Entering Gaussian System, Link 0=/share/apps/gaussian/g16/g16 Initial command: /share/apps/gaussian/g16/l1.exe "/scratch/webmo-13362/515500/Gau-19699.inp" -scrdir="/scratch/webmo-13362/515500/" Entering Link 1 = /share/apps/gaussian/g16/l1.exe PID= 19700. Copyright (c) 1988-2019, Gaussian, Inc. All Rights Reserved. This is part of the Gaussian(R) 16 program. It is based on the Gaussian(R) 09 system (copyright 2009, Gaussian, Inc.), the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.), the Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.), the Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.), the Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.), the Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.), the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.), the Gaussian 86(TM) system (copyright 1986, Carnegie Mellon University), and the Gaussian 82(TM) system (copyright 1983, Carnegie Mellon University). Gaussian is a federally registered trademark of Gaussian, Inc. This software contains proprietary and confidential information, including trade secrets, belonging to Gaussian, Inc. This software is provided under written license and may be used, copied, transmitted, or stored only in accord with that written license. The following legend is applicable only to US Government contracts under FAR: RESTRICTED RIGHTS LEGEND Use, reproduction and disclosure by the US Government is subject to restrictions as set forth in subparagraphs (a) and (c) of the Commercial Computer Software - Restricted Rights clause in FAR 52.227-19. Gaussian, Inc. 340 Quinnipiac St., Bldg. 40, Wallingford CT 06492 --------------------------------------------------------------- Warning -- This program may not be used in any manner that competes with the business of Gaussian, Inc. or will provide assistance to any competitor of Gaussian, Inc. The licensee of this program is prohibited from giving any competitor of Gaussian, Inc. access to this program. By using this program, the user acknowledges that Gaussian, Inc. is engaged in the business of creating and licensing software in the field of computational chemistry and represents and warrants to the licensee that it is not a competitor of Gaussian, Inc. and that it will not use this program in any manner prohibited above. --------------------------------------------------------------- Cite this work as: Gaussian 16, Revision C.01, M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, G. A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A. V. Marenich, J. Bloino, B. G. Janesko, R. Gomperts, B. Mennucci, H. P. Hratchian, J. V. Ortiz, A. F. Izmaylov, J. L. Sonnenberg, D. Williams-Young, F. Ding, F. Lipparini, F. Egidi, J. Goings, B. Peng, A. Petrone, T. Henderson, D. Ranasinghe, V. G. Zakrzewski, J. Gao, N. Rega, G. Zheng, W. Liang, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, T. Vreven, K. Throssell, J. A. Montgomery, Jr., J. E. Peralta, F. Ogliaro, M. J. Bearpark, J. J. Heyd, E. N. Brothers, K. N. Kudin, V. N. Staroverov, T. A. Keith, R. Kobayashi, J. Normand, K. Raghavachari, A. P. Rendell, J. C. Burant, S. S. Iyengar, J. Tomasi, M. Cossi, J. M. Millam, M. Klene, C. Adamo, R. Cammi, J. W. Ochterski, R. L. Martin, K. Morokuma, O. Farkas, J. B. Foresman, and D. J. Fox, Gaussian, Inc., Wallingford CT, 2019. ****************************************** Gaussian 16: ES64L-G16RevC.01 3-Jul-2019 11-Sep-2020 ****************************************** %NProcShared=12 Will use up to 12 processors via shared memory. %mem=6gb ---------------------------------------------------------------------- #N B3LYP/6-31G(d) SP GFINPUT POP=(FULL,NBO6Read) SCRF=(PCM,Solvent=Wat er) Geom=Connectivity ---------------------------------------------------------------------- 1/38=1,57=2,163=2,172=1/1; 2/12=2,17=6,18=5,40=1/2; 3/5=1,6=6,7=1,11=2,24=10,25=1,30=1,70=2201,72=1,74=-5/1,2,3; 4//1; 5/5=2,38=5,53=1/2; 6/7=3,28=1,40=2,113=1,114=1,124=2103,126=1/1,12; 99/5=1,9=1/99; ------------------------------------------------------------ C14H12Br(+1) cis-stilbene bromonium cation (H2O solvent, C1) ------------------------------------------------------------ Symbolic Z-matrix: Charge = 1 Multiplicity = 1 C C 1 B1 H 2 B2 1 A1 Br 1 B3 2 A2 3 D1 0 C 2 B4 1 A3 4 D2 0 C 5 B5 2 A4 1 D3 0 C 6 B6 5 A5 2 D4 0 C 7 B7 6 A6 5 D5 0 C 8 B8 7 A7 6 D6 0 C 5 B9 2 A8 1 D7 0 H 10 B10 5 A9 2 D8 0 H 9 B11 10 A10 5 D9 0 H 8 B12 9 A11 10 D10 0 H 7 B13 8 A12 9 D11 0 H 6 B14 5 A13 2 D12 0 C 1 B15 2 A14 3 D13 0 C 16 B16 1 A15 2 D14 0 C 17 B17 16 A16 1 D15 0 C 18 B18 17 A17 16 D16 0 C 19 B19 18 A18 17 D17 0 C 20 B20 19 A19 18 D18 0 H 21 B21 20 A20 19 D19 0 H 20 B22 19 A21 18 D20 0 H 19 B23 18 A22 17 D21 0 H 18 B24 17 A23 16 D22 0 H 17 B25 16 A24 1 D23 0 H 1 B26 2 A25 3 D24 0 Variables: B1 1.48507 B2 1.09175 B3 2.63624 B4 1.50211 B5 1.40213 B6 1.39402 B7 1.39797 B8 1.39586 B9 1.40285 B10 1.0866 B11 1.08578 B12 1.08599 B13 1.08582 B14 1.0852 B15 1.3953 B16 1.43345 B17 1.37898 B18 1.40694 B19 1.40369 B20 1.37953 B21 1.08523 B22 1.08415 B23 1.08586 B24 1.08431 B25 1.08043 B26 1.08737 A1 107.89397 A2 50.11046 A3 123.81527 A4 123.66662 A5 120.06872 A6 120.26573 A7 119.86307 A8 116.84558 A9 119.97765 A10 119.6134 A11 120.09569 A12 120.18913 A13 119.83373 A14 133.04209 A15 125.38379 A16 119.79067 A17 120.14131 A18 121.39195 A19 119.24858 A20 120.42415 A21 120.23295 A22 119.24192 A23 120.06069 A24 120.11844 A25 111.76182 D1 -104.93705 D2 123.24447 D3 -82.29884 D4 178.50493 D5 0.23841 D6 0.45383 D7 97.48149 D8 1.32814 D9 179.70183 D10 -179.41698 D11 -179.14918 D12 -2.15623 D13 143.21586 D14 -3.73486 D15 -178.89856 D16 0.09929 D17 0.1741 D18 -0.09045 D19 -179.96364 D20 179.80789 D21 179.83611 D22 179.74579 D23 0.49615 D24 -36.22021 Input orientation: --------------------------------------------------------------------- Center Atomic Atomic Coordinates (Angstroms) Number Number Type X Y Z --------------------------------------------------------------------- 1 6 0 0.000000 0.000000 0.000000 2 6 0 0.000000 0.000000 1.485073 3 1 0 1.038940 0.000000 1.820521 4 35 0 -0.521377 1.954390 1.690645 5 6 0 -0.832137 -0.930091 2.321022 6 6 0 -2.182615 -0.705155 2.623669 7 6 0 -2.892814 -1.634958 3.381544 8 6 0 -2.262797 -2.792587 3.847703 9 6 0 -0.914687 -3.013662 3.561085 10 6 0 -0.197741 -2.082228 2.808985 11 1 0 0.853323 -2.255388 2.594543 12 1 0 -0.415038 -3.904359 3.929779 13 1 0 -2.818593 -3.512638 4.440991 14 1 0 -3.937590 -1.450959 3.613054 15 1 0 -2.670452 0.199555 2.275583 16 6 0 -0.816720 -0.610632 -0.952340 17 6 0 -1.894479 -1.511486 -0.666553 18 6 0 -2.615128 -2.068031 -1.702170 19 6 0 -2.292900 -1.754826 -3.035421 20 6 0 -1.239698 -0.880786 -3.347130 21 6 0 -0.507017 -0.316166 -2.323664 22 1 0 0.310892 0.362575 -2.542886 23 1 0 -1.005669 -0.654934 -4.381345 24 1 0 -2.868259 -2.203489 -3.839636 25 1 0 -3.428593 -2.753201 -1.491125 26 1 0 -2.135322 -1.761435 0.356606 27 1 0 0.814723 0.596729 -0.403143 --------------------------------------------------------------------- Distance matrix (angstroms): 1 2 3 4 5 1 C 0.000000 2 C 1.485073 0.000000 3 H 2.096114 1.091752 0.000000 4 Br 2.636239 2.033159 2.504216 0.000000 5 C 2.635273 1.502109 2.148604 2.968868 0.000000 6 C 3.484923 2.560752 3.394217 3.271609 1.402135 7 C 4.740918 3.825973 4.535259 4.622367 2.422382 8 C 5.265322 4.301257 4.775927 5.497202 2.801149 9 C 4.753960 3.772086 3.991037 5.323042 2.426075 10 C 3.502167 2.475383 2.615744 4.201156 1.402850 11 H 3.542117 2.654404 2.391723 4.519852 2.161481 12 H 5.555127 4.625242 4.669801 6.272956 3.407102 13 H 6.324990 5.387072 5.838326 6.536819 3.887136 14 H 5.537513 4.705124 5.484916 5.192549 3.403599 15 H 3.514173 2.792139 3.742525 2.835511 2.158139 16 C 1.395297 2.642137 3.391917 3.694853 3.288950 17 C 2.513550 3.240855 4.132200 4.410679 3.223693 18 C 3.743398 4.612393 5.480722 5.663467 4.545332 19 C 4.189342 5.363924 6.144978 6.263568 5.612977 20 C 3.676399 5.065848 5.715994 5.825237 5.683000 21 C 2.399258 3.855321 4.434435 4.611974 4.696351 22 H 2.587351 4.056177 4.438563 4.598841 5.160921 23 H 4.542741 5.987919 6.562965 6.626627 6.710258 24 H 5.274948 6.436987 7.222115 7.306150 6.612189 25 H 4.643147 5.309719 6.205318 6.382553 4.959615 26 H 2.790954 2.989263 3.914287 4.265189 2.499671 27 H 1.087375 2.141313 2.313232 2.830611 3.530496 6 7 8 9 10 6 C 0.000000 7 C 1.394020 0.000000 8 C 2.421169 1.397974 0.000000 9 C 2.795638 2.417860 1.395859 0.000000 10 C 2.422890 2.791289 2.418264 1.395434 0.000000 11 H 3.408957 3.877866 3.401351 2.152915 1.086602 12 H 3.881386 3.404426 2.158005 1.085784 2.150246 13 H 3.404275 2.157225 1.085990 2.155938 3.402702 14 H 2.148265 1.085821 2.158694 3.403334 3.877047 15 H 1.085195 2.153609 3.404505 3.880720 3.406663 16 C 3.829157 4.913447 5.467401 5.114211 4.086110 17 C 3.399817 4.171212 4.706951 4.592325 3.909480 18 C 4.556027 5.109678 5.608049 5.611378 5.118055 19 C 5.756672 6.446061 6.960981 6.855511 6.217232 20 C 6.047344 6.969693 7.514475 7.237280 6.358214 21 C 5.237847 6.323024 6.877586 6.486366 5.436792 22 H 5.835317 7.025151 7.577503 7.082336 5.905785 23 H 7.103376 8.048864 8.594601 8.285775 7.375010 24 H 6.670039 7.243567 7.733615 7.696980 7.165929 25 H 4.762193 5.027965 5.464771 5.649105 5.420292 26 H 2.501507 3.120904 3.642428 3.650577 3.141862 27 H 4.454271 5.748924 6.247262 5.633905 4.303448 11 12 13 14 15 11 H 0.000000 12 H 2.471983 0.000000 13 H 4.298024 2.488344 0.000000 14 H 4.963599 4.304400 2.487601 0.000000 15 H 4.306445 4.966424 4.300153 2.473592 0.000000 16 C 4.251428 5.902971 6.443381 5.593639 3.809490 17 C 4.328805 5.388957 5.562877 4.742678 3.490839 18 C 5.525124 6.319125 6.314009 5.511922 4.579031 19 C 6.468831 7.527341 7.698246 6.855622 5.671765 20 C 6.447770 7.923096 8.371044 7.486512 5.901618 21 C 5.458925 7.210349 7.830796 6.949906 5.108766 22 H 5.791472 7.786469 8.578199 7.696369 5.668566 23 H 7.394615 8.943288 9.449169 8.552206 6.914937 24 H 7.433137 8.323164 8.383623 7.566528 6.573405 25 H 5.939302 6.308159 6.011560 5.292216 4.845785 26 H 3.766212 4.507667 4.496196 3.734838 2.795410 27 H 4.137896 6.367599 7.318027 6.550369 4.413589 16 17 18 19 20 16 C 0.000000 17 C 1.433449 0.000000 18 C 2.433214 1.378977 0.000000 19 C 2.797770 2.414434 1.406943 0.000000 20 C 2.446817 2.830550 2.450970 1.403689 0.000000 21 C 1.436369 2.469789 2.810590 2.401192 1.379529 22 H 2.179101 3.449115 3.895670 3.392008 2.144081 23 H 3.434493 3.914505 3.430041 2.162924 1.084150 24 H 3.883617 3.390512 2.156661 1.085862 2.155067 25 H 3.420931 2.138990 1.084307 2.161342 3.426653 26 H 2.185497 1.080432 2.136065 3.395692 3.910926 27 H 2.102604 3.442925 4.533464 4.702768 3.882107 21 22 23 24 25 21 C 0.000000 22 H 1.085230 0.000000 23 H 2.144172 2.479635 0.000000 24 H 3.381660 4.286402 2.482078 0.000000 25 H 3.894594 4.979760 4.315861 2.476219 0.000000 26 H 3.453118 4.347694 4.994862 4.282646 2.463789 27 H 2.503752 2.210696 4.550449 5.763251 5.514659 26 27 26 H 0.000000 27 H 3.852392 0.000000 Stoichiometry C14H12Br(1+) Framework group C1[X(C14H12Br)] Deg. of freedom 75 Full point group C1 NOp 1 Largest Abelian subgroup C1 NOp 1 Largest concise Abelian subgroup C1 NOp 1 Standard orientation: --------------------------------------------------------------------- Center Atomic Atomic Coordinates (Angstroms) Number Number Type X Y Z --------------------------------------------------------------------- 1 6 0 0.812619 0.864625 0.890789 2 6 0 -0.670952 0.810789 0.851275 3 1 0 -1.045794 1.186867 1.805204 4 35 0 -0.902605 2.419924 -0.369690 5 6 0 -1.452231 -0.392525 0.406337 6 6 0 -1.708244 -0.699672 -0.937575 7 6 0 -2.416198 -1.854323 -1.267536 8 6 0 -2.878598 -2.708736 -0.262302 9 6 0 -2.638598 -2.399477 1.077542 10 6 0 -1.936710 -1.241003 1.412991 11 1 0 -1.758586 -1.000953 2.457669 12 1 0 -3.004959 -3.051671 1.864530 13 1 0 -3.432998 -3.605315 -0.523381 14 1 0 -2.611869 -2.082595 -2.310902 15 1 0 -1.363253 -0.030825 -1.719415 16 6 0 1.809674 0.027989 0.388021 17 6 0 1.586703 -1.220069 -0.280868 18 6 0 2.661997 -1.967655 -0.712651 19 6 0 3.974168 -1.508618 -0.495903 20 6 0 4.224608 -0.293649 0.160964 21 6 0 3.160801 0.466358 0.601196 22 1 0 3.332467 1.409036 1.110718 23 1 0 5.243485 0.040627 0.320746 24 1 0 4.810186 -2.110309 -0.839616 25 1 0 2.498483 -2.914334 -1.215428 26 1 0 0.579702 -1.578824 -0.437642 27 1 0 1.170081 1.736767 1.432982 --------------------------------------------------------------------- Rotational constants (GHZ): 0.5133014 0.3706463 0.2450159 Standard basis: 6-31G(d) (6D, 7F) AO basis set in the form of general basis input (Overlap normalization): 1 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 2 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 3 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 4 0 S 8 1.00 0.000000000000 0.5743000000D+06 0.2106827531D-03 0.8907000000D+05 0.1612717209D-02 0.2021000000D+05 0.8360109593D-02 0.5736000000D+04 0.3402755882D-01 0.1899000000D+04 0.1085150006D+00 0.6987000000D+03 0.2673969444D+00 0.2778000000D+03 0.4295672215D+00 0.1152000000D+03 0.2869931170D+00 S 2 1.00 0.000000000000 0.3597000000D+02 0.2777729144D+00 0.1550000000D+02 0.7470576360D+00 S 1 1.00 0.000000000000 0.4771000000D+01 0.1000000000D+01 S 1 1.00 0.000000000000 0.2077000000D+01 0.1000000000D+01 S 1 1.00 0.000000000000 0.4211000000D+00 0.1000000000D+01 S 1 1.00 0.000000000000 0.1610000000D+00 0.1000000000D+01 P 6 1.00 0.000000000000 0.4406000000D+04 0.1395526229D-02 0.1042000000D+04 0.1237482833D-01 0.3321000000D+03 0.6101752413D-01 0.1219000000D+03 0.2267755466D+00 0.4924000000D+02 0.4059758745D+00 0.2116000000D+02 0.4506923223D+00 P 3 1.00 0.000000000000 0.8836000000D+01 0.2920185849D+00 0.3829000000D+01 0.5302208617D+00 0.1643000000D+01 0.2752874045D+00 P 1 1.00 0.000000000000 0.4650000000D+00 0.1000000000D+01 P 1 1.00 0.000000000000 0.1427000000D+00 0.1000000000D+01 D 5 1.00 0.000000000000 0.1084000000D+03 0.2158793714D-01 0.3071000000D+02 0.1341760360D+00 0.1066000000D+02 0.3678706466D+00 0.3851000000D+01 0.4918952062D+00 0.1317000000D+01 0.2683219787D+00 D 1 1.00 0.000000000000 0.3380000000D+00 0.1000000000D+01 **** 5 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 6 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 7 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 8 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 9 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 10 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 11 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 12 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 13 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 14 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 15 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 16 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 17 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 18 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 19 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 20 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 21 0 S 6 1.00 0.000000000000 0.3047524880D+04 0.1834737132D-02 0.4573695180D+03 0.1403732281D-01 0.1039486850D+03 0.6884262226D-01 0.2921015530D+02 0.2321844432D+00 0.9286662960D+01 0.4679413484D+00 0.3163926960D+01 0.3623119853D+00 SP 3 1.00 0.000000000000 0.7868272350D+01 -0.1193324198D+00 0.6899906659D-01 0.1881288540D+01 -0.1608541517D+00 0.3164239610D+00 0.5442492580D+00 0.1143456438D+01 0.7443082909D+00 SP 1 1.00 0.000000000000 0.1687144782D+00 0.1000000000D+01 0.1000000000D+01 D 1 1.00 0.000000000000 0.8000000000D+00 0.1000000000D+01 **** 22 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 23 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 24 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 25 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 26 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** 27 0 S 3 1.00 0.000000000000 0.1873113696D+02 0.3349460434D-01 0.2825394365D+01 0.2347269535D+00 0.6401216923D+00 0.8137573261D+00 S 1 1.00 0.000000000000 0.1612777588D+00 0.1000000000D+01 **** There are 264 symmetry adapted cartesian basis functions of A symmetry. There are 264 symmetry adapted basis functions of A symmetry. 264 basis functions, 523 primitive gaussians, 264 cartesian basis functions 65 alpha electrons 65 beta electrons nuclear repulsion energy 1208.4771236026 Hartrees. NAtoms= 27 NActive= 27 NUniq= 27 SFac= 1.00D+00 NAtFMM= 60 NAOKFM=F Big=F Integral buffers will be 131072 words long. Raffenetti 2 integral format. Two-electron integral symmetry is turned on. ------------------------------------------------------------------------------ Polarizable Continuum Model (PCM) ================================= Model : PCM. Atomic radii : UFF (Universal Force Field). Polarization charges : Total charges. Charge compensation : None. Solution method : On-the-fly selection. Cavity type : Scaled VdW (van der Waals Surface) (Alpha=1.100). Cavity algorithm : GePol (No added spheres) Default sphere list used, NSphG= 27. Lebedev-Laikov grids with approx. 5.0 points / Ang**2. Smoothing algorithm: York/Karplus (Gamma=1.0000). Polarization charges: spherical gaussians, with point-specific exponents (IZeta= 3). Self-potential: point-specific (ISelfS= 7). Self-field : sphere-specific E.n sum rule (ISelfD= 2). Solvent : Water, Eps= 78.355300 Eps(inf)= 1.777849 ------------------------------------------------------------------------------ One-electron integrals computed using PRISM. NBasis= 264 RedAO= T EigKep= 4.63D-04 NBF= 264 NBsUse= 264 1.00D-06 EigRej= -1.00D+00 NBFU= 264 ExpMin= 1.43D-01 ExpMax= 5.74D+05 ExpMxC= 5.74D+03 IAcc=3 IRadAn= 5 AccDes= 0.00D+00 Harris functional with IExCor= 402 and IRadAn= 5 diagonalized for initial guess. HarFok: IExCor= 402 AccDes= 0.00D+00 IRadAn= 5 IDoV= 1 UseB2=F ITyADJ=14 ICtDFT= 3500011 ScaDFX= 1.000000 1.000000 1.000000 1.000000 FoFCou: FMM=F IPFlag= 0 FMFlag= 100000 FMFlg1= 0 NFxFlg= 0 DoJE=T BraDBF=F KetDBF=T FulRan=T wScrn= 0.000000 ICntrl= 500 IOpCl= 0 I1Cent= 200000004 NGrid= 0 NMat0= 1 NMatS0= 1 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0 Petite list used in FoFCou. Requested convergence on RMS density matrix=1.00D-08 within 128 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. Inv3: Mode=1 IEnd= 14427747. Iteration 1 A*A^-1 deviation from unit magnitude is 8.88D-15 for 910. Iteration 1 A*A^-1 deviation from orthogonality is 4.72D-15 for 1220 463. Iteration 1 A^-1*A deviation from unit magnitude is 9.55D-15 for 152. Iteration 1 A^-1*A deviation from orthogonality is 2.00D-15 for 1001 369. Error on total polarization charges = 0.00931 SCF Done: E(RB3LYP) = -3112.21370533 A.U. after 14 cycles NFock= 14 Conv=0.38D-08 -V/T= 2.0068 ********************************************************************** Population analysis using the SCF Density. ********************************************************************** Orbital symmetries: Occupied (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) Virtual (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) The electronic state is 1-A. Alpha occ. eigenvalues -- -482.94259 -61.90420 -56.42496 -56.42090 -56.42057 Alpha occ. eigenvalues -- -10.30752 -10.29869 -10.26153 -10.25579 -10.25416 Alpha occ. eigenvalues -- -10.25007 -10.23401 -10.23362 -10.22890 -10.21242 Alpha occ. eigenvalues -- -10.21019 -10.20701 -10.20638 -10.20605 -8.61466 Alpha occ. eigenvalues -- -6.56887 -6.55593 -6.55455 -2.68433 -2.68110 Alpha occ. eigenvalues -- -2.67999 -2.66968 -2.66965 -0.91912 -0.89096 Alpha occ. eigenvalues -- -0.86060 -0.81755 -0.79715 -0.77333 -0.76279 Alpha occ. eigenvalues -- -0.74286 -0.68625 -0.65245 -0.63215 -0.62372 Alpha occ. eigenvalues -- -0.59427 -0.55832 -0.53260 -0.52763 -0.50703 Alpha occ. eigenvalues -- -0.48896 -0.47627 -0.46984 -0.46000 -0.45902 Alpha occ. eigenvalues -- -0.43819 -0.43283 -0.42930 -0.40851 -0.40373 Alpha occ. eigenvalues -- -0.39054 -0.37105 -0.36575 -0.36011 -0.33357 Alpha occ. eigenvalues -- -0.31180 -0.30562 -0.30043 -0.26916 -0.26706 Alpha virt. eigenvalues -- -0.16594 -0.06298 -0.04224 -0.02343 -0.01650 Alpha virt. eigenvalues -- 0.00125 0.06543 0.08247 0.09420 0.11577 Alpha virt. eigenvalues -- 0.11951 0.12985 0.13637 0.14049 0.15223 Alpha virt. eigenvalues -- 0.15352 0.16830 0.17604 0.18029 0.18940 Alpha virt. eigenvalues -- 0.19541 0.21359 0.23943 0.26399 0.27087 Alpha virt. eigenvalues -- 0.27940 0.28619 0.29193 0.30161 0.31824 Alpha virt. eigenvalues -- 0.33106 0.36934 0.39680 0.39945 0.41951 Alpha virt. eigenvalues -- 0.42702 0.43965 0.45216 0.46519 0.47204 Alpha virt. eigenvalues -- 0.47875 0.48807 0.49595 0.51095 0.51709 Alpha virt. eigenvalues -- 0.52041 0.52472 0.53374 0.54212 0.54907 Alpha virt. eigenvalues -- 0.55666 0.56351 0.56774 0.57529 0.57759 Alpha virt. eigenvalues -- 0.57994 0.58131 0.58885 0.59634 0.60064 Alpha virt. eigenvalues -- 0.60388 0.61085 0.62204 0.64152 0.64705 Alpha virt. eigenvalues -- 0.69078 0.69401 0.71978 0.75119 0.76107 Alpha virt. eigenvalues -- 0.79122 0.80079 0.80407 0.80982 0.82167 Alpha virt. eigenvalues -- 0.82619 0.82994 0.84088 0.84222 0.86476 Alpha virt. eigenvalues -- 0.86953 0.87274 0.88208 0.89797 0.90869 Alpha virt. eigenvalues -- 0.91126 0.92134 0.94124 0.95779 0.96380 Alpha virt. eigenvalues -- 0.99760 1.00352 1.01784 1.07179 1.08888 Alpha virt. eigenvalues -- 1.09775 1.11449 1.13380 1.14548 1.15323 Alpha virt. eigenvalues -- 1.18239 1.19935 1.20480 1.23219 1.25056 Alpha virt. eigenvalues -- 1.27467 1.32645 1.38521 1.38648 1.39139 Alpha virt. eigenvalues -- 1.41376 1.42413 1.43490 1.44203 1.44659 Alpha virt. eigenvalues -- 1.45559 1.46126 1.46407 1.48180 1.49485 Alpha virt. eigenvalues -- 1.53128 1.54604 1.58914 1.67875 1.69164 Alpha virt. eigenvalues -- 1.73611 1.75552 1.79338 1.80496 1.81904 Alpha virt. eigenvalues -- 1.83818 1.86673 1.87148 1.88657 1.89417 Alpha virt. eigenvalues -- 1.91574 1.92148 1.93438 1.95902 1.99076 Alpha virt. eigenvalues -- 1.99691 2.02147 2.04584 2.07632 2.09180 Alpha virt. eigenvalues -- 2.10596 2.11230 2.11932 2.13937 2.15534 Alpha virt. eigenvalues -- 2.17697 2.18975 2.22978 2.24127 2.25615 Alpha virt. eigenvalues -- 2.27147 2.28774 2.29412 2.31588 2.39060 Alpha virt. eigenvalues -- 2.42039 2.44115 2.51635 2.54842 2.56667 Alpha virt. eigenvalues -- 2.57055 2.59048 2.60387 2.63696 2.67727 Alpha virt. eigenvalues -- 2.69363 2.70691 2.71031 2.72560 2.73875 Alpha virt. eigenvalues -- 2.75717 2.80248 2.84045 2.95330 3.03556 Alpha virt. eigenvalues -- 3.10908 3.35184 3.39048 4.02134 4.04768 Alpha virt. eigenvalues -- 4.07181 4.08642 4.11018 4.13591 4.21211 Alpha virt. eigenvalues -- 4.28034 4.29569 4.32389 4.38150 4.46293 Alpha virt. eigenvalues -- 4.66419 4.69567 8.61666 73.51206 Molecular Orbital Coefficients: 1 2 3 4 5 O O O O O Eigenvalues -- -482.94259 -61.90420 -56.42496 -56.42090 -56.42057 1 1 C 1S -0.00002 -0.00021 -0.00030 0.00002 -0.00016 2 2S -0.00009 -0.00082 -0.00184 0.00026 -0.00061 3 2PX -0.00005 -0.00040 -0.00005 0.00018 -0.00008 4 2PY 0.00005 0.00047 0.00029 0.00006 0.00008 5 2PZ 0.00006 0.00053 0.00020 -0.00008 0.00013 6 3S 0.00074 0.00648 0.01524 0.00133 0.00510 7 3PX -0.00043 -0.00371 -0.00728 -0.00057 0.00195 8 3PY -0.00041 -0.00356 -0.00284 -0.00225 -0.00182 9 3PZ -0.00062 -0.00537 -0.00550 0.00001 -0.00183 10 4XX -0.00001 -0.00007 0.00026 0.00003 -0.00017 11 4YY -0.00003 -0.00025 -0.00021 -0.00015 -0.00034 12 4ZZ -0.00003 -0.00022 -0.00026 -0.00004 -0.00019 13 4XY -0.00001 -0.00008 -0.00049 0.00012 -0.00014 14 4XZ -0.00002 -0.00014 0.00051 -0.00006 0.00005 15 4YZ 0.00002 0.00020 0.00003 0.00009 0.00004 16 2 C 1S 0.00004 0.00032 0.00073 0.00009 0.00002 17 2S 0.00026 0.00230 0.00388 0.00053 0.00004 18 2PX 0.00006 0.00052 0.00009 -0.00004 -0.00001 19 2PY -0.00015 -0.00129 0.00063 -0.00004 -0.00007 20 2PZ 0.00008 0.00067 -0.00078 -0.00006 -0.00036 21 3S -0.00137 -0.01186 -0.02255 -0.00475 -0.00062 22 3PX -0.00017 -0.00152 -0.00528 0.00048 0.00031 23 3PY 0.00073 0.00633 0.00224 0.00251 0.00203 24 3PZ 0.00022 0.00189 0.00742 0.00052 0.00172 25 4XX -0.00003 -0.00026 0.00071 0.00010 -0.00001 26 4YY -0.00014 -0.00119 0.00036 -0.00010 -0.00007 27 4ZZ -0.00001 -0.00013 0.00099 0.00013 0.00020 28 4XY -0.00001 -0.00010 -0.00001 -0.00006 -0.00001 29 4XZ -0.00001 -0.00011 -0.00025 -0.00007 0.00002 30 4YZ 0.00011 0.00094 0.00087 0.00001 -0.00011 31 3 H 1S -0.00002 -0.00020 -0.00034 -0.00002 -0.00003 32 2S 0.00027 0.00230 0.00030 0.00028 -0.00188 33 4 Br 1S 0.99479 -0.42154 -0.00012 0.00001 0.00009 34 2S 0.03201 1.16632 0.00204 0.00012 0.00018 35 3S -0.04242 -0.27666 -0.00425 -0.00034 -0.00099 36 4S -0.04263 -0.39814 -0.00270 -0.00023 -0.00062 37 5S -0.02401 -0.20806 0.00286 0.00012 0.00140 38 6S -0.01959 -0.17015 -0.01636 -0.00127 -0.00579 39 7PX 0.00000 0.00015 -0.20290 0.93038 -0.21900 40 7PY -0.00002 -0.00068 0.77262 0.29145 0.52214 41 7PZ 0.00001 0.00055 -0.56245 0.06474 0.79633 42 8PX -0.00001 -0.00011 -0.01282 0.05828 -0.01370 43 8PY 0.00008 0.00060 0.04886 0.01830 0.03280 44 8PZ -0.00003 -0.00020 -0.03547 0.00408 0.04986 45 9PX 0.00007 0.00062 0.00429 -0.01739 0.00403 46 9PY -0.00035 -0.00303 -0.01648 -0.00563 -0.01027 47 9PZ 0.00013 0.00110 0.01152 -0.00133 -0.01477 48 10PX -0.00015 -0.00128 -0.00221 0.00797 -0.00177 49 10PY 0.00063 0.00548 0.00754 0.00270 0.00549 50 10PZ -0.00029 -0.00249 -0.00509 0.00067 0.00634 51 11XX 0.04059 0.35771 0.00411 0.00030 0.00091 52 11YY 0.04060 0.35780 0.00404 0.00034 0.00096 53 11ZZ 0.04059 0.35774 0.00403 0.00034 0.00095 54 11XY -0.00000 -0.00002 0.00002 0.00002 0.00000 55 11XZ 0.00001 0.00007 0.00003 -0.00000 0.00001 56 11YZ -0.00000 -0.00004 0.00001 0.00002 0.00000 57 12XX 0.01066 0.09238 0.00537 0.00066 0.00178 58 12YY 0.01064 0.09217 0.00643 0.00027 0.00132 59 12ZZ 0.01064 0.09221 0.00607 0.00032 0.00173 60 12XY 0.00001 0.00008 -0.00021 -0.00031 0.00004 61 12XZ -0.00004 -0.00039 -0.00016 0.00017 -0.00009 62 12YZ 0.00001 0.00009 -0.00033 -0.00009 -0.00005 63 5 C 1S -0.00001 -0.00009 -0.00016 -0.00011 0.00003 64 2S -0.00010 -0.00086 -0.00055 -0.00042 0.00018 65 2PX 0.00001 0.00011 -0.00027 0.00011 -0.00000 66 2PY -0.00001 -0.00013 -0.00059 -0.00026 -0.00005 67 2PZ 0.00001 0.00009 0.00050 -0.00002 0.00016 68 3S -0.00013 -0.00117 0.00196 0.00285 -0.00439 69 3PX 0.00063 0.00548 0.00721 0.00134 0.00219 70 3PY 0.00100 0.00866 0.01100 0.00293 0.00315 71 3PZ 0.00096 0.00826 -0.00556 0.00274 0.00152 72 4XX 0.00000 0.00003 -0.00033 -0.00022 0.00003 73 4YY 0.00007 0.00061 -0.00026 0.00000 0.00011 74 4ZZ -0.00004 -0.00031 -0.00026 -0.00025 -0.00017 75 4XY 0.00004 0.00035 0.00018 0.00014 0.00001 76 4XZ -0.00001 -0.00005 0.00026 0.00001 -0.00000 77 4YZ -0.00003 -0.00025 0.00012 -0.00001 0.00000 78 6 C 1S -0.00002 -0.00013 -0.00004 -0.00005 -0.00002 79 2S -0.00010 -0.00086 0.00013 -0.00014 -0.00008 80 2PX 0.00001 0.00007 -0.00026 0.00011 -0.00004 81 2PY -0.00005 -0.00040 -0.00040 -0.00026 -0.00022 82 2PZ -0.00006 -0.00050 -0.00031 -0.00006 -0.00031 83 3S 0.00054 0.00450 -0.00480 0.00101 -0.00075 84 3PX 0.00006 0.00055 -0.00002 0.00018 0.00086 85 3PY 0.00024 0.00209 0.00013 0.00125 0.00168 86 3PZ 0.00133 0.01155 0.00158 0.00202 0.00545 87 4XX -0.00005 -0.00043 -0.00035 -0.00022 -0.00019 88 4YY -0.00001 -0.00008 -0.00046 -0.00020 -0.00021 89 4ZZ 0.00005 0.00039 0.00009 0.00007 0.00028 90 4XY 0.00000 0.00003 -0.00021 -0.00003 -0.00011 91 4XZ 0.00001 0.00006 -0.00017 0.00001 -0.00001 92 4YZ -0.00000 -0.00001 -0.00031 -0.00008 -0.00005 93 7 C 1S -0.00000 -0.00002 -0.00009 -0.00002 -0.00004 94 2S -0.00002 -0.00017 -0.00050 -0.00014 -0.00023 95 2PX -0.00001 -0.00005 0.00004 -0.00003 0.00000 96 2PY 0.00001 0.00007 0.00012 0.00006 0.00007 97 2PZ 0.00001 0.00005 -0.00013 0.00000 0.00004 98 3S 0.00010 0.00099 0.00247 0.00123 0.00249 99 3PX 0.00024 0.00214 0.00121 0.00078 0.00145 100 3PY 0.00032 0.00281 0.00179 0.00062 0.00210 101 3PZ -0.00041 -0.00353 0.00113 0.00012 -0.00114 102 4XX 0.00001 0.00006 -0.00012 0.00003 -0.00001 103 4YY 0.00001 0.00008 0.00009 0.00003 0.00008 104 4ZZ -0.00000 -0.00003 -0.00009 0.00001 -0.00006 105 4XY 0.00002 0.00014 0.00025 0.00009 0.00014 106 4XZ 0.00000 0.00001 0.00005 0.00003 0.00002 107 4YZ -0.00001 -0.00006 0.00007 -0.00001 -0.00000 108 8 C 1S -0.00000 -0.00002 -0.00002 0.00000 0.00000 109 2S -0.00001 -0.00010 -0.00007 0.00003 0.00000 110 2PX -0.00000 -0.00000 -0.00004 -0.00001 0.00002 111 2PY -0.00000 -0.00000 -0.00008 -0.00002 0.00003 112 2PZ 0.00000 0.00001 0.00018 -0.00001 0.00005 113 3S 0.00030 0.00256 0.00114 -0.00069 0.00126 114 3PX 0.00008 0.00067 0.00027 -0.00024 -0.00006 115 3PY 0.00017 0.00145 0.00042 -0.00020 0.00013 116 3PZ -0.00022 -0.00193 -0.00031 -0.00058 -0.00085 117 4XX -0.00000 -0.00003 -0.00006 -0.00001 0.00000 118 4YY 0.00000 0.00002 -0.00005 0.00001 0.00002 119 4ZZ -0.00000 -0.00002 0.00002 -0.00002 0.00000 120 4XY 0.00000 0.00002 0.00001 -0.00001 -0.00000 121 4XZ 0.00000 0.00002 0.00003 0.00001 0.00000 122 4YZ -0.00001 -0.00005 0.00001 -0.00002 -0.00001 123 9 C 1S 0.00000 0.00000 0.00003 -0.00002 -0.00000 124 2S 0.00000 0.00003 0.00020 -0.00011 -0.00001 125 2PX -0.00001 -0.00005 -0.00011 -0.00003 -0.00004 126 2PY -0.00001 -0.00013 -0.00023 -0.00004 -0.00004 127 2PZ 0.00000 0.00003 -0.00012 0.00003 -0.00005 128 3S -0.00045 -0.00389 -0.00459 0.00025 -0.00045 129 3PX -0.00018 -0.00154 -0.00139 -0.00006 -0.00023 130 3PY -0.00024 -0.00214 -0.00207 0.00005 -0.00054 131 3PZ -0.00015 -0.00126 0.00112 -0.00098 0.00031 132 4XX -0.00001 -0.00007 -0.00004 -0.00006 -0.00001 133 4YY -0.00000 -0.00004 -0.00007 -0.00002 -0.00002 134 4ZZ 0.00001 0.00006 0.00005 0.00001 0.00002 135 4XY -0.00001 -0.00005 -0.00009 0.00002 0.00000 136 4XZ -0.00000 -0.00003 -0.00001 -0.00001 -0.00000 137 4YZ -0.00000 -0.00003 -0.00002 0.00000 0.00001 138 10 C 1S -0.00000 -0.00001 -0.00013 0.00002 -0.00003 139 2S -0.00000 -0.00004 -0.00077 0.00007 -0.00019 140 2PX -0.00000 -0.00004 0.00010 -0.00002 0.00003 141 2PY 0.00002 0.00022 0.00038 0.00006 0.00004 142 2PZ -0.00000 -0.00002 -0.00007 -0.00002 0.00000 143 3S 0.00036 0.00325 0.01220 -0.00088 0.00254 144 3PX -0.00027 -0.00232 -0.00042 -0.00047 -0.00014 145 3PY -0.00056 -0.00487 -0.00089 -0.00134 0.00002 146 3PZ -0.00029 -0.00257 -0.00650 -0.00012 -0.00217 147 4XX 0.00000 0.00002 -0.00017 0.00005 -0.00006 148 4YY -0.00001 -0.00010 -0.00000 -0.00001 -0.00003 149 4ZZ 0.00000 0.00001 0.00013 0.00009 0.00006 150 4XY -0.00000 -0.00001 0.00021 -0.00002 0.00002 151 4XZ 0.00001 0.00007 0.00000 -0.00002 -0.00002 152 4YZ 0.00002 0.00015 -0.00008 0.00004 -0.00006 153 11 H 1S 0.00004 0.00038 0.00025 0.00007 -0.00000 154 2S 0.00011 0.00097 0.00138 0.00035 0.00091 155 12 H 1S 0.00001 0.00007 -0.00007 0.00006 -0.00005 156 2S 0.00001 0.00006 -0.00044 0.00029 -0.00016 157 13 H 1S -0.00000 -0.00001 -0.00002 -0.00002 -0.00008 158 2S 0.00003 0.00024 0.00011 -0.00008 -0.00012 159 14 H 1S -0.00003 -0.00023 0.00004 -0.00001 -0.00013 160 2S -0.00013 -0.00108 0.00055 0.00010 -0.00040 161 15 H 1S -0.00006 -0.00055 -0.00016 -0.00024 -0.00045 162 2S 0.00086 0.00745 0.00214 0.00102 0.00385 163 16 C 1S -0.00002 -0.00014 0.00001 0.00004 0.00001 164 2S -0.00000 -0.00004 0.00029 0.00012 0.00020 165 2PX 0.00005 0.00044 0.00004 -0.00016 0.00009 166 2PY -0.00006 -0.00050 -0.00014 0.00002 -0.00008 167 2PZ 0.00002 0.00018 -0.00004 -0.00005 0.00012 168 3S -0.00005 -0.00049 -0.00255 -0.00198 -0.00332 169 3PX 0.00023 0.00204 0.00439 0.00195 0.00127 170 3PY 0.00024 0.00203 -0.00078 0.00038 -0.00207 171 3PZ 0.00010 0.00082 0.00047 -0.00007 -0.00151 172 4XX -0.00008 -0.00066 -0.00031 0.00011 -0.00016 173 4YY -0.00007 -0.00056 -0.00011 0.00009 -0.00007 174 4ZZ -0.00004 -0.00032 0.00003 0.00008 -0.00000 175 4XY 0.00001 0.00012 0.00018 0.00001 0.00007 176 4XZ -0.00001 -0.00010 -0.00000 0.00005 -0.00000 177 4YZ 0.00002 0.00014 0.00007 -0.00006 0.00001 178 17 C 1S 0.00000 0.00002 -0.00001 -0.00001 0.00002 179 2S -0.00000 -0.00003 -0.00010 -0.00006 0.00005 180 2PX -0.00002 -0.00013 -0.00012 -0.00005 -0.00005 181 2PY 0.00001 0.00010 0.00014 0.00001 0.00004 182 2PZ 0.00001 0.00007 0.00010 0.00000 -0.00001 183 3S 0.00028 0.00244 0.00287 0.00077 -0.00040 184 3PX 0.00024 0.00209 0.00089 0.00004 0.00028 185 3PY -0.00001 -0.00006 -0.00088 0.00070 -0.00089 186 3PZ 0.00001 0.00012 -0.00076 0.00042 -0.00025 187 4XX 0.00001 0.00007 0.00004 -0.00000 0.00003 188 4YY 0.00001 0.00007 0.00004 0.00004 0.00000 189 4ZZ 0.00002 0.00014 0.00001 0.00001 0.00007 190 4XY -0.00000 -0.00003 -0.00013 -0.00004 -0.00006 191 4XZ -0.00000 -0.00003 -0.00012 -0.00001 -0.00003 192 4YZ 0.00001 0.00006 -0.00002 0.00003 -0.00000 193 18 C 1S 0.00000 0.00003 0.00004 0.00000 0.00002 194 2S 0.00002 0.00020 0.00025 0.00002 0.00010 195 2PX 0.00001 0.00005 0.00007 0.00004 0.00000 196 2PY -0.00000 -0.00002 -0.00000 0.00002 0.00001 197 2PZ -0.00000 -0.00000 0.00001 0.00000 0.00001 198 3S -0.00032 -0.00280 -0.00233 0.00033 -0.00083 199 3PX 0.00001 0.00011 0.00098 -0.00015 0.00035 200 3PY -0.00015 -0.00131 -0.00121 -0.00018 -0.00042 201 3PZ -0.00009 -0.00080 -0.00065 -0.00009 -0.00034 202 4XX -0.00000 -0.00004 -0.00004 0.00001 -0.00002 203 4YY -0.00000 -0.00000 0.00001 -0.00001 0.00001 204 4ZZ 0.00000 0.00004 0.00008 0.00001 0.00003 205 4XY 0.00000 0.00003 0.00007 0.00001 0.00002 206 4XZ 0.00000 0.00002 0.00003 0.00001 0.00002 207 4YZ -0.00001 -0.00005 -0.00006 -0.00001 -0.00004 208 19 C 1S -0.00000 -0.00001 -0.00000 0.00001 0.00000 209 2S -0.00001 -0.00007 -0.00003 0.00003 -0.00001 210 2PX -0.00000 -0.00002 -0.00006 -0.00004 -0.00002 211 2PY -0.00000 -0.00002 -0.00005 -0.00002 0.00002 212 2PZ -0.00000 -0.00002 -0.00001 -0.00001 0.00000 213 3S 0.00011 0.00096 0.00050 -0.00019 0.00046 214 3PX -0.00011 -0.00098 -0.00000 0.00038 -0.00008 215 3PY 0.00003 0.00023 0.00056 -0.00014 0.00027 216 3PZ 0.00003 0.00024 0.00032 -0.00008 0.00023 217 4XX 0.00000 0.00002 0.00001 0.00001 0.00000 218 4YY -0.00000 -0.00001 -0.00000 0.00000 0.00001 219 4ZZ -0.00000 -0.00001 0.00001 0.00001 0.00002 220 4XY 0.00000 0.00001 -0.00000 -0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00001 -0.00000 -0.00000 222 4YZ 0.00000 0.00001 0.00001 -0.00001 0.00000 223 20 C 1S 0.00000 0.00003 0.00000 -0.00002 0.00002 224 2S 0.00002 0.00016 -0.00001 -0.00013 0.00009 225 2PX 0.00000 0.00001 -0.00008 -0.00004 -0.00003 226 2PY 0.00000 0.00001 0.00004 0.00004 -0.00001 227 2PZ 0.00000 0.00003 0.00007 0.00001 0.00001 228 3S -0.00026 -0.00220 0.00126 0.00202 -0.00045 229 3PX 0.00011 0.00092 -0.00068 -0.00103 0.00042 230 3PY -0.00008 -0.00067 0.00071 0.00042 0.00036 231 3PZ -0.00007 -0.00057 0.00023 0.00027 0.00006 232 4XX -0.00000 -0.00001 0.00004 0.00003 -0.00001 233 4YY -0.00000 -0.00000 -0.00001 -0.00000 0.00001 234 4ZZ 0.00000 0.00004 0.00001 -0.00003 0.00003 235 4XY 0.00000 0.00002 -0.00004 -0.00004 -0.00000 236 4XZ 0.00000 0.00003 -0.00000 -0.00003 0.00001 237 4YZ -0.00001 -0.00005 -0.00001 0.00003 -0.00003 238 21 C 1S 0.00000 0.00000 -0.00000 0.00001 0.00001 239 2S -0.00000 -0.00003 0.00001 0.00011 -0.00001 240 2PX -0.00002 -0.00014 0.00010 0.00013 -0.00004 241 2PY -0.00000 -0.00002 -0.00005 -0.00004 0.00003 242 2PZ -0.00001 -0.00006 -0.00013 -0.00002 -0.00003 243 3S 0.00001 0.00007 -0.00236 -0.00231 0.00050 244 3PX 0.00029 0.00246 -0.00067 -0.00093 -0.00037 245 3PY -0.00005 -0.00040 0.00203 0.00119 -0.00004 246 3PZ 0.00001 0.00011 0.00126 0.00068 0.00025 247 4XX 0.00001 0.00006 0.00003 -0.00005 0.00008 248 4YY 0.00001 0.00004 -0.00006 -0.00001 0.00001 249 4ZZ 0.00000 0.00003 0.00001 -0.00001 0.00001 250 4XY 0.00000 0.00001 0.00001 0.00005 -0.00000 251 4XZ -0.00001 -0.00007 0.00001 0.00004 -0.00003 252 4YZ 0.00000 0.00001 0.00000 -0.00003 -0.00003 253 22 H 1S 0.00002 0.00019 -0.00012 -0.00014 -0.00002 254 2S -0.00009 -0.00077 -0.00088 -0.00002 -0.00001 255 23 H 1S 0.00000 0.00004 -0.00002 -0.00001 -0.00002 256 2S -0.00001 -0.00005 0.00003 0.00014 -0.00020 257 24 H 1S 0.00001 0.00006 0.00002 -0.00004 0.00001 258 2S 0.00003 0.00023 0.00009 -0.00012 0.00004 259 25 H 1S -0.00000 -0.00001 -0.00001 -0.00003 -0.00000 260 2S -0.00005 -0.00040 -0.00031 -0.00013 -0.00017 261 26 H 1S 0.00002 0.00014 0.00012 -0.00003 0.00007 262 2S 0.00007 0.00064 -0.00076 0.00027 -0.00010 263 27 H 1S -0.00003 -0.00026 -0.00019 0.00058 0.00013 264 2S 0.00060 0.00518 0.00252 -0.00061 -0.00039 6 7 8 9 10 O O O O O Eigenvalues -- -10.30752 -10.29869 -10.26153 -10.25579 -10.25416 1 1 C 1S 0.99277 -0.01681 -0.00618 -0.00000 0.00013 2 2S 0.04943 -0.00126 -0.00073 -0.00003 -0.00015 3 2PX -0.00025 0.00027 -0.00028 0.00004 0.00002 4 2PY -0.00002 0.00017 0.00028 -0.00002 -0.00005 5 2PZ -0.00035 0.00001 0.00017 -0.00001 -0.00003 6 3S -0.01652 0.00895 0.00472 0.00145 0.00168 7 3PX 0.00094 -0.00386 0.00117 0.00037 0.00063 8 3PY 0.00177 -0.00232 -0.00156 -0.00045 -0.00058 9 3PZ 0.00168 -0.00151 -0.00084 -0.00028 -0.00035 10 4XX -0.00886 -0.00026 -0.00038 0.00002 0.00011 11 4YY -0.00913 0.00002 -0.00026 0.00001 0.00005 12 4ZZ -0.00923 0.00001 -0.00016 0.00000 -0.00001 13 4XY -0.00018 -0.00001 0.00016 -0.00001 -0.00003 14 4XZ -0.00009 0.00005 0.00010 -0.00001 -0.00002 15 4YZ 0.00016 0.00007 -0.00011 0.00001 0.00006 16 2 C 1S 0.01656 0.99313 0.00007 0.00000 -0.00001 17 2S 0.00080 0.05070 0.00007 0.00001 -0.00002 18 2PX -0.00018 0.00028 -0.00005 -0.00002 -0.00003 19 2PY 0.00016 0.00044 0.00001 -0.00000 0.00001 20 2PZ -0.00003 -0.00052 0.00002 -0.00000 0.00001 21 3S 0.00331 -0.02558 -0.00112 -0.00013 0.00002 22 3PX 0.00186 -0.00184 0.00006 0.00004 0.00023 23 3PY -0.00201 0.00137 0.00055 0.00013 0.00018 24 3PZ 0.00017 0.00295 0.00020 0.00006 0.00002 25 4XX -0.00063 -0.00862 0.00007 -0.00001 -0.00003 26 4YY -0.00025 -0.00878 0.00002 -0.00000 -0.00002 27 4ZZ -0.00027 -0.00858 0.00002 0.00000 -0.00002 28 4XY -0.00008 0.00006 0.00002 -0.00000 -0.00001 29 4XZ -0.00009 -0.00009 0.00002 0.00000 -0.00001 30 4YZ 0.00010 0.00011 0.00000 -0.00000 -0.00000 31 3 H 1S -0.00007 0.00013 0.00004 -0.00000 -0.00000 32 2S 0.00041 0.00210 0.00002 -0.00000 0.00004 33 4 Br 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 34 2S -0.00005 0.00000 -0.00004 -0.00000 0.00000 35 3S 0.00017 -0.00000 0.00014 0.00000 -0.00000 36 4S 0.00003 -0.00007 0.00003 0.00000 0.00000 37 5S -0.00169 -0.00091 -0.00004 0.00001 0.00003 38 6S 0.00450 0.00377 0.00052 -0.00002 -0.00008 39 7PX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 40 7PY 0.00001 -0.00002 0.00000 -0.00000 0.00000 41 7PZ 0.00000 0.00001 0.00000 -0.00000 -0.00000 42 8PX 0.00001 -0.00001 0.00001 0.00000 0.00000 43 8PY -0.00003 0.00008 -0.00001 0.00000 0.00000 44 8PZ -0.00001 -0.00005 -0.00000 0.00000 0.00000 45 9PX -0.00017 0.00008 -0.00005 -0.00000 0.00000 46 9PY 0.00026 -0.00044 0.00003 -0.00000 -0.00000 47 9PZ -0.00003 0.00030 -0.00000 -0.00000 -0.00001 48 10PX 0.00077 0.00019 0.00005 -0.00000 -0.00002 49 10PY -0.00124 -0.00180 -0.00007 0.00001 0.00004 50 10PZ 0.00074 0.00112 0.00002 -0.00001 -0.00001 51 11XX -0.00014 0.00005 -0.00010 -0.00000 0.00000 52 11YY -0.00013 -0.00000 -0.00011 -0.00000 0.00000 53 11ZZ -0.00011 0.00003 -0.00011 -0.00000 -0.00000 54 11XY 0.00005 0.00001 -0.00000 -0.00000 -0.00000 55 11XZ -0.00002 0.00001 0.00000 -0.00000 -0.00000 56 11YZ 0.00004 0.00001 0.00000 -0.00000 -0.00000 57 12XX -0.00073 -0.00063 -0.00022 -0.00000 0.00002 58 12YY -0.00077 0.00039 -0.00015 0.00000 0.00000 59 12ZZ -0.00091 -0.00020 -0.00017 0.00000 0.00001 60 12XY -0.00038 -0.00015 0.00004 0.00001 0.00002 61 12XZ 0.00020 0.00003 0.00000 0.00000 -0.00000 62 12YZ -0.00038 -0.00057 -0.00001 0.00000 0.00001 63 5 C 1S -0.00006 0.00175 0.00001 0.00002 -0.00003 64 2S -0.00016 -0.00023 0.00002 0.00002 -0.00004 65 2PX -0.00011 -0.00014 0.00000 0.00001 -0.00002 66 2PY -0.00006 -0.00021 -0.00001 -0.00001 -0.00001 67 2PZ -0.00003 0.00005 -0.00001 -0.00000 -0.00000 68 3S 0.00059 0.00505 0.00018 -0.00007 0.00022 69 3PX -0.00041 0.00339 0.00030 0.00006 0.00019 70 3PY -0.00026 0.00471 0.00052 0.00016 0.00023 71 3PZ -0.00064 -0.00133 0.00022 0.00002 0.00008 72 4XX -0.00009 -0.00014 0.00001 0.00001 -0.00002 73 4YY -0.00005 -0.00032 0.00002 0.00001 -0.00001 74 4ZZ -0.00009 -0.00014 0.00001 0.00001 -0.00002 75 4XY -0.00004 -0.00002 0.00002 -0.00000 0.00000 76 4XZ -0.00003 0.00002 0.00000 0.00000 0.00000 77 4YZ 0.00003 -0.00005 0.00000 0.00000 0.00001 78 6 C 1S 0.00002 -0.00005 0.00001 0.00001 -0.00001 79 2S 0.00006 -0.00007 0.00001 0.00000 -0.00001 80 2PX -0.00000 -0.00014 0.00000 0.00001 0.00000 81 2PY 0.00004 -0.00008 0.00000 0.00000 0.00001 82 2PZ 0.00004 -0.00007 0.00000 0.00000 -0.00000 83 3S -0.00036 -0.00154 0.00012 0.00000 0.00010 84 3PX -0.00022 0.00009 -0.00006 -0.00003 -0.00006 85 3PY -0.00048 -0.00016 -0.00007 -0.00003 -0.00011 86 3PZ -0.00085 -0.00016 0.00017 0.00005 0.00006 87 4XX 0.00003 -0.00010 0.00000 0.00001 -0.00000 88 4YY 0.00004 -0.00013 0.00001 0.00001 -0.00000 89 4ZZ -0.00000 0.00004 0.00002 0.00000 -0.00000 90 4XY -0.00000 -0.00001 0.00000 -0.00000 -0.00000 91 4XZ -0.00000 -0.00006 -0.00000 0.00000 -0.00000 92 4YZ 0.00001 -0.00010 -0.00001 -0.00000 0.00000 93 7 C 1S 0.00001 -0.00006 -0.00000 -0.00001 -0.00001 94 2S 0.00004 -0.00024 -0.00001 -0.00001 -0.00001 95 2PX 0.00001 0.00000 -0.00000 -0.00001 -0.00001 96 2PY -0.00000 -0.00001 -0.00001 -0.00000 -0.00000 97 2PZ -0.00001 -0.00005 -0.00000 -0.00000 -0.00001 98 3S -0.00054 0.00149 -0.00002 0.00004 -0.00004 99 3PX -0.00024 0.00021 0.00002 0.00003 0.00001 100 3PY -0.00032 0.00044 0.00004 0.00001 -0.00003 101 3PZ 0.00010 0.00111 -0.00000 0.00002 0.00000 102 4XX 0.00000 -0.00008 -0.00000 -0.00001 -0.00001 103 4YY -0.00001 0.00001 -0.00000 -0.00001 -0.00001 104 4ZZ 0.00001 -0.00003 0.00000 -0.00001 -0.00001 105 4XY -0.00002 0.00007 0.00000 0.00000 0.00000 106 4XZ -0.00000 0.00001 0.00000 0.00000 0.00000 107 4YZ 0.00000 0.00003 0.00000 -0.00000 -0.00000 108 8 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 109 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 110 2PX -0.00000 -0.00002 -0.00000 -0.00000 -0.00000 111 2PY -0.00000 -0.00003 -0.00000 -0.00000 -0.00000 112 2PZ 0.00000 0.00002 -0.00000 0.00000 0.00000 113 3S -0.00006 -0.00058 0.00003 0.00000 -0.00000 114 3PX 0.00009 -0.00027 0.00000 -0.00000 -0.00000 115 3PY 0.00010 -0.00056 0.00000 -0.00000 0.00001 116 3PZ 0.00010 0.00013 -0.00001 0.00000 0.00001 117 4XX 0.00000 -0.00002 -0.00000 -0.00000 -0.00000 118 4YY -0.00000 -0.00002 -0.00000 -0.00000 -0.00000 119 4ZZ 0.00000 0.00001 0.00000 0.00000 -0.00000 120 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 121 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 122 4YZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 123 9 C 1S 0.00001 -0.00003 -0.00000 -0.00000 -0.00000 124 2S 0.00005 -0.00015 -0.00002 -0.00000 0.00000 125 2PX -0.00000 -0.00001 -0.00000 -0.00000 -0.00000 126 2PY 0.00000 -0.00006 -0.00001 -0.00000 -0.00000 127 2PZ -0.00000 -0.00002 0.00000 -0.00000 0.00000 128 3S -0.00061 0.00107 0.00003 -0.00002 -0.00007 129 3PX -0.00016 0.00038 0.00002 -0.00000 -0.00001 130 3PY -0.00028 0.00078 0.00004 -0.00001 -0.00003 131 3PZ -0.00002 0.00018 0.00001 0.00001 -0.00001 132 4XX 0.00001 -0.00005 -0.00001 -0.00000 -0.00000 133 4YY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 134 4ZZ 0.00000 -0.00002 -0.00000 -0.00000 -0.00000 135 4XY -0.00002 0.00005 0.00001 0.00000 -0.00000 136 4XZ -0.00000 0.00001 0.00000 -0.00000 0.00000 137 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 138 10 C 1S 0.00001 -0.00005 -0.00000 -0.00000 -0.00000 139 2S 0.00003 -0.00025 -0.00001 -0.00001 -0.00001 140 2PX 0.00002 -0.00006 -0.00000 0.00000 0.00000 141 2PY 0.00004 -0.00004 -0.00001 0.00000 0.00000 142 2PZ -0.00001 -0.00004 -0.00000 0.00000 -0.00000 143 3S 0.00020 0.00193 0.00010 0.00012 0.00010 144 3PX -0.00028 0.00081 0.00002 0.00002 -0.00005 145 3PY -0.00045 0.00132 0.00003 0.00000 -0.00005 146 3PZ 0.00005 -0.00126 -0.00016 -0.00008 -0.00008 147 4XX 0.00001 -0.00009 -0.00001 -0.00000 -0.00000 148 4YY 0.00003 -0.00007 -0.00001 -0.00000 -0.00000 149 4ZZ 0.00000 0.00010 0.00001 0.00000 0.00000 150 4XY -0.00001 0.00005 -0.00000 0.00000 -0.00000 151 4XZ -0.00001 -0.00001 -0.00000 -0.00000 0.00000 152 4YZ 0.00000 -0.00007 0.00000 0.00000 -0.00000 153 11 H 1S 0.00004 -0.00007 0.00000 0.00000 0.00001 154 2S -0.00007 0.00018 0.00007 0.00002 0.00003 155 12 H 1S 0.00001 -0.00002 -0.00000 -0.00000 0.00000 156 2S -0.00005 0.00020 0.00002 -0.00000 -0.00000 157 13 H 1S 0.00002 -0.00004 -0.00000 -0.00000 0.00000 158 2S 0.00005 -0.00011 0.00000 -0.00000 0.00000 159 14 H 1S 0.00002 0.00003 -0.00000 0.00000 0.00000 160 2S 0.00003 0.00042 0.00002 0.00001 0.00000 161 15 H 1S 0.00006 -0.00002 0.00001 0.00001 0.00001 162 2S -0.00033 0.00006 0.00007 0.00003 0.00006 163 16 C 1S 0.00574 -0.00012 0.99227 0.00035 -0.02774 164 2S -0.00024 0.00014 0.04985 -0.00021 -0.00191 165 2PX 0.00040 0.00003 -0.00011 -0.00007 -0.00036 166 2PY -0.00023 0.00000 0.00012 0.00005 -0.00006 167 2PZ -0.00011 0.00002 0.00008 0.00003 -0.00003 168 3S 0.00615 -0.00234 -0.01972 0.00316 0.00837 169 3PX -0.00347 0.00164 -0.00096 0.00242 0.00509 170 3PY 0.00009 -0.00075 0.00101 -0.00184 -0.00184 171 3PZ -0.00016 -0.00047 0.00045 -0.00106 -0.00113 172 4XX -0.00044 -0.00011 -0.00916 -0.00001 -0.00021 173 4YY -0.00040 0.00011 -0.00913 -0.00002 -0.00003 174 4ZZ -0.00033 0.00005 -0.00934 -0.00007 0.00003 175 4XY 0.00009 0.00000 -0.00009 0.00003 -0.00010 176 4XZ 0.00008 0.00001 -0.00006 0.00002 -0.00004 177 4YZ -0.00013 0.00007 0.00020 0.00004 -0.00006 178 17 C 1S 0.00004 -0.00003 0.01783 0.00080 -0.00170 179 2S 0.00005 0.00000 0.00039 0.00016 0.00004 180 2PX 0.00008 0.00000 -0.00011 -0.00004 -0.00001 181 2PY -0.00007 0.00003 -0.00028 0.00001 -0.00003 182 2PZ -0.00004 0.00003 -0.00015 0.00001 -0.00002 183 3S -0.00274 0.00057 0.00693 -0.00457 -0.00446 184 3PX -0.00072 -0.00038 0.00206 -0.00258 -0.00279 185 3PY -0.00061 -0.00033 0.00245 -0.00081 -0.00090 186 3PZ -0.00022 -0.00021 0.00129 -0.00037 -0.00040 187 4XX 0.00001 -0.00003 -0.00040 0.00007 0.00005 188 4YY 0.00002 -0.00004 -0.00059 0.00003 0.00008 189 4ZZ 0.00001 -0.00001 -0.00042 0.00003 0.00006 190 4XY 0.00008 -0.00002 -0.00006 -0.00003 -0.00000 191 4XZ 0.00005 -0.00001 -0.00003 -0.00002 0.00000 192 4YZ 0.00003 -0.00002 -0.00014 -0.00000 0.00002 193 18 C 1S -0.00004 0.00001 0.00022 0.01131 -0.00027 194 2S -0.00017 0.00003 0.00010 -0.00007 -0.00026 195 2PX -0.00004 0.00001 0.00003 -0.00031 -0.00001 196 2PY -0.00000 0.00001 -0.00001 -0.00016 -0.00003 197 2PZ -0.00000 -0.00000 -0.00001 -0.00008 -0.00001 198 3S 0.00165 -0.00002 -0.00311 0.00885 0.00410 199 3PX 0.00007 0.00027 -0.00062 0.00196 0.00033 200 3PY 0.00107 -0.00002 -0.00179 0.00355 0.00219 201 3PZ 0.00056 0.00001 -0.00096 0.00187 0.00117 202 4XX 0.00001 -0.00000 0.00004 -0.00059 0.00001 203 4YY 0.00000 0.00000 0.00006 -0.00033 -0.00003 204 4ZZ -0.00004 0.00001 0.00004 -0.00033 -0.00007 205 4XY -0.00003 0.00000 -0.00003 -0.00006 -0.00000 206 4XZ -0.00001 0.00000 -0.00001 -0.00002 -0.00000 207 4YZ 0.00004 -0.00000 0.00001 0.00000 0.00004 208 19 C 1S -0.00000 -0.00000 -0.00053 0.99270 -0.00289 209 2S 0.00002 -0.00000 -0.00024 0.04961 -0.00004 210 2PX 0.00003 -0.00002 0.00002 -0.00028 -0.00000 211 2PY 0.00001 -0.00000 -0.00001 0.00020 -0.00005 212 2PZ 0.00000 -0.00000 -0.00001 0.00012 -0.00003 213 3S -0.00091 0.00007 0.00333 -0.01897 -0.00432 214 3PX 0.00051 0.00030 -0.00151 0.00379 0.00183 215 3PY -0.00022 0.00016 0.00100 -0.00273 -0.00134 216 3PZ -0.00012 0.00008 0.00058 -0.00158 -0.00077 217 4XX -0.00001 -0.00000 0.00000 -0.00919 0.00005 218 4YY 0.00001 0.00000 -0.00002 -0.00923 0.00010 219 4ZZ -0.00000 0.00000 -0.00006 -0.00942 0.00008 220 4XY -0.00000 -0.00000 0.00001 0.00009 -0.00003 221 4XZ -0.00000 0.00000 0.00000 0.00004 -0.00001 222 4YZ 0.00001 0.00000 0.00004 0.00016 0.00002 223 20 C 1S -0.00002 -0.00001 0.00032 0.01142 0.01473 224 2S -0.00008 -0.00004 0.00011 -0.00007 0.00005 225 2PX 0.00002 -0.00004 0.00002 0.00012 0.00031 226 2PY -0.00002 0.00001 -0.00002 0.00029 -0.00014 227 2PZ -0.00002 0.00001 -0.00001 0.00016 -0.00009 228 3S 0.00092 0.00125 -0.00321 0.00880 0.00894 229 3PX -0.00057 -0.00052 0.00191 -0.00353 -0.00461 230 3PY 0.00004 0.00066 0.00072 -0.00243 -0.00020 231 3PZ 0.00004 0.00034 0.00034 -0.00124 -0.00001 232 4XX 0.00001 0.00002 0.00006 -0.00032 -0.00045 233 4YY -0.00002 0.00000 0.00003 -0.00054 -0.00046 234 4ZZ -0.00003 -0.00001 0.00004 -0.00039 -0.00039 235 4XY 0.00001 -0.00003 -0.00002 0.00000 0.00011 236 4XZ 0.00000 -0.00001 -0.00001 0.00000 0.00006 237 4YZ 0.00001 0.00001 -0.00000 -0.00013 -0.00007 238 21 C 1S 0.00001 -0.00002 0.02737 0.00279 0.99233 239 2S -0.00016 -0.00006 0.00090 0.00024 0.04975 240 2PX -0.00002 0.00007 0.00026 -0.00003 -0.00016 241 2PY -0.00004 -0.00004 0.00013 0.00003 -0.00032 242 2PZ -0.00001 -0.00004 0.00007 0.00002 -0.00018 243 3S 0.00069 -0.00071 0.00662 -0.00441 -0.01960 244 3PX -0.00079 -0.00138 -0.00184 0.00034 0.00107 245 3PY 0.00022 0.00097 -0.00225 0.00228 0.00463 246 3PZ 0.00017 0.00063 -0.00117 0.00124 0.00253 247 4XX 0.00012 0.00003 -0.00072 0.00002 -0.00913 248 4YY 0.00002 -0.00004 -0.00049 0.00003 -0.00932 249 4ZZ -0.00004 -0.00004 -0.00046 0.00001 -0.00944 250 4XY 0.00003 0.00004 -0.00008 -0.00004 -0.00008 251 4XZ 0.00000 0.00002 -0.00004 -0.00002 -0.00005 252 4YZ 0.00003 0.00000 -0.00003 0.00002 0.00011 253 22 H 1S -0.00005 -0.00010 -0.00001 -0.00008 -0.00046 254 2S -0.00021 -0.00024 0.00045 -0.00052 0.00067 255 23 H 1S -0.00000 -0.00003 -0.00007 0.00004 0.00005 256 2S 0.00018 -0.00001 -0.00044 0.00088 0.00092 257 24 H 1S -0.00002 -0.00002 0.00005 -0.00045 -0.00006 258 2S -0.00010 -0.00004 0.00045 0.00083 -0.00042 259 25 H 1S 0.00004 -0.00000 -0.00008 0.00004 0.00007 260 2S 0.00035 0.00003 -0.00046 0.00088 0.00063 261 26 H 1S -0.00005 0.00001 -0.00003 -0.00008 -0.00008 262 2S -0.00004 -0.00072 0.00056 -0.00054 -0.00078 263 27 H 1S -0.00021 0.00008 -0.00003 -0.00000 -0.00003 264 2S 0.00149 0.00069 -0.00004 0.00003 0.00000 11 12 13 14 15 O O O O O Eigenvalues -- -10.25007 -10.23401 -10.23362 -10.22890 -10.21242 1 1 C 1S 0.00009 -0.00001 -0.00001 -0.00001 0.00001 2 2S -0.00009 -0.00010 -0.00006 -0.00028 0.00005 3 2PX 0.00005 -0.00001 -0.00003 0.00021 0.00002 4 2PY 0.00001 0.00002 0.00001 0.00013 0.00001 5 2PZ 0.00000 0.00002 0.00001 0.00005 -0.00001 6 3S 0.00134 -0.00011 -0.00024 0.00192 -0.00094 7 3PX 0.00085 -0.00021 0.00096 -0.00236 -0.00037 8 3PY -0.00039 -0.00035 0.00006 -0.00127 0.00033 9 3PZ -0.00026 -0.00022 0.00002 -0.00068 0.00030 10 4XX 0.00009 -0.00004 0.00002 0.00000 -0.00001 11 4YY 0.00004 -0.00001 -0.00002 -0.00005 0.00000 12 4ZZ -0.00000 -0.00003 -0.00002 -0.00016 0.00000 13 4XY -0.00004 -0.00001 -0.00002 -0.00004 0.00000 14 4XZ -0.00003 -0.00000 -0.00001 -0.00002 -0.00000 15 4YZ 0.00005 0.00002 -0.00000 0.00005 -0.00000 16 2 C 1S 0.00001 0.00001 -0.00000 -0.00194 0.00002 17 2S -0.00001 0.00004 -0.00002 -0.00000 -0.00020 18 2PX -0.00003 -0.00001 0.00002 0.00011 -0.00003 19 2PY 0.00001 0.00002 -0.00001 0.00013 -0.00001 20 2PZ 0.00001 0.00000 -0.00001 0.00007 0.00001 21 3S 0.00036 -0.00051 0.00056 0.00125 0.00180 22 3PX 0.00025 0.00001 0.00036 -0.00231 -0.00032 23 3PY 0.00009 0.00026 0.00017 -0.00115 -0.00082 24 3PZ -0.00001 0.00016 0.00012 -0.00035 -0.00069 25 4XX -0.00003 0.00001 0.00001 -0.00026 -0.00000 26 4YY -0.00003 -0.00001 -0.00001 -0.00030 0.00004 27 4ZZ -0.00002 0.00000 0.00000 -0.00008 0.00000 28 4XY 0.00000 0.00001 0.00000 -0.00024 0.00006 29 4XZ 0.00001 0.00000 0.00000 -0.00007 0.00001 30 4YZ -0.00000 -0.00001 -0.00000 -0.00009 0.00002 31 3 H 1S -0.00001 0.00000 -0.00003 -0.00006 -0.00001 32 2S 0.00003 -0.00003 -0.00004 -0.00022 0.00018 33 4 Br 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 34 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 35 3S -0.00001 -0.00001 -0.00001 0.00002 0.00000 36 4S 0.00000 0.00000 0.00000 -0.00001 -0.00000 37 5S 0.00006 0.00005 0.00001 -0.00015 -0.00008 38 6S -0.00019 -0.00013 -0.00006 0.00036 0.00016 39 7PX -0.00000 0.00000 0.00000 0.00000 -0.00000 40 7PY -0.00000 -0.00000 -0.00000 0.00001 0.00000 41 7PZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 42 8PX 0.00000 -0.00000 -0.00000 -0.00001 0.00001 43 8PY 0.00000 0.00000 0.00000 -0.00002 -0.00000 44 8PZ 0.00000 -0.00000 0.00000 0.00001 0.00000 45 9PX -0.00000 0.00000 0.00001 0.00007 -0.00003 46 9PY -0.00001 -0.00002 -0.00000 0.00010 0.00003 47 9PZ -0.00001 0.00001 -0.00000 -0.00006 -0.00001 48 10PX -0.00001 -0.00001 -0.00001 -0.00005 0.00002 49 10PY 0.00006 0.00002 0.00001 -0.00006 -0.00001 50 10PZ 0.00000 -0.00002 -0.00002 0.00009 0.00002 51 11XX 0.00001 0.00000 0.00000 -0.00000 0.00000 52 11YY 0.00001 0.00000 0.00000 -0.00002 -0.00000 53 11ZZ 0.00001 0.00000 0.00001 -0.00001 -0.00000 54 11XY -0.00000 -0.00000 -0.00000 -0.00001 -0.00000 55 11XZ 0.00000 -0.00000 -0.00000 -0.00001 -0.00000 56 11YZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 57 12XX 0.00005 0.00003 0.00003 -0.00015 -0.00005 58 12YY 0.00002 0.00004 0.00002 -0.00010 -0.00006 59 12ZZ 0.00004 0.00003 0.00000 -0.00012 -0.00003 60 12XY 0.00001 0.00001 -0.00000 0.00006 0.00002 61 12XZ -0.00000 0.00000 0.00000 0.00006 0.00001 62 12YZ 0.00000 0.00000 0.00001 0.00000 0.00002 63 5 C 1S -0.00002 -0.00017 -0.00008 0.99271 -0.01598 64 2S 0.00002 -0.00008 -0.00003 0.05009 -0.00133 65 2PX -0.00001 -0.00003 -0.00001 0.00037 0.00019 66 2PY -0.00001 -0.00000 -0.00000 0.00015 0.00027 67 2PZ -0.00002 0.00001 0.00000 0.00006 -0.00025 68 3S 0.00010 0.00052 0.00027 -0.02087 0.00860 69 3PX -0.00012 0.00028 0.00002 0.00048 -0.00309 70 3PY -0.00003 0.00021 0.00007 0.00158 -0.00483 71 3PZ 0.00021 -0.00009 -0.00001 0.00000 0.00075 72 4XX -0.00001 -0.00003 -0.00001 -0.00911 -0.00006 73 4YY 0.00001 -0.00003 -0.00001 -0.00906 -0.00011 74 4ZZ -0.00001 -0.00002 -0.00001 -0.00885 -0.00023 75 4XY 0.00002 0.00001 0.00000 0.00012 -0.00007 76 4XZ 0.00000 0.00001 0.00000 0.00001 0.00005 77 4YZ 0.00000 0.00001 0.00000 -0.00002 0.00010 78 6 C 1S 0.00004 -0.00001 0.00000 0.01401 -0.00154 79 2S 0.00010 0.00000 0.00001 0.00033 0.00008 80 2PX -0.00001 -0.00001 -0.00001 0.00008 0.00003 81 2PY -0.00004 -0.00001 -0.00001 -0.00011 -0.00002 82 2PZ 0.00001 -0.00001 -0.00000 -0.00030 -0.00002 83 3S -0.00048 -0.00010 -0.00007 0.00599 -0.00451 84 3PX 0.00012 -0.00005 0.00001 -0.00031 0.00097 85 3PY 0.00032 -0.00004 0.00002 -0.00017 0.00198 86 3PZ 0.00006 -0.00005 -0.00004 0.00315 -0.00188 87 4XX 0.00002 -0.00001 -0.00000 -0.00020 0.00009 88 4YY 0.00003 -0.00001 -0.00000 -0.00024 0.00009 89 4ZZ 0.00005 -0.00000 0.00000 -0.00046 0.00014 90 4XY -0.00001 -0.00000 -0.00000 -0.00003 0.00001 91 4XZ -0.00001 -0.00001 -0.00000 -0.00005 0.00001 92 4YZ -0.00001 -0.00000 -0.00000 -0.00009 0.00001 93 7 C 1S 0.00002 0.00001 0.00001 0.00023 -0.00053 94 2S 0.00000 0.00001 0.00001 0.00007 -0.00027 95 2PX 0.00004 0.00001 0.00001 0.00001 0.00001 96 2PY 0.00000 0.00000 0.00000 -0.00002 -0.00001 97 2PZ 0.00001 0.00000 0.00000 0.00000 -0.00002 98 3S 0.00024 -0.00005 -0.00001 -0.00256 0.00417 99 3PX 0.00004 -0.00003 -0.00002 -0.00001 0.00048 100 3PY 0.00021 -0.00001 0.00001 0.00001 0.00062 101 3PZ 0.00003 0.00001 0.00001 -0.00178 0.00230 102 4XX 0.00002 0.00001 0.00001 0.00007 -0.00005 103 4YY 0.00002 0.00001 0.00001 0.00004 -0.00001 104 4ZZ 0.00003 0.00001 0.00001 0.00006 0.00001 105 4XY 0.00000 0.00000 -0.00000 0.00003 0.00005 106 4XZ -0.00000 -0.00000 -0.00000 0.00003 -0.00000 107 4YZ 0.00001 0.00000 0.00000 0.00003 -0.00001 108 8 C 1S 0.00001 0.00000 0.00000 -0.00018 0.00217 109 2S -0.00000 -0.00000 -0.00000 -0.00023 0.00021 110 2PX 0.00000 0.00000 0.00000 -0.00001 -0.00001 111 2PY -0.00000 -0.00000 -0.00000 -0.00003 -0.00002 112 2PZ 0.00000 -0.00000 -0.00000 0.00000 -0.00006 113 3S -0.00002 0.00000 -0.00001 0.00333 -0.00431 114 3PX 0.00002 0.00000 0.00001 0.00094 -0.00127 115 3PY -0.00001 0.00001 0.00000 0.00155 -0.00206 116 3PZ -0.00009 0.00001 -0.00000 0.00042 -0.00061 117 4XX 0.00001 0.00000 0.00000 -0.00006 0.00002 118 4YY -0.00000 0.00000 0.00000 -0.00003 0.00002 119 4ZZ -0.00000 0.00000 -0.00000 0.00001 0.00002 120 4XY 0.00001 0.00000 0.00000 0.00004 0.00001 121 4XZ -0.00000 -0.00000 -0.00000 0.00001 0.00002 122 4YZ 0.00000 0.00000 0.00000 -0.00001 0.00003 123 9 C 1S 0.00000 0.00000 0.00000 0.00022 0.04366 124 2S -0.00001 -0.00000 -0.00000 0.00009 0.00151 125 2PX 0.00001 0.00000 0.00000 -0.00001 -0.00016 126 2PY -0.00000 -0.00000 0.00000 -0.00003 -0.00028 127 2PZ 0.00000 -0.00000 0.00000 -0.00001 -0.00002 128 3S 0.00006 -0.00001 0.00001 -0.00293 0.00848 129 3PX -0.00003 0.00001 -0.00000 -0.00055 0.00197 130 3PY 0.00001 0.00001 0.00001 -0.00098 0.00343 131 3PZ -0.00008 0.00000 -0.00001 0.00169 -0.00217 132 4XX 0.00000 0.00000 0.00000 0.00005 -0.00068 133 4YY 0.00000 0.00000 0.00000 0.00007 -0.00076 134 4ZZ 0.00000 0.00000 0.00000 0.00003 -0.00066 135 4XY 0.00000 0.00000 0.00000 0.00003 -0.00009 136 4XZ -0.00000 0.00000 -0.00000 -0.00001 -0.00005 137 4YZ -0.00000 -0.00000 -0.00000 0.00000 -0.00009 138 10 C 1S 0.00001 -0.00000 0.00000 0.01558 0.99172 139 2S 0.00001 -0.00000 0.00000 0.00019 0.04978 140 2PX -0.00000 0.00000 0.00000 -0.00007 0.00004 141 2PY -0.00000 -0.00000 -0.00000 -0.00019 -0.00001 142 2PZ -0.00000 -0.00000 -0.00000 0.00026 -0.00032 143 3S -0.00020 0.00006 -0.00003 0.00754 -0.01991 144 3PX -0.00002 -0.00003 -0.00001 0.00069 0.00066 145 3PY -0.00008 0.00003 -0.00001 0.00109 0.00089 146 3PZ 0.00007 -0.00005 0.00001 -0.00344 0.00531 147 4XX 0.00000 -0.00001 -0.00000 -0.00035 -0.00939 148 4YY 0.00000 0.00000 0.00000 -0.00047 -0.00923 149 4ZZ 0.00001 0.00001 0.00000 -0.00044 -0.00928 150 4XY -0.00000 -0.00000 -0.00000 -0.00007 0.00018 151 4XZ 0.00000 0.00001 0.00000 0.00004 -0.00002 152 4YZ 0.00001 -0.00001 -0.00000 0.00013 -0.00004 153 11 H 1S 0.00000 0.00000 -0.00000 -0.00004 -0.00047 154 2S 0.00001 0.00002 0.00000 0.00044 0.00069 155 12 H 1S 0.00000 0.00000 0.00000 -0.00008 0.00004 156 2S 0.00002 0.00001 0.00001 -0.00039 0.00095 157 13 H 1S -0.00000 -0.00000 -0.00000 0.00003 -0.00007 158 2S 0.00001 0.00001 0.00000 0.00047 -0.00047 159 14 H 1S -0.00001 0.00000 0.00000 -0.00008 0.00006 160 2S 0.00002 0.00001 0.00000 -0.00031 0.00059 161 15 H 1S -0.00004 0.00000 -0.00000 0.00001 -0.00008 162 2S 0.00008 0.00002 -0.00001 0.00039 -0.00065 163 16 C 1S -0.01827 0.00018 0.00016 0.00003 0.00000 164 2S -0.00139 0.00015 0.00018 0.00025 0.00002 165 2PX 0.00002 -0.00002 0.00000 -0.00003 0.00001 166 2PY 0.00035 0.00000 0.00003 -0.00003 -0.00001 167 2PZ 0.00018 0.00000 0.00002 -0.00003 -0.00000 168 3S 0.00778 -0.00440 -0.00469 -0.00263 -0.00022 169 3PX 0.00228 -0.00118 -0.00232 0.00226 -0.00056 170 3PY -0.00418 0.00183 0.00033 0.00261 0.00096 171 3PZ -0.00232 0.00103 0.00021 0.00137 0.00047 172 4XX -0.00010 0.00004 0.00005 -0.00003 0.00002 173 4YY -0.00030 0.00007 0.00004 -0.00005 -0.00002 174 4ZZ -0.00010 0.00005 0.00005 0.00004 0.00000 175 4XY -0.00006 -0.00000 0.00001 -0.00003 -0.00001 176 4XZ -0.00002 -0.00000 0.00001 -0.00001 -0.00000 177 4YZ -0.00017 0.00002 -0.00001 -0.00007 -0.00001 178 17 C 1S 0.99248 -0.01955 -0.00001 0.00002 -0.00000 179 2S 0.04982 -0.00171 -0.00020 0.00004 -0.00003 180 2PX 0.00035 -0.00034 -0.00004 0.00005 -0.00005 181 2PY 0.00024 0.00017 -0.00003 -0.00011 -0.00002 182 2PZ 0.00012 0.00010 -0.00002 -0.00010 -0.00004 183 3S -0.01994 0.01013 0.00323 -0.00040 0.00040 184 3PX -0.00467 0.00472 0.00229 -0.00079 0.00082 185 3PY -0.00178 0.00035 0.00031 0.00373 0.00067 186 3PZ -0.00085 0.00005 0.00011 0.00216 0.00043 187 4XX -0.00923 -0.00014 -0.00002 -0.00012 0.00002 188 4YY -0.00924 -0.00014 -0.00003 0.00012 0.00004 189 4ZZ -0.00942 -0.00007 -0.00006 0.00003 0.00001 190 4XY -0.00006 0.00010 -0.00001 0.00012 0.00002 191 4XZ -0.00005 0.00006 -0.00001 0.00006 0.00002 192 4YZ 0.00016 -0.00006 0.00003 0.00007 0.00002 193 18 C 1S 0.01902 0.99253 0.00825 0.00012 0.00000 194 2S 0.00026 0.04993 0.00055 -0.00017 0.00001 195 2PX 0.00021 0.00010 -0.00005 -0.00000 0.00001 196 2PY -0.00022 0.00040 -0.00001 0.00003 -0.00000 197 2PZ -0.00013 0.00021 -0.00001 0.00003 0.00001 198 3S 0.00879 -0.01995 -0.00468 0.00274 -0.00035 199 3PX -0.00087 -0.00076 -0.00023 -0.00219 -0.00029 200 3PY 0.00383 -0.00483 -0.00228 0.00053 -0.00034 201 3PZ 0.00210 -0.00259 -0.00123 0.00026 -0.00023 202 4XX -0.00055 -0.00912 -0.00001 0.00006 0.00001 203 4YY -0.00044 -0.00935 -0.00003 -0.00002 -0.00001 204 4ZZ -0.00041 -0.00948 -0.00003 -0.00006 -0.00001 205 4XY 0.00008 -0.00004 0.00003 -0.00006 -0.00000 206 4XZ 0.00005 -0.00003 0.00001 -0.00003 0.00000 207 4YZ -0.00003 0.00011 0.00000 0.00003 -0.00001 208 19 C 1S -0.00095 -0.01166 -0.01194 -0.00000 -0.00000 209 2S 0.00005 -0.00119 -0.00122 0.00006 -0.00001 210 2PX 0.00006 0.00034 0.00001 -0.00002 -0.00001 211 2PY 0.00002 0.00006 -0.00030 0.00003 -0.00000 212 2PZ 0.00001 0.00002 -0.00016 0.00001 -0.00000 213 3S -0.00402 0.00912 0.00930 -0.00015 0.00041 214 3PX 0.00175 -0.00428 -0.00235 -0.00002 -0.00022 215 3PY -0.00127 0.00133 0.00347 -0.00102 0.00001 216 3PZ -0.00073 0.00082 0.00195 -0.00053 0.00003 217 4XX 0.00009 -0.00032 -0.00015 0.00002 0.00000 218 4YY 0.00003 -0.00017 -0.00030 -0.00000 -0.00000 219 4ZZ 0.00004 -0.00012 -0.00016 0.00001 -0.00000 220 4XY -0.00001 -0.00013 -0.00009 0.00000 0.00000 221 4XZ -0.00001 -0.00007 -0.00005 -0.00000 -0.00000 222 4YZ -0.00001 -0.00004 -0.00012 -0.00002 0.00000 223 20 C 1S -0.00023 -0.00830 0.99260 0.00006 0.00000 224 2S -0.00023 -0.00028 0.04997 -0.00007 0.00001 225 2PX 0.00003 0.00002 -0.00044 -0.00001 0.00001 226 2PY 0.00000 0.00005 -0.00017 -0.00000 -0.00000 227 2PZ -0.00000 0.00003 -0.00008 -0.00000 -0.00000 228 3S 0.00369 -0.00440 -0.02013 0.00111 -0.00037 229 3PX -0.00208 0.00244 0.00539 -0.00040 0.00020 230 3PY -0.00068 0.00068 0.00170 -0.00050 -0.00003 231 3PZ -0.00032 0.00032 0.00080 -0.00027 -0.00003 232 4XX -0.00002 0.00012 -0.00928 0.00000 -0.00000 233 4YY -0.00001 0.00015 -0.00924 0.00001 -0.00000 234 4ZZ -0.00006 0.00013 -0.00944 -0.00001 0.00000 235 4XY 0.00000 0.00002 -0.00007 -0.00000 0.00000 236 4XZ -0.00000 0.00001 -0.00004 -0.00000 0.00000 237 4YZ 0.00004 0.00001 0.00018 0.00002 0.00000 238 21 C 1S 0.00128 0.00025 -0.01528 0.00002 -0.00000 239 2S 0.00014 -0.00020 -0.00148 0.00001 -0.00002 240 2PX 0.00002 0.00003 -0.00027 0.00004 -0.00000 241 2PY 0.00003 0.00003 0.00026 -0.00001 -0.00000 242 2PZ 0.00001 0.00001 0.00015 -0.00000 0.00000 243 3S -0.00361 0.00337 0.01028 -0.00154 0.00035 244 3PX 0.00020 0.00001 0.00063 0.00062 0.00012 245 3PY 0.00210 -0.00197 -0.00412 0.00027 -0.00036 246 3PZ 0.00115 -0.00108 -0.00227 0.00013 -0.00019 247 4XX 0.00007 -0.00001 -0.00024 -0.00003 -0.00001 248 4YY 0.00003 -0.00004 -0.00013 -0.00001 0.00001 249 4ZZ 0.00002 -0.00007 -0.00009 -0.00002 -0.00000 250 4XY 0.00000 -0.00001 0.00009 0.00003 0.00001 251 4XZ 0.00000 -0.00001 0.00005 0.00002 0.00000 252 4YZ 0.00001 0.00003 -0.00004 0.00000 0.00001 253 22 H 1S -0.00007 0.00008 0.00006 0.00000 0.00002 254 2S -0.00057 0.00055 0.00077 -0.00005 0.00013 255 23 H 1S 0.00006 -0.00006 -0.00047 0.00000 -0.00000 256 2S 0.00055 -0.00051 0.00059 0.00014 -0.00003 257 24 H 1S -0.00006 0.00005 0.00005 -0.00007 0.00000 258 2S -0.00041 0.00083 0.00083 -0.00023 0.00003 259 25 H 1S 0.00005 -0.00046 -0.00007 -0.00009 -0.00002 260 2S 0.00083 0.00065 -0.00050 -0.00014 -0.00017 261 26 H 1S -0.00049 0.00006 0.00008 -0.00023 -0.00009 262 2S 0.00110 0.00077 0.00062 0.00189 0.00092 263 27 H 1S -0.00001 0.00002 -0.00004 0.00010 0.00001 264 2S 0.00009 0.00019 -0.00005 0.00088 0.00000 16 17 18 19 20 O O O O O Eigenvalues -- -10.21019 -10.20701 -10.20638 -10.20605 -8.61466 1 1 C 1S 0.00002 0.00001 0.00001 0.00001 0.00027 2 2S 0.00014 0.00006 0.00006 0.00004 0.00143 3 2PX 0.00000 -0.00000 -0.00001 -0.00001 0.00054 4 2PY -0.00001 0.00001 0.00001 0.00001 -0.00065 5 2PZ 0.00001 0.00000 0.00000 -0.00000 -0.00073 6 3S -0.00248 -0.00127 -0.00110 -0.00055 -0.00975 7 3PX -0.00078 -0.00028 -0.00010 -0.00010 0.00538 8 3PY 0.00094 0.00060 0.00041 0.00029 0.00495 9 3PZ 0.00044 0.00037 0.00036 0.00011 0.00787 10 4XX -0.00004 -0.00001 -0.00000 0.00001 -0.00001 11 4YY 0.00002 -0.00000 -0.00001 -0.00000 0.00022 12 4ZZ 0.00003 0.00000 0.00000 0.00001 0.00021 13 4XY 0.00000 0.00001 0.00001 -0.00001 0.00017 14 4XZ -0.00000 0.00000 -0.00001 0.00001 0.00010 15 4YZ -0.00002 -0.00001 -0.00001 -0.00001 -0.00018 16 2 C 1S 0.00001 -0.00002 -0.00001 -0.00002 -0.00044 17 2S -0.00027 -0.00014 -0.00007 -0.00009 -0.00323 18 2PX -0.00005 0.00000 0.00001 0.00003 -0.00072 19 2PY -0.00000 -0.00000 0.00002 0.00005 0.00183 20 2PZ 0.00005 0.00002 0.00004 0.00000 -0.00094 21 3S 0.00282 0.00131 -0.00010 -0.00039 0.01613 22 3PX -0.00036 -0.00021 0.00029 0.00001 0.00249 23 3PY -0.00168 -0.00066 0.00001 -0.00020 -0.00897 24 3PZ -0.00049 -0.00039 -0.00044 0.00023 -0.00276 25 4XX -0.00002 -0.00002 -0.00002 -0.00003 0.00038 26 4YY 0.00003 -0.00001 -0.00004 -0.00001 0.00177 27 4ZZ -0.00006 -0.00005 -0.00003 -0.00005 0.00033 28 4XY 0.00005 0.00001 -0.00001 0.00002 0.00009 29 4XZ -0.00000 0.00000 0.00002 -0.00001 0.00015 30 4YZ 0.00004 0.00002 0.00002 0.00000 -0.00143 31 3 H 1S 0.00001 -0.00001 0.00003 -0.00003 0.00032 32 2S 0.00015 0.00007 0.00015 0.00000 -0.00323 33 4 Br 1S -0.00000 0.00000 0.00000 0.00000 0.16786 34 2S -0.00001 0.00000 0.00000 0.00000 -0.93979 35 3S 0.00003 -0.00000 -0.00001 -0.00000 0.86461 36 4S -0.00001 -0.00001 -0.00001 -0.00000 1.24512 37 5S -0.00019 -0.00003 -0.00008 -0.00005 0.29894 38 6S 0.00056 0.00004 0.00011 0.00017 0.24741 39 7PX 0.00000 -0.00000 -0.00000 0.00000 -0.00042 40 7PY 0.00000 0.00000 0.00000 0.00000 0.00198 41 7PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00146 42 8PX -0.00001 0.00000 0.00000 -0.00000 0.00106 43 8PY -0.00002 -0.00000 -0.00001 -0.00000 -0.00505 44 8PZ 0.00000 0.00000 0.00000 -0.00000 0.00365 45 9PX 0.00003 -0.00001 -0.00002 0.00000 -0.00083 46 9PY 0.00008 0.00002 0.00005 0.00000 0.00405 47 9PZ -0.00003 -0.00001 -0.00001 0.00001 -0.00139 48 10PX -0.00004 0.00001 -0.00001 0.00003 0.00186 49 10PY -0.00009 0.00003 -0.00002 -0.00006 -0.00805 50 10PZ 0.00019 0.00002 -0.00002 0.00005 0.00369 51 11XX -0.00001 0.00000 0.00001 0.00000 -0.43848 52 11YY -0.00002 0.00001 0.00000 0.00000 -0.43726 53 11ZZ -0.00002 0.00000 0.00001 0.00000 -0.43789 54 11XY -0.00000 0.00000 -0.00000 0.00000 -0.00043 55 11XZ -0.00000 -0.00000 0.00000 -0.00000 0.00031 56 11YZ 0.00001 -0.00000 -0.00000 0.00000 -0.00146 57 12XX -0.00014 -0.00001 -0.00004 -0.00003 -0.13277 58 12YY -0.00018 -0.00005 -0.00004 -0.00001 -0.13236 59 12ZZ -0.00009 0.00000 -0.00004 -0.00000 -0.13249 60 12XY 0.00002 0.00000 0.00002 -0.00003 -0.00014 61 12XZ 0.00001 0.00001 -0.00001 0.00002 0.00056 62 12YZ -0.00005 0.00002 0.00003 -0.00002 -0.00025 63 5 C 1S -0.01432 0.00075 0.00050 0.00064 0.00014 64 2S -0.00107 -0.00002 0.00019 0.00034 0.00116 65 2PX 0.00022 0.00004 -0.00001 -0.00001 -0.00012 66 2PY 0.00006 0.00005 -0.00002 -0.00002 0.00024 67 2PZ 0.00031 0.00000 -0.00004 0.00000 -0.00014 68 3S 0.00784 -0.00036 -0.00357 -0.00736 0.00200 69 3PX -0.00344 -0.00068 0.00084 0.00205 -0.00786 70 3PY -0.00429 -0.00098 0.00139 0.00331 -0.01238 71 3PZ -0.00379 -0.00019 0.00154 0.00044 -0.01103 72 4XX 0.00003 -0.00002 0.00004 0.00008 0.00002 73 4YY 0.00004 0.00002 0.00004 0.00008 -0.00076 74 4ZZ -0.00022 0.00009 0.00005 0.00007 0.00045 75 4XY -0.00005 0.00003 -0.00001 -0.00002 -0.00045 76 4XZ -0.00006 -0.00001 0.00001 -0.00001 0.00004 77 4YZ -0.00001 -0.00001 0.00003 -0.00001 0.00032 78 6 C 1S 0.98991 -0.03756 -0.06340 -0.01766 0.00018 79 2S 0.05008 -0.00206 -0.00367 -0.00130 0.00109 80 2PX 0.00011 0.00012 0.00017 0.00006 -0.00009 81 2PY -0.00024 0.00015 0.00025 0.00008 0.00062 82 2PZ 0.00037 0.00000 0.00004 -0.00002 0.00073 83 3S -0.02171 0.00136 0.00907 0.00779 -0.00518 84 3PX 0.00137 -0.00034 -0.00165 -0.00172 -0.00090 85 3PY 0.00365 -0.00036 -0.00284 -0.00305 -0.00335 86 3PZ -0.00468 -0.00036 0.00204 0.00272 -0.01637 87 4XX -0.00922 0.00030 0.00039 0.00002 0.00059 88 4YY -0.00912 0.00029 0.00029 0.00002 0.00018 89 4ZZ -0.00909 0.00027 0.00039 0.00008 -0.00051 90 4XY 0.00014 -0.00002 -0.00012 -0.00001 0.00001 91 4XZ 0.00006 -0.00003 -0.00006 -0.00001 -0.00006 92 4YZ 0.00006 -0.00004 -0.00008 -0.00002 0.00003 93 7 C 1S 0.07508 0.42508 0.85277 0.26861 0.00004 94 2S 0.00308 0.02083 0.04298 0.01387 0.00029 95 2PX -0.00008 0.00014 0.00006 0.00001 0.00006 96 2PY -0.00024 0.00021 0.00003 -0.00002 -0.00012 97 2PZ -0.00011 -0.00012 0.00038 0.00018 -0.00007 98 3S 0.00853 -0.00197 -0.01814 -0.01321 -0.00212 99 3PX 0.00161 -0.00051 -0.00069 -0.00073 -0.00331 100 3PY 0.00231 -0.00091 -0.00072 -0.00076 -0.00433 101 3PZ 0.00390 0.00102 -0.00483 -0.00540 0.00475 102 4XX -0.00094 -0.00421 -0.00799 -0.00239 -0.00007 103 4YY -0.00109 -0.00422 -0.00781 -0.00231 -0.00011 104 4ZZ -0.00087 -0.00418 -0.00788 -0.00230 0.00007 105 4XY -0.00010 0.00001 0.00020 0.00009 -0.00022 106 4XZ 0.00000 0.00005 -0.00003 -0.00004 -0.00001 107 4YZ -0.00001 0.00008 -0.00007 -0.00009 0.00007 108 8 C 1S 0.00612 0.85018 -0.29218 -0.42128 0.00002 109 2S 0.00039 0.04216 -0.01495 -0.02187 0.00013 110 2PX -0.00002 0.00005 -0.00012 -0.00018 0.00000 111 2PY -0.00007 0.00008 -0.00023 -0.00029 0.00001 112 2PZ 0.00006 0.00006 0.00027 -0.00024 -0.00003 113 3S -0.00430 -0.01021 0.00989 0.01867 -0.00352 114 3PX -0.00126 -0.00060 0.00196 0.00353 -0.00087 115 3PY -0.00202 -0.00100 0.00336 0.00574 -0.00196 116 3PZ -0.00074 -0.00054 -0.00106 0.00261 0.00289 117 4XX -0.00001 -0.00825 0.00267 0.00375 0.00004 118 4YY -0.00001 -0.00817 0.00260 0.00370 -0.00002 119 4ZZ -0.00005 -0.00812 0.00254 0.00336 0.00003 120 4XY 0.00002 0.00009 -0.00006 -0.00006 -0.00002 121 4XZ -0.00000 0.00001 0.00006 0.00000 -0.00002 122 4YZ -0.00001 0.00001 0.00012 0.00004 0.00007 123 9 C 1S -0.00031 0.28291 -0.41092 0.85726 -0.00001 124 2S -0.00027 0.01370 -0.02033 0.04335 -0.00007 125 2PX -0.00000 0.00007 -0.00005 0.00010 0.00008 126 2PY -0.00003 0.00010 -0.00010 0.00019 0.00019 127 2PZ 0.00002 0.00026 0.00003 -0.00032 -0.00003 128 3S 0.00420 0.00025 0.00163 -0.02236 0.00553 129 3PX 0.00080 -0.00016 -0.00028 -0.00218 0.00226 130 3PY 0.00149 -0.00015 -0.00053 -0.00405 0.00316 131 3PZ -0.00175 -0.00173 0.00115 0.00554 0.00176 132 4XX -0.00007 -0.00286 0.00400 -0.00802 0.00009 133 4YY -0.00003 -0.00284 0.00394 -0.00789 0.00006 134 4ZZ 0.00002 -0.00293 0.00401 -0.00773 -0.00007 135 4XY 0.00004 0.00002 -0.00006 0.00015 0.00007 136 4XZ 0.00001 -0.00004 -0.00001 0.00008 0.00004 137 4YZ 0.00001 -0.00006 -0.00001 0.00011 0.00003 138 10 C 1S 0.00144 -0.01426 0.01921 -0.03715 0.00002 139 2S 0.00018 -0.00088 0.00102 -0.00257 0.00012 140 2PX 0.00004 0.00008 -0.00007 0.00016 0.00004 141 2PY -0.00002 0.00011 -0.00014 0.00025 -0.00035 142 2PZ 0.00002 0.00007 -0.00004 0.00013 0.00003 143 3S -0.00418 0.00047 0.00012 0.01188 -0.00527 144 3PX 0.00068 -0.00023 -0.00004 -0.00154 0.00324 145 3PY 0.00088 -0.00039 -0.00002 -0.00228 0.00682 146 3PZ 0.00266 0.00030 -0.00099 -0.00513 0.00397 147 4XX 0.00007 0.00008 -0.00013 0.00007 -0.00002 148 4YY 0.00006 0.00007 -0.00005 -0.00003 0.00011 149 4ZZ 0.00007 0.00009 -0.00011 0.00013 -0.00005 150 4XY 0.00003 -0.00000 0.00008 -0.00010 -0.00000 151 4XZ -0.00002 0.00002 -0.00000 -0.00002 -0.00008 152 4YZ 0.00000 0.00003 0.00000 -0.00002 -0.00018 153 11 H 1S -0.00009 -0.00002 0.00006 0.00011 -0.00051 154 2S -0.00069 -0.00005 0.00037 0.00103 -0.00147 155 12 H 1S 0.00006 -0.00013 0.00013 -0.00045 -0.00008 156 2S 0.00061 0.00075 -0.00097 0.00015 -0.00005 157 13 H 1S -0.00008 -0.00037 0.00016 0.00026 0.00003 158 2S -0.00044 0.00132 0.00017 0.00066 -0.00030 159 14 H 1S 0.00002 -0.00019 -0.00039 -0.00020 0.00031 160 2S 0.00109 0.00093 0.00058 -0.00057 0.00146 161 15 H 1S -0.00042 -0.00002 0.00006 0.00012 0.00079 162 2S 0.00063 -0.00005 0.00051 0.00094 -0.01084 163 16 C 1S 0.00001 0.00000 0.00000 0.00000 0.00015 164 2S 0.00010 0.00003 0.00003 0.00002 0.00016 165 2PX 0.00002 0.00004 0.00004 0.00002 -0.00060 166 2PY -0.00002 -0.00000 -0.00000 -0.00000 0.00067 167 2PZ -0.00004 -0.00000 0.00000 -0.00000 -0.00024 168 3S -0.00119 -0.00043 -0.00047 -0.00024 0.00113 169 3PX -0.00134 -0.00142 -0.00123 -0.00063 -0.00311 170 3PY 0.00262 0.00086 0.00064 0.00036 -0.00256 171 3PZ 0.00172 0.00051 0.00033 0.00023 -0.00112 172 4XX 0.00005 0.00000 -0.00000 -0.00000 0.00077 173 4YY -0.00005 -0.00002 -0.00001 -0.00001 0.00063 174 4ZZ 0.00000 -0.00000 -0.00000 0.00000 0.00032 175 4XY -0.00002 -0.00001 -0.00001 -0.00000 -0.00019 176 4XZ -0.00002 -0.00001 -0.00000 -0.00000 0.00011 177 4YZ -0.00007 -0.00001 -0.00001 -0.00001 -0.00016 178 17 C 1S 0.00000 -0.00001 -0.00001 -0.00001 -0.00002 179 2S 0.00002 -0.00006 -0.00005 -0.00003 0.00003 180 2PX -0.00012 -0.00008 -0.00008 -0.00004 0.00019 181 2PY -0.00016 -0.00003 -0.00003 -0.00002 -0.00014 182 2PZ 0.00001 -0.00002 -0.00002 -0.00001 -0.00008 183 3S 0.00020 0.00076 0.00062 0.00032 -0.00348 184 3PX 0.00250 0.00150 0.00132 0.00064 -0.00291 185 3PY 0.00283 0.00048 0.00033 0.00024 0.00013 186 3PZ 0.00108 0.00021 0.00017 0.00011 -0.00013 187 4XX -0.00001 0.00005 0.00005 0.00002 -0.00009 188 4YY 0.00013 0.00003 0.00003 0.00002 -0.00009 189 4ZZ 0.00006 0.00001 0.00001 0.00001 -0.00016 190 4XY 0.00006 0.00001 0.00001 0.00001 0.00005 191 4XZ 0.00003 0.00000 0.00000 0.00000 0.00004 192 4YZ 0.00005 0.00002 0.00002 0.00001 -0.00007 193 18 C 1S -0.00000 0.00000 0.00000 0.00000 -0.00005 194 2S -0.00001 0.00006 0.00006 0.00002 -0.00029 195 2PX 0.00001 0.00002 0.00002 0.00001 -0.00007 196 2PY 0.00002 -0.00000 -0.00000 -0.00000 0.00002 197 2PZ -0.00001 -0.00000 -0.00000 0.00000 0.00000 198 3S -0.00030 -0.00115 -0.00105 -0.00049 0.00397 199 3PX -0.00113 -0.00015 -0.00010 -0.00009 -0.00020 200 3PY -0.00098 -0.00074 -0.00065 -0.00032 0.00189 201 3PZ -0.00031 -0.00039 -0.00036 -0.00017 0.00117 202 4XX 0.00004 0.00000 -0.00000 0.00000 0.00005 203 4YY -0.00005 -0.00001 -0.00001 -0.00000 0.00000 204 4ZZ -0.00001 0.00001 0.00001 0.00000 -0.00005 205 4XY 0.00001 0.00001 0.00001 0.00000 -0.00004 206 4XZ -0.00001 0.00000 0.00001 0.00000 -0.00003 207 4YZ -0.00001 -0.00002 -0.00002 -0.00001 0.00007 208 19 C 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00001 209 2S -0.00000 -0.00005 -0.00004 -0.00002 0.00009 210 2PX -0.00003 -0.00001 -0.00001 -0.00000 0.00002 211 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00002 212 2PZ 0.00001 -0.00000 -0.00000 -0.00000 0.00002 213 3S 0.00093 0.00091 0.00081 0.00042 -0.00135 214 3PX -0.00049 -0.00042 -0.00036 -0.00019 0.00137 215 3PY -0.00012 0.00026 0.00025 0.00011 -0.00036 216 3PZ -0.00013 0.00015 0.00015 0.00007 -0.00035 217 4XX 0.00001 0.00001 0.00000 0.00000 -0.00003 218 4YY -0.00000 -0.00000 -0.00000 -0.00000 0.00001 219 4ZZ 0.00001 -0.00001 -0.00001 -0.00000 0.00000 220 4XY -0.00000 0.00000 0.00000 0.00000 -0.00001 221 4XZ 0.00001 0.00000 0.00000 0.00000 -0.00000 222 4YZ -0.00000 0.00001 0.00001 0.00000 -0.00001 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00004 224 2S 0.00002 0.00004 0.00004 0.00002 -0.00023 225 2PX 0.00002 0.00001 0.00001 0.00000 -0.00001 226 2PY -0.00001 -0.00001 -0.00000 -0.00000 -0.00001 227 2PZ -0.00001 -0.00000 -0.00000 -0.00000 -0.00004 228 3S -0.00088 -0.00088 -0.00077 -0.00039 0.00303 229 3PX 0.00049 0.00049 0.00044 0.00023 -0.00130 230 3PY -0.00024 0.00014 0.00016 0.00007 0.00091 231 3PZ -0.00009 0.00007 0.00007 0.00003 0.00080 232 4XX -0.00000 -0.00000 -0.00000 -0.00000 0.00001 233 4YY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 234 4ZZ 0.00000 0.00001 0.00001 0.00000 -0.00005 235 4XY 0.00001 0.00000 0.00000 0.00000 -0.00003 236 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00005 237 4YZ 0.00000 -0.00001 -0.00001 -0.00000 0.00007 238 21 C 1S -0.00000 -0.00001 -0.00001 -0.00000 -0.00000 239 2S -0.00003 -0.00006 -0.00006 -0.00003 0.00005 240 2PX -0.00002 -0.00002 -0.00001 -0.00001 0.00018 241 2PY -0.00000 -0.00000 -0.00000 -0.00000 0.00001 242 2PZ 0.00000 -0.00000 0.00000 -0.00000 0.00008 243 3S 0.00085 0.00117 0.00106 0.00053 -0.00016 244 3PX 0.00046 -0.00016 -0.00019 -0.00008 -0.00338 245 3PY -0.00095 -0.00068 -0.00059 -0.00031 0.00044 246 3PZ -0.00061 -0.00038 -0.00031 -0.00017 -0.00022 247 4XX -0.00002 0.00001 0.00001 0.00000 -0.00007 248 4YY 0.00001 0.00000 0.00000 0.00000 -0.00005 249 4ZZ 0.00000 -0.00001 -0.00001 -0.00001 -0.00004 250 4XY 0.00001 0.00001 0.00001 0.00001 0.00001 251 4XZ 0.00002 0.00001 0.00000 0.00000 0.00009 252 4YZ 0.00002 0.00001 0.00001 0.00001 -0.00002 253 22 H 1S 0.00005 0.00002 0.00002 0.00001 -0.00025 254 2S 0.00035 0.00023 0.00020 0.00011 0.00117 255 23 H 1S -0.00000 -0.00001 -0.00001 -0.00001 -0.00005 256 2S -0.00006 -0.00012 -0.00011 -0.00006 0.00008 257 24 H 1S -0.00001 0.00001 0.00001 0.00000 -0.00009 258 2S 0.00001 0.00012 0.00010 0.00005 -0.00034 259 25 H 1S -0.00007 -0.00003 -0.00002 -0.00001 0.00002 260 2S -0.00053 -0.00027 -0.00023 -0.00012 0.00059 261 26 H 1S -0.00017 -0.00002 -0.00003 -0.00002 -0.00019 262 2S 0.00367 0.00103 0.00089 0.00046 -0.00087 263 27 H 1S 0.00002 -0.00001 -0.00000 0.00000 0.00041 264 2S -0.00006 -0.00012 -0.00012 -0.00007 -0.00749 21 22 23 24 25 O O O O O Eigenvalues -- -6.56887 -6.55593 -6.55455 -2.68433 -2.68110 1 1 C 1S 0.00017 -0.00002 0.00009 -0.00011 -0.00008 2 2S 0.00111 -0.00017 0.00043 -0.00086 -0.00077 3 2PX 0.00007 -0.00014 0.00005 0.00029 0.00009 4 2PY -0.00021 -0.00002 -0.00005 -0.00004 -0.00028 5 2PZ -0.00012 0.00006 -0.00008 0.00009 0.00020 6 3S -0.00894 -0.00072 -0.00337 0.00266 0.00160 7 3PX 0.00473 0.00059 -0.00125 -0.00058 -0.00033 8 3PY 0.00149 0.00131 0.00125 -0.00024 0.00189 9 3PZ 0.00346 -0.00019 0.00120 -0.00078 -0.00062 10 4XX -0.00019 -0.00003 0.00008 -0.00015 -0.00001 11 4YY 0.00007 0.00008 0.00019 -0.00005 -0.00006 12 4ZZ 0.00010 0.00003 0.00009 -0.00016 -0.00010 13 4XY 0.00030 -0.00009 0.00007 -0.00011 -0.00012 14 4XZ -0.00030 0.00004 -0.00004 0.00011 0.00013 15 4YZ 0.00000 -0.00006 -0.00002 -0.00016 -0.00009 16 2 C 1S -0.00041 -0.00005 -0.00002 0.00042 -0.00004 17 2S -0.00264 -0.00036 -0.00007 -0.00082 0.00031 18 2PX -0.00008 0.00002 0.00001 -0.00002 -0.00049 19 2PY -0.00035 0.00003 0.00004 -0.00084 0.00019 20 2PZ 0.00044 0.00000 0.00024 0.00060 -0.00011 21 3S 0.01348 0.00305 0.00062 0.00515 -0.00236 22 3PX 0.00338 -0.00019 -0.00022 -0.00081 0.00194 23 3PY -0.00110 -0.00147 -0.00142 0.00322 -0.00060 24 3PZ -0.00460 -0.00011 -0.00122 -0.00187 -0.00050 25 4XX -0.00032 -0.00004 0.00000 -0.00016 0.00002 26 4YY -0.00001 0.00006 0.00003 -0.00079 0.00017 27 4ZZ -0.00040 -0.00005 -0.00010 -0.00047 0.00013 28 4XY -0.00000 0.00002 0.00001 0.00012 -0.00006 29 4XZ 0.00016 0.00005 -0.00000 -0.00003 0.00002 30 4YZ -0.00061 -0.00002 0.00004 0.00061 -0.00013 31 3 H 1S 0.00018 0.00000 0.00003 -0.00046 0.00031 32 2S -0.00033 -0.00037 0.00131 -0.00023 0.00074 33 4 Br 1S 0.00087 0.00004 -0.00003 0.00052 0.00000 34 2S -0.00558 -0.00025 0.00003 -0.00330 -0.00001 35 3S 0.00672 0.00031 0.00022 0.00397 0.00002 36 4S 0.00619 0.00028 -0.00020 0.00510 0.00002 37 5S -0.00174 -0.00003 -0.00130 0.00240 -0.00007 38 6S 0.01162 0.00060 0.00384 -0.01292 0.00033 39 7PX 0.09137 -0.41804 0.05707 -0.00028 -0.00096 40 7PY -0.33417 -0.10738 -0.25111 0.00086 -0.00027 41 7PZ 0.25727 0.00899 -0.34649 -0.00066 0.00003 42 8PX -0.22421 1.02603 -0.14007 0.00073 0.00252 43 8PY 0.81997 0.26354 0.61631 -0.00226 0.00070 44 8PZ -0.63130 -0.02206 0.85044 0.00174 -0.00009 45 9PX -0.00618 0.02578 -0.00346 -0.00008 -0.00044 46 9PY 0.02271 0.00671 0.01579 0.00008 -0.00011 47 9PZ -0.01713 -0.00047 0.02122 -0.00013 0.00007 48 10PX 0.00184 -0.00654 0.00082 -0.00089 -0.00128 49 10PY -0.00617 -0.00180 -0.00462 0.00410 -0.00055 50 10PZ 0.00444 0.00004 -0.00511 -0.00308 0.00015 51 11XX -0.00240 0.00049 -0.00025 0.46367 -0.35187 52 11YY -0.00432 -0.00083 -0.00190 -0.41025 0.33198 53 11ZZ -0.00350 -0.00016 0.00165 -0.05860 0.01985 54 11XY 0.00061 -0.00156 0.00042 0.29358 0.69485 55 11XZ -0.00050 0.00128 0.00010 -0.21181 -0.57104 56 11YZ 0.00189 0.00033 -0.00058 0.77567 -0.16059 57 12XX -0.00381 -0.00033 -0.00113 0.01340 -0.00803 58 12YY -0.00457 -0.00012 -0.00084 -0.00734 0.00753 59 12ZZ -0.00431 -0.00013 -0.00106 0.00111 0.00053 60 12XY 0.00016 0.00017 0.00001 0.00685 0.01558 61 12XZ 0.00008 -0.00009 0.00005 -0.00496 -0.01275 62 12YZ 0.00030 0.00004 0.00003 0.01859 -0.00367 63 5 C 1S 0.00010 0.00007 -0.00001 -0.00002 0.00003 64 2S 0.00042 0.00032 -0.00008 0.00001 0.00005 65 2PX 0.00016 -0.00008 0.00000 -0.00008 0.00001 66 2PY 0.00036 0.00016 0.00006 -0.00020 0.00026 67 2PZ -0.00032 0.00003 -0.00010 0.00002 -0.00018 68 3S -0.00119 -0.00204 0.00282 -0.00130 0.00068 69 3PX -0.00432 -0.00066 -0.00157 0.00048 -0.00042 70 3PY -0.00676 -0.00164 -0.00234 0.00019 -0.00056 71 3PZ 0.00359 -0.00184 -0.00110 0.00008 0.00298 72 4XX 0.00017 0.00012 -0.00000 -0.00007 0.00006 73 4YY 0.00010 -0.00002 -0.00007 -0.00022 0.00022 74 4ZZ 0.00014 0.00013 0.00012 -0.00007 0.00007 75 4XY -0.00011 -0.00008 -0.00001 -0.00005 0.00001 76 4XZ -0.00014 -0.00000 0.00000 0.00010 -0.00009 77 4YZ -0.00006 0.00001 0.00000 0.00003 -0.00008 78 6 C 1S 0.00002 0.00003 0.00002 -0.00002 -0.00001 79 2S -0.00005 0.00012 0.00007 -0.00007 -0.00015 80 2PX 0.00016 -0.00008 0.00002 -0.00001 -0.00000 81 2PY 0.00026 0.00016 0.00017 -0.00007 0.00017 82 2PZ 0.00019 0.00002 0.00021 -0.00000 0.00005 83 3S 0.00316 -0.00086 0.00048 0.00029 0.00254 84 3PX -0.00002 -0.00006 -0.00053 0.00015 0.00011 85 3PY -0.00016 -0.00077 -0.00113 0.00061 -0.00052 86 3PZ -0.00093 -0.00106 -0.00382 0.00046 0.00095 87 4XX 0.00018 0.00011 0.00012 -0.00006 0.00004 88 4YY 0.00024 0.00010 0.00013 -0.00006 0.00012 89 4ZZ -0.00005 -0.00003 -0.00016 -0.00000 0.00002 90 4XY 0.00012 0.00001 0.00007 -0.00003 0.00007 91 4XZ 0.00010 -0.00001 0.00000 -0.00001 0.00004 92 4YZ 0.00017 0.00004 0.00003 -0.00001 0.00006 93 7 C 1S 0.00005 0.00001 0.00002 -0.00001 0.00002 94 2S 0.00031 0.00006 0.00015 -0.00005 0.00011 95 2PX -0.00002 0.00002 0.00000 -0.00001 -0.00002 96 2PY -0.00007 -0.00003 -0.00005 0.00001 -0.00006 97 2PZ 0.00008 0.00000 -0.00002 -0.00000 0.00002 98 3S -0.00152 -0.00059 -0.00164 0.00060 -0.00105 99 3PX -0.00078 -0.00043 -0.00101 0.00024 -0.00032 100 3PY -0.00115 -0.00026 -0.00142 0.00024 -0.00018 101 3PZ -0.00070 -0.00009 0.00082 0.00009 -0.00073 102 4XX 0.00006 -0.00002 0.00000 -0.00000 -0.00001 103 4YY -0.00006 -0.00001 -0.00005 0.00001 -0.00002 104 4ZZ 0.00005 -0.00001 0.00003 -0.00001 0.00000 105 4XY -0.00014 -0.00004 -0.00009 0.00003 -0.00005 106 4XZ -0.00003 -0.00002 -0.00001 0.00000 -0.00002 107 4YZ -0.00004 0.00001 0.00001 0.00000 -0.00001 108 8 C 1S 0.00001 -0.00000 -0.00000 -0.00000 -0.00000 109 2S 0.00005 -0.00002 -0.00000 -0.00000 -0.00001 110 2PX 0.00003 0.00001 -0.00001 0.00001 -0.00000 111 2PY 0.00005 0.00001 -0.00002 0.00001 0.00001 112 2PZ -0.00011 0.00001 -0.00003 0.00001 -0.00005 113 3S -0.00068 0.00048 -0.00088 0.00021 0.00015 114 3PX -0.00019 0.00013 0.00003 -0.00007 0.00013 115 3PY -0.00030 0.00010 -0.00012 -0.00013 0.00016 116 3PZ 0.00024 0.00034 0.00059 0.00007 -0.00011 117 4XX 0.00003 0.00001 0.00000 -0.00000 0.00000 118 4YY 0.00003 -0.00000 -0.00001 -0.00000 0.00000 119 4ZZ -0.00001 0.00001 -0.00000 0.00000 -0.00000 120 4XY -0.00000 0.00000 0.00000 -0.00000 0.00001 121 4XZ -0.00002 -0.00001 -0.00000 0.00001 -0.00001 122 4YZ -0.00001 0.00001 0.00001 -0.00000 -0.00001 123 9 C 1S -0.00002 0.00001 0.00000 -0.00001 -0.00001 124 2S -0.00014 0.00007 0.00000 -0.00003 -0.00005 125 2PX 0.00007 0.00002 0.00003 0.00002 0.00001 126 2PY 0.00014 0.00002 0.00003 -0.00001 0.00003 127 2PZ 0.00007 -0.00003 0.00003 -0.00001 0.00004 128 3S 0.00299 -0.00011 0.00038 0.00054 0.00030 129 3PX 0.00094 0.00005 0.00018 0.00010 0.00014 130 3PY 0.00140 -0.00003 0.00040 0.00034 0.00015 131 3PZ -0.00062 0.00068 -0.00018 0.00040 -0.00043 132 4XX 0.00002 0.00003 0.00001 -0.00001 0.00000 133 4YY 0.00005 0.00001 0.00001 0.00002 0.00001 134 4ZZ -0.00003 -0.00000 -0.00001 -0.00001 -0.00001 135 4XY 0.00006 -0.00001 -0.00000 0.00001 0.00002 136 4XZ 0.00001 0.00001 0.00000 0.00001 0.00000 137 4YZ 0.00001 -0.00000 -0.00001 0.00001 0.00000 138 10 C 1S 0.00007 -0.00002 0.00002 -0.00001 0.00002 139 2S 0.00046 -0.00007 0.00012 -0.00010 0.00015 140 2PX -0.00007 0.00001 -0.00002 -0.00008 -0.00001 141 2PY -0.00025 -0.00003 -0.00003 0.00001 -0.00011 142 2PZ 0.00003 0.00001 0.00000 -0.00000 0.00003 143 3S -0.00766 0.00079 -0.00176 0.00026 -0.00235 144 3PX 0.00034 0.00033 0.00013 0.00062 -0.00047 145 3PY 0.00074 0.00097 0.00009 0.00077 -0.00060 146 3PZ 0.00401 -0.00010 0.00151 -0.00054 0.00103 147 4XX 0.00008 -0.00003 0.00003 -0.00003 -0.00001 148 4YY -0.00001 0.00001 0.00001 -0.00001 -0.00006 149 4ZZ -0.00007 -0.00004 -0.00004 0.00005 -0.00004 150 4XY -0.00012 0.00001 -0.00001 0.00001 -0.00006 151 4XZ 0.00000 0.00001 0.00002 -0.00002 0.00003 152 4YZ 0.00003 -0.00003 0.00003 -0.00006 0.00005 153 11 H 1S -0.00017 -0.00005 -0.00000 -0.00005 0.00001 154 2S -0.00083 -0.00016 -0.00064 0.00027 -0.00017 155 12 H 1S 0.00004 -0.00004 0.00003 -0.00003 0.00003 156 2S 0.00028 -0.00020 0.00011 -0.00005 0.00014 157 13 H 1S 0.00001 0.00000 0.00005 -0.00002 0.00001 158 2S -0.00008 0.00003 0.00007 -0.00005 0.00005 159 14 H 1S -0.00003 0.00000 0.00008 -0.00001 -0.00003 160 2S -0.00036 -0.00007 0.00029 0.00006 -0.00024 161 15 H 1S 0.00009 0.00012 0.00029 0.00001 0.00005 162 2S -0.00136 -0.00045 -0.00280 -0.00002 0.00010 163 16 C 1S -0.00000 -0.00003 -0.00001 0.00001 0.00001 164 2S -0.00013 -0.00010 -0.00011 0.00002 0.00004 165 2PX -0.00005 0.00012 -0.00006 -0.00007 -0.00001 166 2PY 0.00010 -0.00003 0.00005 0.00002 0.00008 167 2PZ 0.00002 0.00005 -0.00008 -0.00003 -0.00004 168 3S 0.00119 0.00110 0.00223 -0.00025 0.00042 169 3PX -0.00247 -0.00123 -0.00085 0.00144 -0.00016 170 3PY 0.00019 -0.00036 0.00134 -0.00032 -0.00102 171 3PZ -0.00049 -0.00007 0.00100 0.00012 0.00026 172 4XX 0.00018 -0.00007 0.00009 0.00004 0.00002 173 4YY 0.00007 -0.00006 0.00004 0.00002 0.00000 174 4ZZ -0.00002 -0.00005 -0.00001 0.00001 0.00005 175 4XY -0.00011 0.00000 -0.00004 0.00001 0.00002 176 4XZ 0.00001 -0.00003 -0.00000 -0.00001 -0.00004 177 4YZ -0.00004 0.00003 -0.00000 0.00001 0.00002 178 17 C 1S 0.00001 0.00000 -0.00001 -0.00000 0.00001 179 2S 0.00006 0.00004 -0.00004 -0.00002 0.00004 180 2PX 0.00008 0.00002 0.00003 -0.00001 0.00001 181 2PY -0.00009 -0.00000 -0.00002 0.00003 -0.00001 182 2PZ -0.00006 -0.00000 0.00000 0.00000 0.00000 183 3S -0.00180 -0.00049 0.00029 0.00037 -0.00062 184 3PX -0.00063 0.00003 -0.00016 -0.00025 -0.00033 185 3PY 0.00044 -0.00056 0.00055 -0.00007 -0.00025 186 3PZ 0.00042 -0.00030 0.00015 -0.00007 -0.00038 187 4XX -0.00003 0.00001 -0.00001 0.00000 0.00000 188 4YY -0.00003 -0.00002 -0.00000 0.00002 0.00001 189 4ZZ -0.00000 0.00000 -0.00004 -0.00001 -0.00001 190 4XY 0.00006 0.00002 0.00003 -0.00003 -0.00000 191 4XZ 0.00006 0.00000 0.00002 -0.00003 -0.00002 192 4YZ 0.00001 -0.00002 0.00000 -0.00000 -0.00003 193 18 C 1S -0.00002 -0.00000 -0.00001 0.00001 -0.00000 194 2S -0.00014 -0.00000 -0.00006 0.00004 -0.00001 195 2PX -0.00004 -0.00002 -0.00000 0.00001 -0.00001 196 2PY 0.00000 -0.00001 -0.00001 0.00001 0.00000 197 2PZ -0.00001 -0.00000 -0.00001 0.00001 0.00001 198 3S 0.00140 -0.00033 0.00045 -0.00009 0.00015 199 3PX -0.00056 0.00015 -0.00022 0.00010 0.00008 200 3PY 0.00073 0.00008 0.00025 -0.00010 0.00012 201 3PZ 0.00039 0.00003 0.00021 -0.00006 0.00012 202 4XX 0.00002 -0.00000 0.00001 -0.00001 -0.00000 203 4YY -0.00000 0.00001 -0.00000 0.00001 0.00000 204 4ZZ -0.00004 -0.00000 -0.00001 0.00001 0.00000 205 4XY -0.00004 -0.00001 -0.00001 0.00001 0.00000 206 4XZ -0.00001 -0.00000 -0.00001 0.00001 -0.00001 207 4YZ 0.00003 0.00000 0.00002 -0.00001 0.00000 208 19 C 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 209 2S 0.00002 -0.00002 -0.00000 0.00001 0.00000 210 2PX 0.00003 0.00003 0.00001 -0.00001 0.00001 211 2PY 0.00003 0.00001 -0.00001 -0.00001 0.00000 212 2PZ 0.00001 0.00001 0.00000 0.00000 0.00001 213 3S -0.00029 0.00013 -0.00025 -0.00017 -0.00006 214 3PX 0.00003 -0.00026 0.00000 0.00004 0.00000 215 3PY -0.00032 0.00011 -0.00016 -0.00003 0.00004 216 3PZ -0.00018 0.00007 -0.00014 -0.00003 -0.00001 217 4XX -0.00001 -0.00001 -0.00000 0.00000 -0.00000 218 4YY 0.00000 0.00000 -0.00000 -0.00000 0.00000 219 4ZZ -0.00000 -0.00000 -0.00001 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 221 4XZ -0.00000 0.00000 0.00000 -0.00000 0.00000 222 4YZ -0.00000 0.00001 -0.00000 -0.00000 0.00000 223 20 C 1S -0.00000 0.00001 -0.00001 -0.00000 0.00001 224 2S 0.00000 0.00009 -0.00005 -0.00001 0.00003 225 2PX 0.00004 0.00003 0.00002 -0.00001 -0.00000 226 2PY -0.00002 -0.00002 0.00001 0.00001 -0.00001 227 2PZ -0.00004 -0.00001 -0.00000 0.00001 0.00001 228 3S -0.00067 -0.00137 0.00012 0.00036 -0.00023 229 3PX 0.00038 0.00071 -0.00019 -0.00022 0.00019 230 3PY -0.00037 -0.00026 -0.00027 -0.00009 -0.00002 231 3PZ -0.00010 -0.00018 -0.00006 -0.00003 -0.00002 232 4XX -0.00002 -0.00002 0.00000 0.00001 -0.00001 233 4YY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 234 4ZZ -0.00001 0.00002 -0.00001 0.00000 0.00001 235 4XY 0.00002 0.00002 0.00000 -0.00000 0.00001 236 4XZ -0.00000 0.00002 -0.00001 -0.00000 0.00001 237 4YZ 0.00001 -0.00002 0.00001 0.00000 -0.00001 238 21 C 1S 0.00000 -0.00001 -0.00000 0.00001 -0.00000 239 2S 0.00000 -0.00007 -0.00000 0.00007 -0.00002 240 2PX -0.00006 -0.00009 0.00002 0.00002 -0.00003 241 2PY 0.00003 0.00003 -0.00001 -0.00001 0.00003 242 2PZ 0.00008 0.00002 0.00002 -0.00000 -0.00001 243 3S 0.00137 0.00156 -0.00020 -0.00102 0.00048 244 3PX 0.00027 0.00061 0.00035 0.00031 -0.00002 245 3PY -0.00114 -0.00079 -0.00005 0.00056 -0.00002 246 3PZ -0.00072 -0.00043 -0.00021 0.00022 -0.00013 247 4XX -0.00001 0.00003 -0.00004 -0.00001 0.00002 248 4YY 0.00003 0.00001 -0.00000 -0.00001 -0.00002 249 4ZZ -0.00001 0.00000 -0.00001 0.00002 0.00001 250 4XY -0.00000 -0.00003 -0.00000 -0.00002 -0.00003 251 4XZ -0.00001 -0.00002 0.00002 -0.00000 0.00000 252 4YZ -0.00001 0.00002 0.00002 -0.00001 0.00001 253 22 H 1S 0.00005 0.00009 0.00002 -0.00001 0.00001 254 2S 0.00054 0.00000 -0.00000 -0.00019 -0.00003 255 23 H 1S 0.00001 0.00001 0.00002 0.00001 -0.00000 256 2S -0.00003 -0.00010 0.00012 0.00005 -0.00006 257 24 H 1S -0.00001 0.00002 -0.00000 0.00000 0.00000 258 2S -0.00006 0.00009 -0.00001 -0.00001 0.00001 259 25 H 1S 0.00001 0.00002 0.00000 -0.00000 0.00001 260 2S 0.00019 0.00008 0.00011 -0.00004 0.00005 261 26 H 1S -0.00007 0.00002 -0.00004 0.00001 0.00001 262 2S 0.00038 -0.00020 0.00005 -0.00026 -0.00023 263 27 H 1S 0.00014 -0.00035 -0.00011 -0.00011 -0.00039 264 2S -0.00175 0.00048 0.00036 0.00010 -0.00048 26 27 28 29 30 O O O O O Eigenvalues -- -2.67999 -2.66968 -2.66965 -0.91912 -0.89096 1 1 C 1S -0.00004 -0.00006 0.00007 -0.09328 -0.04251 2 2S -0.00022 -0.00031 0.00048 0.18475 0.08712 3 2PX 0.00005 -0.00000 -0.00000 0.01133 -0.06132 4 2PY -0.00000 0.00008 0.00015 -0.02828 0.00960 5 2PZ 0.00006 0.00011 -0.00003 -0.02058 0.00075 6 3S 0.00076 0.00345 -0.00345 0.13667 0.03170 7 3PX -0.00099 0.00116 0.00201 0.01772 -0.00937 8 3PY 0.00133 -0.00175 -0.00106 -0.00393 0.01988 9 3PZ 0.00064 -0.00118 0.00038 -0.00520 0.01015 10 4XX -0.00006 -0.00003 -0.00004 0.00486 0.00429 11 4YY -0.00011 -0.00007 0.00006 -0.00153 -0.00207 12 4ZZ -0.00004 -0.00007 0.00009 -0.00679 -0.00312 13 4XY -0.00009 -0.00009 0.00005 -0.00360 0.00175 14 4XZ -0.00003 -0.00005 -0.00010 -0.00154 0.00186 15 4YZ -0.00002 0.00004 0.00000 0.00546 0.00058 16 2 C 1S -0.00003 -0.00001 -0.00008 -0.06844 -0.09418 17 2S -0.00018 -0.00003 -0.00024 0.13065 0.17992 18 2PX -0.00012 -0.00001 -0.00013 0.03162 0.00390 19 2PY 0.00036 -0.00007 -0.00009 -0.00315 -0.01078 20 2PZ 0.00030 0.00004 0.00006 -0.00681 -0.01217 21 3S 0.00199 0.00035 0.00151 0.10824 0.16298 22 3PX -0.00104 -0.00038 0.00276 0.01206 0.00240 23 3PY -0.00376 0.00023 0.00142 0.00975 -0.00509 24 3PZ -0.00279 0.00009 -0.00092 -0.00211 -0.01074 25 4XX -0.00002 -0.00004 0.00004 0.00307 -0.00036 26 4YY 0.00002 -0.00001 -0.00009 -0.00190 0.00006 27 4ZZ -0.00000 0.00000 -0.00000 -0.00245 -0.00251 28 4XY 0.00012 0.00003 -0.00002 0.00161 0.00396 29 4XZ 0.00009 -0.00000 0.00000 -0.00064 -0.00020 30 4YZ -0.00001 0.00002 -0.00002 0.00053 0.00153 31 3 H 1S 0.00043 -0.00013 -0.00005 0.03192 0.04877 32 2S 0.00100 0.00027 0.00072 -0.00105 0.00328 33 4 Br 1S 0.00000 -0.00000 -0.00006 -0.00794 -0.01292 34 2S 0.00001 -0.00001 0.00043 0.05140 0.08358 35 3S -0.00008 0.00009 -0.00055 -0.05943 -0.09644 36 4S 0.00006 -0.00006 -0.00065 -0.10501 -0.17141 37 5S 0.00061 -0.00046 0.00012 0.09195 0.14613 38 6S -0.00156 0.00139 0.00007 0.02846 0.06272 39 7PX -0.00013 0.00002 -0.00004 0.00163 0.00142 40 7PY 0.00057 -0.00002 -0.00005 -0.00478 -0.00698 41 7PZ 0.00082 -0.00004 0.00000 0.00343 0.00486 42 8PX 0.00034 -0.00006 0.00010 -0.00493 -0.00431 43 8PY -0.00149 0.00004 0.00014 0.01450 0.02118 44 8PZ -0.00216 0.00010 -0.00000 -0.01038 -0.01474 45 9PX -0.00008 0.00004 -0.00016 0.00815 0.00699 46 9PY 0.00018 0.00016 0.00005 -0.02378 -0.03475 47 9PZ 0.00055 -0.00001 -0.00018 0.01673 0.02407 48 10PX -0.00007 -0.00004 0.00017 0.00169 0.00247 49 10PY 0.00091 -0.00037 0.00021 -0.00448 -0.00973 50 10PZ 0.00074 -0.00010 0.00015 0.00339 0.00733 51 11XX -0.04839 -0.22136 0.77449 0.02915 0.04735 52 11YY -0.77648 0.24910 -0.22063 0.02439 0.03962 53 11ZZ 0.82501 -0.02791 -0.55311 0.02714 0.04373 54 11XY 0.22539 0.52793 0.30434 0.00199 0.00188 55 11XZ 0.08932 0.77669 0.09537 -0.00162 -0.00168 56 11YZ -0.27387 0.18691 -0.50340 0.00492 0.00699 57 12XX -0.00061 -0.00508 0.01630 0.00966 0.01243 58 12YY -0.01689 0.00494 -0.00489 0.01650 0.02394 59 12ZZ 0.01878 -0.00102 -0.01185 0.01231 0.01841 60 12XY 0.00492 0.01113 0.00642 -0.00272 -0.00332 61 12XZ 0.00194 0.01637 0.00199 0.00236 0.00293 62 12YZ -0.00610 0.00400 -0.01060 -0.00694 -0.01115 63 5 C 1S 0.00003 0.00003 0.00002 -0.04119 -0.09454 64 2S 0.00023 0.00006 0.00011 0.07799 0.18176 65 2PX 0.00004 0.00004 -0.00002 0.01161 0.00185 66 2PY -0.00010 0.00013 0.00009 0.01148 0.00178 67 2PZ 0.00010 -0.00004 -0.00007 0.00391 0.00262 68 3S -0.00371 0.00075 -0.00104 0.04649 0.10208 69 3PX -0.00227 -0.00041 0.00030 0.00483 -0.00297 70 3PY -0.00239 -0.00080 0.00055 0.00360 -0.01075 71 3PZ -0.00052 -0.00057 0.00336 0.00796 0.00741 72 4XX -0.00010 0.00008 0.00002 -0.00183 -0.00631 73 4YY -0.00006 0.00004 0.00011 0.00051 -0.00017 74 4ZZ -0.00005 0.00012 -0.00004 -0.00045 0.00067 75 4XY -0.00013 0.00001 -0.00002 0.00389 0.00724 76 4XZ 0.00002 -0.00000 -0.00003 0.00085 0.00115 77 4YZ 0.00006 -0.00005 -0.00002 0.00086 0.00073 78 6 C 1S 0.00003 -0.00000 -0.00000 -0.02153 -0.06258 79 2S 0.00022 -0.00006 -0.00004 0.03895 0.11781 80 2PX -0.00005 -0.00002 -0.00002 0.00269 -0.00275 81 2PY -0.00022 0.00021 0.00002 0.00142 -0.00783 82 2PZ -0.00007 0.00006 -0.00009 0.01598 0.04034 83 3S -0.00298 0.00100 0.00120 0.03506 0.08217 84 3PX 0.00160 -0.00049 0.00058 0.00066 0.00151 85 3PY 0.00276 -0.00147 0.00055 -0.00236 0.00066 86 3PZ 0.00058 -0.00122 0.00301 0.00724 0.00974 87 4XX -0.00004 0.00007 -0.00002 -0.00172 -0.00507 88 4YY -0.00014 0.00015 -0.00003 -0.00066 -0.00101 89 4ZZ 0.00007 -0.00008 0.00012 0.00135 0.00342 90 4XY -0.00012 0.00007 -0.00003 0.00145 0.00431 91 4XZ 0.00002 0.00002 0.00002 0.00072 0.00116 92 4YZ -0.00003 0.00004 0.00002 0.00052 0.00080 93 7 C 1S -0.00003 0.00002 -0.00001 -0.01131 -0.04456 94 2S -0.00020 0.00015 -0.00004 0.02162 0.08545 95 2PX 0.00002 0.00000 -0.00001 0.00313 0.00907 96 2PY 0.00007 -0.00005 -0.00002 0.00461 0.01278 97 2PZ 0.00003 -0.00000 0.00003 0.00759 0.02928 98 3S 0.00342 -0.00177 0.00051 0.00884 0.04931 99 3PX 0.00111 -0.00082 0.00054 -0.00024 0.00070 100 3PY 0.00165 -0.00094 0.00103 -0.00068 0.00134 101 3PZ 0.00071 -0.00028 -0.00094 -0.00195 -0.00034 102 4XX -0.00001 -0.00001 -0.00001 -0.00083 -0.00316 103 4YY 0.00006 -0.00003 0.00002 0.00007 0.00010 104 4ZZ -0.00002 0.00001 -0.00002 0.00017 0.00121 105 4XY 0.00008 -0.00007 0.00002 0.00096 0.00353 106 4XZ 0.00003 -0.00002 -0.00000 0.00020 0.00057 107 4YZ 0.00003 -0.00001 -0.00000 0.00018 0.00035 108 8 C 1S 0.00001 -0.00000 0.00000 -0.00923 -0.04047 109 2S 0.00008 -0.00003 -0.00000 0.01744 0.07698 110 2PX 0.00001 -0.00001 0.00001 0.00388 0.01518 111 2PY 0.00002 0.00000 0.00002 0.00640 0.02511 112 2PZ 0.00005 -0.00003 -0.00001 0.00167 0.00718 113 3S -0.00066 0.00020 0.00053 0.01160 0.04834 114 3PX -0.00044 0.00024 0.00004 0.00077 0.00218 115 3PY -0.00068 0.00022 0.00013 0.00149 0.00401 116 3PZ -0.00073 0.00046 -0.00068 0.00032 0.00032 117 4XX 0.00002 0.00000 0.00000 -0.00069 -0.00301 118 4YY 0.00001 -0.00000 0.00001 0.00005 -0.00001 119 4ZZ -0.00000 0.00000 -0.00000 0.00030 0.00130 120 4XY -0.00001 0.00001 0.00000 0.00077 0.00320 121 4XZ 0.00001 -0.00001 -0.00001 0.00005 0.00023 122 4YZ 0.00000 0.00000 -0.00001 -0.00004 -0.00009 123 9 C 1S -0.00000 0.00001 -0.00001 -0.01108 -0.04470 124 2S -0.00002 0.00003 -0.00004 0.02088 0.08501 125 2PX 0.00000 0.00002 -0.00000 0.00419 0.01357 126 2PY 0.00001 0.00002 0.00001 0.00727 0.02412 127 2PZ -0.00004 0.00001 0.00001 -0.00410 -0.01850 128 3S 0.00129 -0.00021 0.00013 0.01193 0.05405 129 3PX 0.00003 0.00003 -0.00007 0.00083 0.00254 130 3PY 0.00018 0.00010 -0.00018 0.00083 0.00346 131 3PZ -0.00030 0.00021 -0.00041 -0.00051 -0.00311 132 4XX -0.00001 0.00001 -0.00000 -0.00074 -0.00313 133 4YY 0.00000 0.00001 -0.00000 0.00024 0.00037 134 4ZZ 0.00002 -0.00001 0.00001 0.00009 0.00089 135 4XY -0.00001 -0.00000 0.00001 0.00111 0.00386 136 4XZ -0.00000 0.00000 0.00000 0.00005 0.00019 137 4YZ 0.00001 -0.00001 0.00000 -0.00002 -0.00014 138 10 C 1S -0.00000 0.00001 0.00000 -0.02072 -0.06281 139 2S -0.00002 0.00005 0.00002 0.03933 0.12067 140 2PX -0.00001 -0.00001 -0.00000 0.00523 0.00596 141 2PY 0.00003 -0.00003 -0.00005 0.00785 0.01055 142 2PZ -0.00001 0.00000 0.00001 -0.01338 -0.04009 143 3S -0.00058 -0.00035 -0.00098 0.02064 0.06440 144 3PX 0.00052 0.00010 -0.00047 -0.00003 -0.00030 145 3PY 0.00036 0.00018 -0.00068 0.00033 0.00185 146 3PZ 0.00059 0.00050 0.00017 -0.00159 0.00079 147 4XX 0.00001 0.00001 -0.00002 -0.00145 -0.00452 148 4YY 0.00002 0.00000 -0.00003 -0.00003 0.00003 149 4ZZ -0.00000 -0.00004 0.00000 0.00080 0.00227 150 4XY 0.00003 -0.00001 -0.00002 0.00171 0.00484 151 4XZ -0.00005 0.00002 0.00001 -0.00049 -0.00064 152 4YZ -0.00002 0.00002 0.00001 -0.00094 -0.00166 153 11 H 1S -0.00003 -0.00001 0.00003 0.00845 0.02491 154 2S -0.00031 -0.00028 0.00009 0.00202 0.00132 155 12 H 1S -0.00002 0.00000 0.00001 0.00346 0.01519 156 2S 0.00001 -0.00003 0.00006 0.00011 0.00100 157 13 H 1S -0.00006 0.00003 -0.00003 0.00279 0.01352 158 2S -0.00030 0.00012 -0.00005 0.00018 0.00091 159 14 H 1S -0.00003 0.00002 -0.00007 0.00347 0.01500 160 2S 0.00020 -0.00013 -0.00030 -0.00096 -0.00074 161 15 H 1S -0.00026 0.00021 -0.00019 0.00910 0.02497 162 2S 0.00013 -0.00066 0.00162 0.00350 0.00355 163 16 C 1S 0.00001 0.00003 -0.00001 -0.11423 0.03103 164 2S 0.00002 0.00018 -0.00004 0.22352 -0.06194 165 2PX -0.00005 -0.00003 0.00002 0.00065 -0.04518 166 2PY -0.00004 -0.00002 -0.00005 0.00516 0.02581 167 2PZ 0.00001 0.00003 0.00003 0.00367 0.01436 168 3S 0.00069 -0.00235 -0.00029 0.12195 -0.01765 169 3PX -0.00018 0.00237 -0.00029 0.01521 -0.02555 170 3PY 0.00082 -0.00120 0.00023 -0.02012 0.01077 171 3PZ 0.00038 -0.00080 -0.00037 -0.01057 0.00663 172 4XX 0.00004 -0.00003 0.00000 0.00268 0.00012 173 4YY -0.00002 -0.00000 -0.00000 -0.00046 -0.00025 174 4ZZ 0.00002 0.00004 -0.00003 -0.00856 0.00222 175 4XY 0.00002 0.00006 -0.00001 -0.00157 -0.00237 176 4XZ -0.00001 0.00002 0.00002 -0.00131 -0.00119 177 4YZ -0.00001 -0.00003 -0.00001 0.00741 -0.00216 178 17 C 1S -0.00000 0.00000 0.00000 -0.07711 0.04414 179 2S -0.00004 0.00001 -0.00001 0.14911 -0.08650 180 2PX -0.00006 0.00002 -0.00002 0.03558 -0.03953 181 2PY 0.00004 0.00001 0.00002 0.03197 -0.00070 182 2PZ -0.00002 0.00001 -0.00001 0.01652 0.00042 183 3S 0.00078 -0.00028 0.00020 0.08154 -0.04892 184 3PX 0.00078 -0.00100 0.00030 -0.00770 -0.00456 185 3PY 0.00010 0.00003 -0.00020 0.00065 -0.00640 186 3PZ 0.00019 0.00005 0.00009 0.00042 -0.00338 187 4XX 0.00002 -0.00002 0.00001 0.00161 -0.00200 188 4YY 0.00002 0.00001 -0.00001 0.00162 0.00033 189 4ZZ 0.00001 0.00001 0.00002 -0.00573 0.00347 190 4XY -0.00003 -0.00002 -0.00001 0.00035 0.00002 191 4XZ -0.00001 -0.00001 0.00001 -0.00013 0.00023 192 4YZ 0.00002 0.00000 0.00001 0.00644 -0.00280 193 18 C 1S 0.00001 0.00000 0.00000 -0.05952 0.05518 194 2S 0.00005 0.00001 0.00002 0.11393 -0.10620 195 2PX 0.00002 -0.00001 0.00000 -0.00098 -0.00958 196 2PY -0.00001 0.00002 -0.00001 0.03919 -0.03161 197 2PZ 0.00001 0.00001 -0.00000 0.02136 -0.01699 198 3S -0.00070 0.00056 -0.00036 0.07333 -0.06795 199 3PX 0.00008 -0.00015 0.00007 0.00023 0.00335 200 3PY -0.00039 0.00015 -0.00011 0.00672 -0.00158 201 3PZ -0.00031 0.00009 -0.00012 0.00371 -0.00102 202 4XX -0.00001 0.00000 -0.00000 0.00187 -0.00189 203 4YY 0.00000 0.00001 0.00000 0.00027 0.00017 204 4ZZ 0.00000 0.00001 -0.00000 -0.00463 0.00435 205 4XY 0.00001 -0.00000 0.00000 -0.00060 -0.00049 206 4XZ 0.00001 -0.00000 0.00001 -0.00057 -0.00004 207 4YZ -0.00002 -0.00000 -0.00001 0.00438 -0.00367 208 19 C 1S -0.00000 0.00000 -0.00000 -0.05610 0.05936 209 2S -0.00001 0.00002 -0.00001 0.10849 -0.11551 210 2PX -0.00001 -0.00001 0.00000 -0.03112 0.02820 211 2PY -0.00001 0.00001 0.00000 0.02280 -0.02141 212 2PZ -0.00001 0.00001 -0.00001 0.01329 -0.01247 213 3S 0.00023 -0.00020 0.00012 0.06671 -0.07812 214 3PX -0.00014 0.00011 -0.00010 -0.00401 0.00645 215 3PY 0.00008 -0.00015 0.00005 0.00448 -0.00309 216 3PZ 0.00009 -0.00007 0.00006 0.00254 -0.00187 217 4XX 0.00001 0.00000 0.00000 0.00207 -0.00189 218 4YY -0.00000 0.00000 0.00000 0.00022 -0.00013 219 4ZZ -0.00000 0.00001 -0.00000 -0.00445 0.00461 220 4XY 0.00000 -0.00000 0.00000 0.00002 -0.00018 221 4XZ -0.00000 -0.00000 -0.00000 -0.00023 0.00014 222 4YZ -0.00000 -0.00000 0.00000 0.00418 -0.00423 223 20 C 1S -0.00000 0.00000 0.00000 -0.06018 0.05775 224 2S -0.00000 0.00001 0.00002 0.11521 -0.11130 225 2PX -0.00000 -0.00002 0.00001 -0.04494 0.03557 226 2PY 0.00001 0.00000 0.00000 -0.00726 0.01338 227 2PZ 0.00001 0.00000 -0.00001 -0.00287 0.00644 228 3S -0.00013 0.00047 -0.00041 0.07430 -0.07133 229 3PX 0.00002 -0.00013 0.00017 -0.00655 0.00354 230 3PY 0.00001 -0.00001 -0.00006 0.00216 0.00072 231 3PZ -0.00004 -0.00003 -0.00004 0.00135 0.00031 232 4XX 0.00000 0.00000 -0.00000 0.00261 -0.00164 233 4YY -0.00000 0.00001 0.00000 -0.00036 -0.00006 234 4ZZ -0.00000 0.00001 0.00000 -0.00484 0.00440 235 4XY -0.00000 -0.00000 0.00000 -0.00049 -0.00032 236 4XZ 0.00000 0.00000 0.00000 -0.00052 0.00004 237 4YZ 0.00000 -0.00000 -0.00000 0.00405 -0.00399 238 21 C 1S 0.00001 0.00001 0.00000 -0.07936 0.05051 239 2S 0.00004 0.00006 0.00001 0.15395 -0.09816 240 2PX 0.00001 0.00001 -0.00001 -0.02995 -0.00584 241 2PY 0.00001 0.00001 -0.00000 -0.03645 0.03227 242 2PZ -0.00001 -0.00001 0.00002 -0.01942 0.01781 243 3S -0.00035 -0.00089 0.00029 0.08884 -0.05831 244 3PX 0.00018 0.00012 0.00023 -0.01049 0.00075 245 3PY -0.00013 0.00057 -0.00031 0.00282 -0.00100 246 3PZ -0.00001 0.00038 -0.00010 0.00165 -0.00065 247 4XX -0.00001 0.00001 -0.00001 0.00500 -0.00109 248 4YY 0.00001 -0.00000 0.00001 -0.00072 -0.00033 249 4ZZ 0.00001 0.00001 -0.00001 -0.00649 0.00383 250 4XY -0.00000 -0.00001 0.00001 0.00081 0.00072 251 4XZ -0.00000 -0.00001 -0.00001 0.00012 0.00058 252 4YZ -0.00000 -0.00002 -0.00001 0.00521 -0.00378 253 22 H 1S -0.00000 -0.00002 0.00002 0.03083 -0.01789 254 2S 0.00018 -0.00022 0.00005 -0.00012 0.00229 255 23 H 1S 0.00001 -0.00000 0.00000 0.01976 -0.02095 256 2S -0.00000 -0.00002 -0.00002 -0.00018 -0.00042 257 24 H 1S 0.00001 -0.00001 0.00001 0.01905 -0.02249 258 2S 0.00004 -0.00007 0.00003 0.00127 -0.00206 259 25 H 1S -0.00001 -0.00001 0.00000 0.01974 -0.01983 260 2S -0.00015 0.00000 -0.00003 0.00106 0.00075 261 26 H 1S 0.00004 -0.00004 0.00004 0.03088 -0.01037 262 2S 0.00045 -0.00055 0.00004 -0.00543 -0.00408 263 27 H 1S -0.00000 0.00017 0.00024 0.04374 0.02084 264 2S -0.00079 0.00002 0.00023 -0.00088 -0.00505 31 32 33 34 35 O O O O O Eigenvalues -- -0.86060 -0.81755 -0.79715 -0.77333 -0.76279 1 1 C 1S 0.08186 -0.05885 -0.00137 0.00425 0.01390 2 2S -0.16414 0.11932 0.00311 -0.00566 -0.02797 3 2PX 0.02049 0.10902 -0.00656 -0.01285 0.00883 4 2PY -0.00024 -0.04763 -0.02320 -0.02218 -0.01017 5 2PZ 0.00758 -0.01852 -0.01057 0.00702 -0.00552 6 3S -0.11087 0.10545 0.00406 -0.02073 -0.02520 7 3PX 0.00524 0.01967 -0.00393 0.00298 0.00499 8 3PY -0.00693 -0.00843 -0.00447 -0.00221 -0.00490 9 3PZ -0.00064 -0.00284 -0.00141 0.00683 -0.00150 10 4XX -0.00322 -0.00216 -0.00202 0.00200 0.00004 11 4YY 0.00216 0.00053 0.00130 -0.00077 0.00021 12 4ZZ 0.00599 -0.00376 0.00035 -0.00003 0.00107 13 4XY 0.00135 -0.00357 -0.00058 0.00276 0.00019 14 4XZ -0.00042 -0.00361 -0.00058 -0.00105 -0.00004 15 4YZ -0.00361 0.00569 0.00112 0.00035 -0.00034 16 2 C 1S 0.06076 0.05748 0.00288 -0.03279 0.00398 17 2S -0.11875 -0.11400 -0.00516 0.06523 -0.00782 18 2PX -0.05370 0.03475 0.00517 -0.03663 -0.01960 19 2PY -0.03690 -0.02334 -0.01238 -0.09869 -0.02500 20 2PZ 0.00001 0.01675 0.00075 0.02241 -0.02240 21 3S -0.09564 -0.10300 -0.01152 0.06009 -0.01029 22 3PX -0.01480 0.00436 0.00030 -0.00546 -0.00146 23 3PY -0.01714 -0.00977 -0.00346 -0.03006 -0.00434 24 3PZ 0.00329 0.00437 0.00043 0.00996 -0.00571 25 4XX -0.00271 0.00618 0.00085 0.00041 -0.00076 26 4YY 0.00384 -0.00209 -0.00027 0.00007 0.00060 27 4ZZ 0.00140 -0.00124 -0.00038 -0.00250 0.00059 28 4XY 0.00125 -0.00154 -0.00038 0.00500 0.00085 29 4XZ 0.00154 0.00028 -0.00019 0.00028 0.00172 30 4YZ 0.00189 0.00132 0.00074 0.00679 0.00252 31 3 H 1S -0.03385 -0.03795 -0.00371 0.02119 -0.01120 32 2S -0.00173 -0.00479 -0.00026 0.00300 -0.00324 33 4 Br 1S 0.01348 0.02259 0.00476 0.02933 0.00477 34 2S -0.08737 -0.14641 -0.03088 -0.19037 -0.03099 35 3S 0.10107 0.16934 0.03574 0.22053 0.03602 36 4S 0.17945 0.30198 0.06380 0.39407 0.06399 37 5S -0.15480 -0.25433 -0.05410 -0.33346 -0.05671 38 6S -0.06621 -0.14247 -0.03062 -0.20156 -0.02696 39 7PX -0.00237 -0.00041 -0.00019 -0.00157 -0.00095 40 7PY 0.00544 0.00652 0.00082 0.00206 -0.00035 41 7PZ -0.00466 -0.00488 -0.00081 -0.00234 -0.00132 42 8PX 0.00719 0.00125 0.00058 0.00478 0.00290 43 8PY -0.01652 -0.01986 -0.00250 -0.00633 0.00104 44 8PZ 0.01415 0.01487 0.00246 0.00717 0.00403 45 9PX -0.01196 -0.00196 -0.00095 -0.00826 -0.00499 46 9PY 0.02769 0.03381 0.00444 0.01254 -0.00111 47 9PZ -0.02327 -0.02529 -0.00422 -0.01318 -0.00670 48 10PX -0.00365 -0.00237 -0.00069 -0.00432 -0.00242 49 10PY 0.00677 0.01372 0.00135 0.00435 -0.00280 50 10PZ -0.00725 -0.01019 -0.00175 -0.00574 -0.00426 51 11XX -0.04823 -0.08060 -0.01662 -0.10088 -0.01620 52 11YY -0.04344 -0.07267 -0.01582 -0.09885 -0.01717 53 11ZZ -0.04544 -0.07614 -0.01600 -0.09917 -0.01548 54 11XY -0.00276 -0.00104 -0.00021 -0.00195 -0.00098 55 11XZ 0.00218 0.00100 0.00029 0.00163 0.00058 56 11YZ -0.00619 -0.00697 -0.00107 -0.00365 -0.00141 57 12XX -0.01520 -0.02067 -0.00498 -0.03124 -0.00687 58 12YY -0.02332 -0.03541 -0.00651 -0.03750 -0.00540 59 12ZZ -0.01951 -0.02845 -0.00602 -0.03495 -0.00830 60 12XY 0.00424 0.00308 0.00051 0.00422 0.00186 61 12XZ -0.00338 -0.00277 -0.00070 -0.00366 -0.00116 62 12YZ 0.01020 0.01375 0.00218 0.00897 0.00317 63 5 C 1S -0.04916 0.02589 -0.00294 -0.10252 -0.03783 64 2S 0.09387 -0.05175 0.00440 0.20410 0.07466 65 2PX -0.04077 -0.01612 0.00361 0.00436 0.00682 66 2PY -0.06080 -0.03632 -0.00135 -0.00438 0.01900 67 2PZ -0.01574 -0.00741 -0.00190 0.05073 -0.11696 68 3S 0.06277 -0.02878 0.00749 0.15046 0.05896 69 3PX -0.00688 -0.00392 0.00437 0.00506 0.00550 70 3PY -0.01403 -0.00814 0.00148 0.00141 0.00718 71 3PZ -0.01453 -0.00786 -0.00130 -0.00136 -0.01850 72 4XX -0.00523 0.00180 0.00011 -0.00678 -0.00378 73 4YY -0.00340 -0.00166 -0.00083 -0.00385 -0.00526 74 4ZZ 0.00336 0.00114 -0.00018 0.00014 0.00459 75 4XY 0.00125 -0.00222 -0.00022 0.00473 -0.00083 76 4XZ -0.00060 -0.00053 0.00001 -0.00061 0.00458 77 4YZ -0.00154 -0.00084 0.00018 -0.00184 0.00693 78 6 C 1S -0.06704 -0.00341 -0.00217 -0.00198 -0.12781 79 2S 0.12726 0.00641 0.00260 0.00449 0.25051 80 2PX -0.02120 -0.01406 0.00326 0.03714 -0.01438 81 2PY -0.03706 -0.02505 0.00150 0.05458 -0.02558 82 2PZ 0.02616 -0.01084 0.00158 0.06249 0.00214 83 3S 0.07793 0.00068 0.00838 0.00193 0.19651 84 3PX -0.00146 -0.00242 0.00082 0.00249 0.00483 85 3PY -0.00638 -0.00704 -0.00357 0.00182 0.00310 86 3PZ -0.00310 -0.00700 -0.00083 -0.00098 -0.00781 87 4XX -0.00510 0.00028 -0.00005 -0.00180 -0.00815 88 4YY -0.00033 0.00087 -0.00057 -0.00557 -0.00065 89 4ZZ 0.00098 -0.00188 -0.00012 0.00754 -0.00042 90 4XY 0.00499 0.00104 -0.00014 -0.00349 0.00810 91 4XZ -0.00002 -0.00046 0.00017 0.00097 0.00107 92 4YZ -0.00092 -0.00091 -0.00002 0.00073 0.00017 93 7 C 1S -0.07615 -0.03006 0.00277 0.08636 -0.08397 94 2S 0.14551 0.05802 -0.00554 -0.16886 0.16586 95 2PX 0.00728 -0.00383 0.00175 0.01949 0.04422 96 2PY 0.00841 -0.00817 0.00250 0.03464 0.07393 97 2PZ 0.04745 0.01805 -0.00250 -0.03505 -0.00800 98 3S 0.09261 0.03830 -0.00660 -0.13134 0.12263 99 3PX -0.00009 -0.00182 -0.00069 0.00012 0.00395 100 3PY -0.00010 -0.00266 -0.00170 0.00134 0.00857 101 3PZ 0.00755 0.00370 -0.00047 0.00122 -0.00931 102 4XX -0.00577 -0.00242 0.00020 0.00656 -0.00434 103 4YY -0.00063 -0.00086 0.00008 0.00242 0.00165 104 4ZZ 0.00248 0.00139 -0.00035 -0.00319 -0.00298 105 4XY 0.00543 0.00159 -0.00011 -0.00418 0.00697 106 4XZ 0.00031 -0.00043 0.00014 0.00172 0.00350 107 4YZ -0.00052 -0.00116 0.00025 0.00409 0.00527 108 8 C 1S -0.07789 -0.03902 0.00602 0.10000 0.03927 109 2S 0.14903 0.07559 -0.01174 -0.19660 -0.07758 110 2PX 0.02497 0.00914 -0.00095 -0.01551 0.00553 111 2PY 0.04147 0.01521 -0.00173 -0.02842 0.01626 112 2PZ 0.01228 0.00515 -0.00181 0.01942 -0.10285 113 3S 0.09557 0.05109 -0.00821 -0.14516 -0.05677 114 3PX 0.00347 0.00096 0.00019 0.00156 0.00333 115 3PY 0.00539 0.00111 0.00019 0.00181 0.00620 116 3PZ 0.00285 0.00143 0.00067 0.00706 -0.01334 117 4XX -0.00579 -0.00283 0.00046 0.00679 0.00352 118 4YY -0.00050 -0.00052 0.00013 0.00090 0.00397 119 4ZZ 0.00244 0.00111 -0.00019 -0.00107 -0.00474 120 4XY 0.00568 0.00251 -0.00035 -0.00610 -0.00022 121 4XZ 0.00044 0.00020 -0.00008 0.00092 -0.00476 122 4YZ -0.00020 -0.00011 -0.00007 0.00257 -0.00729 123 9 C 1S -0.07635 -0.03158 0.00565 0.02996 0.12486 124 2S 0.14644 0.06128 -0.01091 -0.05850 -0.24583 125 2PX 0.01519 0.00032 0.00012 0.02897 -0.01884 126 2PY 0.02828 0.00182 -0.00033 0.04360 -0.03230 127 2PZ -0.03720 -0.01988 0.00286 0.06360 -0.00085 128 3S 0.09215 0.04052 -0.00967 -0.04048 -0.18996 129 3PX 0.00165 -0.00062 -0.00012 0.00605 -0.00041 130 3PY 0.00305 -0.00041 -0.00064 0.00860 -0.00073 131 3PZ -0.00270 -0.00139 0.00075 0.00993 -0.00758 132 4XX -0.00573 -0.00257 0.00047 0.00399 0.00792 133 4YY -0.00079 -0.00125 0.00017 0.00558 0.00029 134 4ZZ 0.00268 0.00194 -0.00030 -0.00737 0.00029 135 4XY 0.00531 0.00144 -0.00028 0.00180 -0.00826 136 4XZ 0.00035 0.00020 -0.00006 -0.00047 -0.00078 137 4YZ -0.00027 -0.00007 -0.00002 0.00003 -0.00052 138 10 C 1S -0.06810 -0.00651 0.00169 -0.07206 0.09174 139 2S 0.12988 0.01195 -0.00377 0.14188 -0.18135 140 2PX -0.01346 -0.01468 0.00293 0.03714 0.04116 141 2PY -0.02010 -0.02579 0.00337 0.06004 0.07010 142 2PZ -0.04261 -0.00292 -0.00005 -0.02611 -0.00750 143 3S 0.08907 0.01107 0.00037 0.10820 -0.13358 144 3PX -0.00030 -0.00122 0.00017 0.00948 0.00131 145 3PY 0.00011 -0.00359 -0.00014 0.01736 0.00480 146 3PZ -0.00539 -0.00134 -0.00126 0.00463 -0.01087 147 4XX -0.00519 -0.00032 0.00010 -0.00525 0.00500 148 4YY -0.00037 -0.00003 -0.00017 -0.00199 -0.00135 149 4ZZ 0.00206 -0.00036 0.00008 0.00306 0.00275 150 4XY 0.00505 0.00073 -0.00017 0.00352 -0.00728 151 4XZ 0.00076 0.00109 -0.00025 -0.00279 -0.00338 152 4YZ 0.00064 0.00193 -0.00033 -0.00511 -0.00544 153 11 H 1S 0.02423 0.00009 -0.00072 0.04432 -0.05448 154 2S -0.00013 -0.00084 0.00016 0.00472 -0.00748 155 12 H 1S 0.02865 0.01398 -0.00274 -0.01564 -0.07160 156 2S 0.00195 0.00143 -0.00062 -0.00265 -0.01087 157 13 H 1S 0.02935 0.01757 -0.00289 -0.05434 -0.02228 158 2S 0.00289 0.00219 -0.00031 -0.00730 -0.00279 159 14 H 1S 0.02873 0.01336 -0.00121 -0.04688 0.04850 160 2S 0.00308 0.00229 -0.00032 -0.00666 0.00658 161 15 H 1S 0.02278 -0.00308 0.00130 -0.00016 0.07504 162 2S -0.00240 -0.00429 -0.00021 -0.00642 0.00821 163 16 C 1S 0.02843 -0.10364 -0.01634 0.00504 -0.00505 164 2S -0.05809 0.20903 0.03258 -0.01043 0.00989 165 2PX 0.04466 -0.02044 -0.07418 0.00038 0.00993 166 2PY -0.03917 0.04664 -0.08303 0.00049 -0.00528 167 2PZ -0.02208 0.02889 -0.04300 0.00322 -0.00339 168 3S -0.02781 0.13762 0.02872 -0.00594 0.00931 169 3PX 0.01062 0.00419 -0.00926 -0.00781 0.00212 170 3PY -0.01464 -0.00440 -0.01293 -0.00011 -0.00427 171 3PZ -0.00905 -0.00144 -0.00686 0.00040 -0.00313 172 4XX -0.00052 -0.00045 -0.00896 0.00126 0.00038 173 4YY 0.00095 -0.00229 0.00654 -0.00089 -0.00032 174 4ZZ 0.00189 -0.00708 0.00088 0.00023 -0.00049 175 4XY 0.00303 -0.00051 -0.00166 0.00038 0.00106 176 4XZ 0.00172 -0.00084 -0.00082 -0.00019 0.00064 177 4YZ -0.00100 0.00485 0.00505 -0.00062 0.00009 178 17 C 1S -0.01817 -0.00884 -0.12244 0.00897 -0.00331 179 2S 0.03529 0.01841 0.24457 -0.01852 0.00641 180 2PX 0.02796 -0.03578 0.04021 -0.00836 -0.00768 181 2PY -0.02138 0.06496 -0.02696 0.00204 0.00651 182 2PZ -0.01229 0.03641 -0.01533 0.00193 0.00309 183 3S 0.02052 0.00384 0.18055 -0.01220 0.00461 184 3PX -0.00265 -0.01603 -0.01022 0.00021 -0.00469 185 3PY -0.01237 0.00623 -0.00492 -0.00074 -0.00177 186 3PZ -0.00602 0.00393 -0.00223 0.00023 -0.00179 187 4XX 0.00259 -0.00487 0.00400 0.00010 -0.00012 188 4YY -0.00267 0.00474 -0.00278 -0.00013 -0.00010 189 4ZZ -0.00216 0.00073 -0.00909 0.00061 -0.00029 190 4XY -0.00107 0.00390 -0.00288 0.00012 0.00058 191 4XZ -0.00070 0.00219 -0.00210 0.00002 0.00050 192 4YZ -0.00033 0.00344 0.00567 -0.00048 0.00015 193 18 C 1S -0.04453 0.07123 -0.10242 0.00891 0.01004 194 2S 0.08619 -0.13995 0.20225 -0.01766 -0.01998 195 2PX 0.01539 -0.05074 -0.06602 0.00681 -0.00860 196 2PY 0.01962 -0.01657 0.03172 -0.00279 -0.00026 197 2PZ 0.01035 -0.00780 0.01898 -0.00157 -0.00007 198 3S 0.05589 -0.08874 0.15391 -0.01521 -0.01570 199 3PX 0.00649 -0.00599 -0.00931 0.00177 -0.00025 200 3PY 0.00513 0.00401 -0.00034 -0.00014 0.00160 201 3PZ 0.00242 0.00222 0.00009 -0.00025 0.00105 202 4XX 0.00163 -0.00315 0.00044 0.00014 -0.00031 203 4YY -0.00039 0.00171 -0.00030 -0.00004 0.00027 204 4ZZ -0.00351 0.00568 -0.00696 0.00058 0.00077 205 4XY 0.00124 -0.00412 -0.00566 0.00059 -0.00054 206 4XZ 0.00051 -0.00196 -0.00336 0.00034 -0.00026 207 4YZ 0.00268 -0.00329 0.00609 -0.00056 -0.00040 208 19 C 1S -0.05252 0.09768 0.01486 -0.00366 0.01071 209 2S 0.10310 -0.19429 -0.02977 0.00726 -0.02184 210 2PX -0.02096 0.02972 -0.06840 0.00740 0.00538 211 2PY 0.01426 -0.01071 -0.07808 0.00817 0.00527 212 2PZ 0.00839 -0.00677 -0.04088 0.00434 0.00268 213 3S 0.06673 -0.14467 -0.02396 0.00706 -0.01727 214 3PX -0.00252 0.00634 -0.00919 0.00063 -0.00023 215 3PY 0.00325 -0.00082 -0.01000 0.00199 0.00184 216 3PZ 0.00197 -0.00063 -0.00523 0.00115 0.00100 217 4XX 0.00143 -0.00267 0.00899 -0.00088 -0.00069 218 4YY -0.00016 0.00124 -0.00691 0.00066 0.00059 219 4ZZ -0.00403 0.00736 -0.00109 -0.00006 0.00087 220 4XY 0.00033 -0.00101 0.00181 -0.00015 -0.00017 221 4XZ -0.00002 -0.00020 0.00075 -0.00007 -0.00004 222 4YZ 0.00345 -0.00540 -0.00531 0.00065 -0.00023 223 20 C 1S -0.04222 0.05097 0.11684 -0.01201 -0.00336 224 2S 0.08198 -0.10055 -0.23075 0.02407 0.00678 225 2PX -0.01766 -0.00214 0.04575 -0.00216 -0.00514 226 2PY -0.01905 0.05614 -0.03053 0.00036 0.01038 227 2PZ -0.00995 0.03068 -0.01776 0.00033 0.00576 228 3S 0.05067 -0.05304 -0.17274 0.01456 0.00460 229 3PX -0.00076 -0.00983 -0.00159 0.00280 0.00004 230 3PY -0.00277 0.01072 -0.00743 0.00075 0.00167 231 3PZ -0.00153 0.00602 -0.00404 0.00032 0.00089 232 4XX 0.00018 0.00258 -0.00371 0.00011 0.00064 233 4YY 0.00054 -0.00246 0.00277 -0.00019 -0.00060 234 4ZZ -0.00300 0.00294 0.00865 -0.00083 -0.00037 235 4XY 0.00120 -0.00424 0.00338 -0.00006 -0.00070 236 4XZ 0.00053 -0.00225 0.00224 -0.00007 -0.00040 237 4YZ 0.00312 -0.00465 -0.00544 0.00058 -0.00018 238 21 C 1S -0.01256 -0.03926 0.10818 -0.00534 -0.01110 239 2S 0.02432 0.07885 -0.21643 0.01052 0.02243 240 2PX 0.03163 -0.08114 -0.06327 0.01121 0.00074 241 2PY -0.02099 0.01622 0.02822 -0.00339 -0.00270 242 2PZ -0.01214 0.01084 0.01717 -0.00169 -0.00160 243 3S 0.01691 0.04666 -0.16265 0.01414 0.01833 244 3PX 0.00604 -0.02241 -0.00374 0.00086 0.00022 245 3PY -0.00302 0.01839 -0.00505 -0.00368 0.00079 246 3PZ -0.00161 0.01063 -0.00256 -0.00185 0.00062 247 4XX -0.00177 0.00540 -0.00011 -0.00018 0.00009 248 4YY 0.00108 -0.00260 0.00010 0.00014 -0.00011 249 4ZZ -0.00064 -0.00357 0.00720 -0.00032 -0.00076 250 4XY -0.00188 0.00494 0.00552 -0.00067 0.00016 251 4XZ -0.00105 0.00244 0.00328 -0.00045 0.00006 252 4YZ 0.00159 0.00069 -0.00665 0.00041 0.00057 253 22 H 1S 0.00109 0.02649 -0.06189 0.00273 0.00621 254 2S -0.00202 -0.00020 -0.00625 0.00156 0.00006 255 23 H 1S 0.01724 -0.02492 -0.06295 0.00710 0.00192 256 2S 0.00124 -0.00183 -0.00605 0.00038 0.00006 257 24 H 1S 0.02269 -0.05050 -0.00824 0.00235 -0.00697 258 2S 0.00267 -0.00687 -0.00096 0.00071 -0.00075 259 25 H 1S 0.01861 -0.03523 0.05535 -0.00501 -0.00600 260 2S 0.00359 -0.00290 0.00614 -0.00063 -0.00013 261 26 H 1S 0.00816 0.00726 0.07013 -0.00089 0.00832 262 2S -0.00802 -0.00396 0.00317 0.00030 -0.00039 263 27 H 1S -0.04621 0.03330 -0.00925 -0.00977 -0.01235 264 2S -0.00269 0.00247 -0.00476 -0.00616 -0.00198 36 37 38 39 40 O O O O O Eigenvalues -- -0.74286 -0.68625 -0.65245 -0.63215 -0.62372 1 1 C 1S -0.09951 0.05014 -0.00052 -0.05526 -0.00082 2 2S 0.20768 -0.10250 0.00182 0.11721 0.00041 3 2PX -0.05337 -0.16038 0.01317 -0.08066 0.00190 4 2PY 0.01990 0.01399 0.08493 0.09622 0.00608 5 2PZ 0.02547 0.02322 0.05356 0.05110 0.01624 6 3S 0.16694 -0.11788 -0.00045 0.12633 0.00954 7 3PX -0.01215 -0.03733 0.03459 -0.02699 -0.00806 8 3PY 0.01660 -0.00559 0.02927 0.03488 0.00362 9 3PZ 0.01501 0.00557 0.01828 0.01755 0.00219 10 4XX 0.00085 0.00671 0.00472 -0.00441 -0.00072 11 4YY -0.00333 -0.00209 -0.00199 0.00023 0.00104 12 4ZZ -0.00710 0.00203 -0.00067 -0.00284 -0.00012 13 4XY 0.00353 0.00343 0.00329 0.00416 -0.00087 14 4XZ 0.00077 0.00060 0.00125 0.00377 -0.00144 15 4YZ 0.00513 -0.00408 -0.00121 0.00301 0.00021 16 2 C 1S -0.04981 -0.09591 -0.01310 0.01659 0.00608 17 2S 0.10030 0.19765 0.02441 -0.03300 -0.01182 18 2PX 0.10267 -0.02295 -0.01973 0.14431 0.00093 19 2PY -0.00360 -0.01728 0.01936 0.08924 0.02454 20 2PZ 0.05071 0.04874 0.03224 0.02768 0.07389 21 3S 0.09366 0.20477 0.05567 -0.05307 -0.01423 22 3PX 0.02518 -0.00529 0.00666 0.04359 -0.01059 23 3PY -0.00087 -0.00047 0.00886 0.03282 0.00071 24 3PZ 0.01171 0.02096 0.01430 0.00583 0.03854 25 4XX 0.00786 -0.00506 -0.00111 0.00714 0.00024 26 4YY -0.00842 -0.00369 -0.00055 -0.00507 0.00123 27 4ZZ -0.00338 0.00055 0.00086 -0.00060 -0.00020 28 4XY 0.00015 0.00093 0.00213 -0.00151 -0.00036 29 4XZ -0.00141 -0.00263 0.00018 0.00014 -0.00374 30 4YZ 0.00382 0.00485 0.00084 -0.00210 -0.00334 31 3 H 1S 0.03639 0.08915 0.02818 -0.01061 0.03005 32 2S 0.00442 0.01872 0.00772 -0.00235 0.01153 33 4 Br 1S 0.02656 0.01404 0.00228 0.00244 -0.00417 34 2S -0.17250 -0.09128 -0.01486 -0.01591 0.02728 35 3S 0.19999 0.10596 0.01731 0.01858 -0.03208 36 4S 0.35794 0.19043 0.03098 0.03314 -0.05649 37 5S -0.29870 -0.15832 -0.02658 -0.02838 0.05124 38 6S -0.20671 -0.12520 -0.02003 -0.02170 0.03179 39 7PX 0.00265 -0.00031 0.00025 0.00481 0.00039 40 7PY -0.00069 -0.00584 -0.00062 0.00009 0.00517 41 7PZ 0.00177 0.00564 0.00208 0.00187 0.00051 42 8PX -0.00805 0.00096 -0.00076 -0.01468 -0.00119 43 8PY 0.00205 0.01777 0.00189 -0.00030 -0.01574 44 8PZ -0.00534 -0.01719 -0.00635 -0.00570 -0.00157 45 9PX 0.01349 -0.00193 0.00116 0.02520 0.00220 46 9PY -0.00172 -0.02898 -0.00290 0.00072 0.02578 47 9PZ 0.00746 0.02828 0.01045 0.00967 0.00282 48 10PX 0.00378 -0.00104 0.00076 0.01255 0.00256 49 10PY 0.00333 -0.01154 -0.00064 0.00092 0.01473 50 10PZ 0.00142 0.01183 0.00529 0.00391 0.00532 51 11XX -0.09133 -0.04480 -0.00752 -0.00958 0.01331 52 11YY -0.08881 -0.04971 -0.00721 -0.00641 0.01767 53 11ZZ -0.09082 -0.04909 -0.00871 -0.00917 0.01252 54 11XY 0.00172 0.00002 -0.00020 0.00298 0.00034 55 11XZ -0.00144 0.00017 -0.00036 -0.00302 -0.00004 56 11YZ -0.00016 0.00454 0.00114 0.00019 0.00001 57 12XX -0.02510 -0.01716 -0.00247 -0.00031 0.00795 58 12YY -0.03287 -0.01030 -0.00391 -0.00627 0.00116 59 12ZZ -0.02741 -0.01089 -0.00118 -0.00144 0.01027 60 12XY -0.00123 -0.00010 0.00057 -0.00503 -0.00142 61 12XZ 0.00108 -0.00048 0.00068 0.00540 0.00057 62 12YZ 0.00412 -0.00635 -0.00152 0.00044 -0.00175 63 5 C 1S 0.03660 0.00395 -0.00239 0.05813 0.02581 64 2S -0.07212 -0.00693 0.00708 -0.12344 -0.05373 65 2PX 0.02857 0.06139 -0.01126 -0.03248 -0.03482 66 2PY 0.02866 0.09383 0.00210 -0.06995 -0.06544 67 2PZ 0.00158 0.05007 0.02322 -0.06241 0.19923 68 3S -0.05748 -0.01437 0.00101 -0.08550 -0.04613 69 3PX 0.00168 0.01412 -0.00987 -0.00817 -0.01206 70 3PY 0.00166 0.01887 0.00123 -0.01877 -0.02139 71 3PZ 0.00063 0.00368 0.00558 -0.00614 0.03281 72 4XX 0.00441 0.00210 -0.00104 0.00390 0.00178 73 4YY 0.00156 0.00379 0.00114 0.00029 0.00292 74 4ZZ -0.00119 -0.00500 0.00062 0.00526 -0.00014 75 4XY 0.00046 0.00264 0.00048 -0.00210 0.00024 76 4XZ 0.00218 0.00229 0.00016 -0.00053 -0.00322 77 4YZ 0.00350 0.00473 0.00022 -0.00109 -0.00518 78 6 C 1S 0.01267 0.05025 0.00393 -0.05477 0.06276 79 2S -0.02325 -0.10065 -0.00603 0.11036 -0.12799 80 2PX -0.01662 0.00181 -0.01321 -0.01879 -0.07986 81 2PY -0.02750 0.00088 -0.01097 -0.03500 -0.12449 82 2PZ -0.03026 -0.01211 -0.00459 -0.06294 -0.07295 83 3S -0.01937 -0.08274 -0.01078 0.10605 -0.11362 84 3PX -0.00542 -0.00310 -0.00527 0.00163 -0.03422 85 3PY -0.00869 -0.00754 -0.00181 -0.00394 -0.05207 86 3PZ -0.00760 -0.00097 -0.00114 -0.02016 -0.00636 87 4XX 0.00222 0.00439 0.00008 -0.00289 0.00564 88 4YY 0.00302 0.00291 0.00097 -0.00045 0.00651 89 4ZZ -0.00330 -0.00193 0.00007 -0.00354 -0.00484 90 4XY 0.00142 -0.00101 0.00035 0.00266 0.00095 91 4XZ 0.00016 0.00101 -0.00014 -0.00146 0.00065 92 4YZ 0.00046 0.00243 0.00046 -0.00334 0.00275 93 7 C 1S -0.04034 -0.01615 -0.01164 -0.00729 -0.09995 94 2S 0.08038 0.03272 0.02382 0.01462 0.20547 95 2PX -0.01503 -0.04231 -0.00300 0.06387 -0.02811 96 2PY -0.02640 -0.07265 -0.00195 0.10687 -0.04216 97 2PZ 0.01329 0.01510 -0.00248 -0.03606 -0.04482 98 3S 0.05906 0.02947 0.02077 0.00378 0.16348 99 3PX -0.00476 -0.00973 -0.00105 0.01406 -0.01432 100 3PY -0.00696 -0.01712 -0.00066 0.02383 -0.02210 101 3PZ -0.00112 0.00198 -0.00230 -0.01373 -0.04061 102 4XX -0.00303 -0.00175 -0.00094 0.00031 -0.00757 103 4YY -0.00159 -0.00202 -0.00052 0.00113 -0.00692 104 4ZZ 0.00172 0.00258 0.00029 -0.00295 0.00264 105 4XY 0.00143 -0.00069 0.00024 0.00160 0.00091 106 4XZ -0.00107 -0.00257 0.00010 0.00307 0.00115 107 4YZ -0.00236 -0.00474 0.00016 0.00521 0.00071 108 8 C 1S -0.04740 -0.06518 0.00158 0.07042 0.02695 109 2S 0.09421 0.13223 -0.00316 -0.14534 -0.05546 110 2PX 0.00434 -0.00708 0.00183 0.01853 0.02567 111 2PY 0.00920 -0.01014 0.00548 0.02621 0.05616 112 2PZ -0.02052 -0.02001 -0.01902 0.04299 -0.17977 113 3S 0.07120 0.10463 -0.00363 -0.11484 -0.04577 114 3PX -0.00231 -0.01015 0.00005 0.01773 0.00955 115 3PY -0.00360 -0.01616 0.00077 0.02744 0.01923 116 3PZ -0.00353 -0.00546 -0.00397 0.01540 -0.03798 117 4XX -0.00302 -0.00388 0.00012 0.00364 0.00213 118 4YY -0.00031 -0.00097 0.00045 0.00012 0.00327 119 4ZZ -0.00010 -0.00082 -0.00044 0.00387 -0.00227 120 4XY 0.00282 0.00317 0.00012 -0.00377 0.00035 121 4XZ -0.00081 -0.00026 -0.00055 0.00003 -0.00462 122 4YZ -0.00174 -0.00085 -0.00090 0.00027 -0.00755 123 9 C 1S 0.00092 0.00680 0.01106 -0.04131 0.07657 124 2S -0.00200 -0.01401 -0.02278 0.08469 -0.15808 125 2PX -0.01994 -0.03468 0.00360 0.03540 0.06492 126 2PY -0.03125 -0.05449 0.00743 0.05254 0.10444 127 2PZ -0.03419 -0.05438 0.00213 0.08452 0.05769 128 3S 0.00105 0.00024 -0.01442 0.05808 -0.11855 129 3PX -0.00195 -0.00246 0.00287 0.00169 0.02762 130 3PY -0.00304 -0.00496 0.00570 0.00100 0.04652 131 3PZ -0.00533 -0.00990 -0.00157 0.02871 -0.00039 132 4XX -0.00090 -0.00072 0.00070 -0.00159 0.00631 133 4YY -0.00285 -0.00353 0.00071 0.00188 0.00671 134 4ZZ 0.00392 0.00545 -0.00022 -0.00545 -0.00414 135 4XY -0.00195 -0.00279 -0.00022 0.00368 0.00047 136 4XZ 0.00033 0.00078 0.00017 -0.00140 0.00156 137 4YZ 0.00020 0.00090 0.00033 -0.00204 0.00329 138 10 C 1S 0.04369 0.04767 -0.00736 -0.02902 -0.09279 139 2S -0.08620 -0.09579 0.01560 0.05930 0.19045 140 2PX -0.00386 0.01600 0.00612 -0.05602 0.04588 141 2PY -0.00960 0.02546 0.01621 -0.10040 0.07355 142 2PZ 0.01526 0.01361 0.00131 0.03157 0.04371 143 3S -0.07134 -0.08109 0.00786 0.05205 0.15900 144 3PX -0.00070 0.00646 0.00350 -0.01592 0.02555 145 3PY -0.00095 0.01352 0.00708 -0.03098 0.03895 146 3PZ -0.00117 -0.00231 0.00407 0.00871 0.04195 147 4XX 0.00355 0.00389 -0.00085 -0.00160 -0.00735 148 4YY 0.00145 0.00307 -0.00044 -0.00115 -0.00704 149 4ZZ -0.00160 -0.00208 0.00049 -0.00098 0.00327 150 4XY -0.00165 -0.00088 -0.00003 0.00110 0.00055 151 4XZ 0.00059 -0.00038 -0.00002 0.00255 0.00044 152 4YZ 0.00151 -0.00024 -0.00038 0.00453 0.00004 153 11 H 1S -0.02427 -0.02520 0.00845 0.02266 0.10247 154 2S -0.00198 -0.00345 0.00224 0.00968 0.02784 155 12 H 1S -0.00031 -0.00291 -0.01002 0.03937 -0.07855 156 2S 0.00035 0.00006 -0.00201 0.01019 -0.02171 157 13 H 1S 0.02958 0.05295 -0.00159 -0.07188 -0.02811 158 2S 0.00466 0.01012 -0.00055 -0.01855 -0.00828 159 14 H 1S 0.02516 0.01488 0.01013 0.00567 0.10273 160 2S 0.00452 0.00375 0.00295 0.00083 0.02900 161 15 H 1S -0.00998 -0.03330 -0.00653 0.05018 -0.07117 162 2S -0.00538 -0.00945 -0.00317 0.01573 -0.01571 163 16 C 1S 0.03663 0.03928 0.03370 0.06722 -0.00574 164 2S -0.07336 -0.08312 -0.07024 -0.14316 0.01186 165 2PX -0.09007 0.06294 0.14890 -0.05083 -0.00674 166 2PY 0.06765 -0.11349 0.12629 -0.00730 -0.02434 167 2PZ 0.04153 -0.06244 0.06637 -0.00471 -0.00894 168 3S -0.06628 -0.05175 -0.07070 -0.11726 0.01668 169 3PX -0.02634 0.01357 0.02754 -0.00929 -0.00122 170 3PY 0.01648 -0.01114 0.00867 -0.00355 -0.00528 171 3PZ 0.01073 -0.00710 0.00428 -0.00138 0.00096 172 4XX 0.00071 0.00342 0.00639 0.00156 -0.00176 173 4YY -0.00007 0.00212 -0.00172 0.00571 0.00063 174 4ZZ 0.00282 0.00249 0.00134 0.00508 0.00005 175 4XY -0.00738 0.00528 0.00228 -0.00265 -0.00012 176 4XZ -0.00433 0.00278 0.00117 -0.00125 -0.00051 177 4YZ -0.00172 -0.00069 -0.00254 0.00060 0.00087 178 17 C 1S 0.05774 -0.06304 0.05853 -0.04178 -0.01054 179 2S -0.11691 0.12930 -0.12128 0.08717 0.02227 180 2PX -0.00541 0.00720 0.10352 -0.01718 0.00161 181 2PY -0.02770 -0.02388 -0.12034 -0.10595 0.01675 182 2PZ -0.01449 -0.01244 -0.06758 -0.05733 0.01127 183 3S -0.09250 0.11757 -0.11008 0.07978 0.02128 184 3PX 0.00664 -0.00586 0.05324 -0.01816 0.00015 185 3PY 0.00187 -0.00421 -0.03413 -0.02668 -0.00060 186 3PZ 0.00073 -0.00138 -0.01943 -0.01511 0.00189 187 4XX 0.00089 0.00159 0.00332 0.00352 -0.00080 188 4YY 0.00016 -0.00379 -0.00104 -0.00504 0.00000 189 4ZZ 0.00400 -0.00499 0.00344 -0.00368 -0.00054 190 4XY -0.00397 0.00221 -0.00669 -0.00261 0.00114 191 4XZ -0.00199 0.00088 -0.00350 -0.00157 0.00031 192 4YZ -0.00309 0.00101 -0.00350 -0.00124 0.00061 193 18 C 1S -0.02323 0.00850 -0.10086 -0.01954 0.01195 194 2S 0.04654 -0.01776 0.20817 0.04029 -0.02463 195 2PX 0.09078 -0.12039 0.02360 -0.12770 -0.01010 196 2PY -0.01618 0.02448 -0.04886 -0.00700 0.01437 197 2PZ -0.01083 0.01629 -0.02668 -0.00070 0.00864 198 3S 0.04252 -0.02475 0.16328 0.03617 -0.02501 199 3PX 0.01257 -0.02671 0.00996 -0.03265 0.00078 200 3PY -0.00393 0.00405 -0.04015 -0.00806 0.00684 201 3PZ -0.00236 0.00275 -0.02195 -0.00330 0.00324 202 4XX 0.00306 -0.00288 -0.00500 -0.00198 0.00029 203 4YY -0.00198 0.00165 -0.00040 0.00058 0.00018 204 4ZZ -0.00222 0.00105 -0.00593 -0.00078 0.00077 205 4XY 0.00604 -0.00619 0.00249 -0.00414 -0.00071 206 4XZ 0.00313 -0.00327 0.00126 -0.00224 -0.00039 207 4YZ -0.00007 0.00084 0.00465 0.00137 -0.00042 208 19 C 1S -0.08453 0.07542 0.02952 0.05250 -0.00111 209 2S 0.17331 -0.15788 -0.06214 -0.11085 0.00226 210 2PX 0.00285 -0.00374 -0.13829 0.00603 0.01515 211 2PY -0.00945 0.04715 -0.12230 0.05001 0.02007 212 2PZ -0.00489 0.02554 -0.06328 0.02695 0.01073 213 3S 0.13688 -0.12555 -0.05023 -0.09005 0.00063 214 3PX 0.01335 -0.02336 -0.03671 -0.01185 0.00420 215 3PY -0.01051 0.02208 -0.01918 0.02267 0.00586 216 3PZ -0.00591 0.01253 -0.00955 0.01249 0.00323 217 4XX 0.00084 -0.00163 0.00831 -0.00097 -0.00092 218 4YY -0.00167 0.00358 -0.00490 0.00392 0.00052 219 4ZZ -0.00576 0.00530 0.00009 0.00401 0.00009 220 4XY 0.00036 0.00094 0.00298 0.00339 -0.00042 221 4XZ -0.00002 0.00069 0.00140 0.00198 -0.00024 222 4YZ 0.00361 -0.00152 -0.00463 -0.00017 0.00042 223 20 C 1S -0.01339 -0.03528 0.07203 -0.05526 -0.00723 224 2S 0.02649 0.07255 -0.14885 0.11400 0.01497 225 2PX 0.03758 -0.03519 -0.07947 0.02214 0.00829 226 2PY -0.07624 0.08779 0.10061 0.07566 -0.01582 227 2PZ -0.04231 0.04874 0.05677 0.04082 -0.00857 228 3S 0.02963 0.03395 -0.11540 0.10107 0.01136 229 3PX 0.00414 0.01182 -0.04149 0.02132 0.00389 230 3PY -0.00944 0.01372 0.02453 0.02592 -0.00326 231 3PZ -0.00526 0.00720 0.01435 0.01374 -0.00177 232 4XX -0.00431 0.00406 0.00241 0.00223 -0.00014 233 4YY 0.00384 -0.00512 0.00087 -0.00414 -0.00032 234 4ZZ 0.00015 -0.00351 0.00441 -0.00424 -0.00051 235 4XY 0.00463 -0.00331 -0.00631 -0.00057 0.00091 236 4XZ 0.00260 -0.00200 -0.00337 -0.00048 0.00044 237 4YZ 0.00311 -0.00129 -0.00291 0.00013 0.00017 238 21 C 1S 0.06152 -0.04118 -0.09157 -0.00249 0.01257 239 2S -0.12502 0.08463 0.19055 0.00532 -0.02642 240 2PX 0.02001 0.09384 -0.04888 0.14690 -0.00102 241 2PY 0.01474 -0.03050 0.07113 0.01018 -0.01518 242 2PZ 0.00825 -0.01869 0.03994 0.00207 -0.00720 243 3S -0.09882 0.08149 0.17019 0.00358 -0.02583 244 3PX -0.00530 0.03671 -0.02714 0.03091 0.00065 245 3PY -0.00359 -0.01641 0.04626 0.00518 -0.00710 246 3PZ -0.00169 -0.00961 0.02592 0.00189 -0.00413 247 4XX 0.00020 -0.00461 -0.00469 -0.00245 0.00069 248 4YY 0.00067 0.00114 -0.00003 0.00111 -0.00009 249 4ZZ 0.00424 -0.00210 -0.00538 0.00049 0.00064 250 4XY -0.00348 -0.00148 0.00328 -0.00644 -0.00006 251 4XZ -0.00183 -0.00085 0.00171 -0.00345 -0.00009 252 4YZ -0.00308 0.00295 0.00465 0.00085 -0.00065 253 22 H 1S -0.03433 0.02227 0.10405 0.01803 -0.01767 254 2S -0.00076 0.00662 0.02622 0.01071 -0.00541 255 23 H 1S 0.01104 0.02623 -0.07048 0.06519 0.00663 256 2S 0.00251 0.00325 -0.01702 0.01817 0.00183 257 24 H 1S 0.06076 -0.07022 -0.03073 -0.05595 -0.00029 258 2S 0.00748 -0.01165 -0.00698 -0.01451 -0.00002 259 25 H 1S 0.01765 -0.01069 0.09901 0.02622 -0.01606 260 2S 0.00320 -0.00297 0.02296 0.00766 -0.00465 261 26 H 1S -0.03491 0.04733 -0.06686 0.06045 0.00053 262 2S -0.00112 0.01054 -0.01211 0.01946 -0.00396 263 27 H 1S 0.07310 -0.04967 0.04620 0.08112 0.00651 264 2S 0.00673 -0.01052 0.01615 0.02696 0.00343 41 42 43 44 45 O O O O O Eigenvalues -- -0.59427 -0.55832 -0.53260 -0.52763 -0.50703 1 1 C 1S 0.04350 -0.02715 0.03333 -0.00591 -0.01118 2 2S -0.09176 0.05794 -0.07222 0.01150 0.02258 3 2PX -0.10568 -0.05301 0.01808 0.18681 -0.15358 4 2PY 0.00069 0.14943 0.12826 0.12613 0.13198 5 2PZ 0.00719 0.08500 0.10357 0.10046 0.04401 6 3S -0.13035 0.08064 -0.13009 0.03365 0.01983 7 3PX -0.03131 -0.01418 0.01976 0.10206 -0.05074 8 3PY -0.00211 0.05875 0.05995 0.05590 0.04634 9 3PZ 0.00579 0.03117 0.04913 0.04338 0.01010 10 4XX 0.00760 -0.00285 0.00298 -0.00240 -0.00264 11 4YY -0.00231 0.00287 0.00346 0.00518 0.00180 12 4ZZ 0.00155 -0.00052 0.00212 0.00142 -0.00001 13 4XY -0.00248 0.00359 0.00105 0.00378 0.00726 14 4XZ -0.00217 0.00317 -0.00157 0.00000 0.00735 15 4YZ -0.00356 0.00286 0.00095 0.00443 0.00124 16 2 C 1S -0.05610 0.02405 -0.01478 0.01551 0.02532 17 2S 0.11753 -0.04890 0.02673 -0.03679 -0.04922 18 2PX -0.00782 0.08902 -0.07957 -0.16180 0.16816 19 2PY 0.06699 0.07664 0.12435 -0.01012 -0.00673 20 2PZ 0.06443 0.03351 0.14857 0.05507 -0.08804 21 3S 0.15850 -0.08906 0.06551 -0.02424 -0.11773 22 3PX -0.00360 0.03593 -0.01544 -0.03667 0.08110 23 3PY 0.02513 0.04455 0.06050 0.00425 0.00619 24 3PZ 0.02319 0.01989 0.06858 0.03396 -0.03472 25 4XX -0.00487 0.00491 -0.00555 -0.00403 0.00607 26 4YY -0.00488 -0.00046 -0.00038 0.00235 -0.00049 27 4ZZ 0.00438 -0.00045 0.00732 0.00445 -0.00527 28 4XY -0.00343 0.00326 -0.00098 0.00382 0.00478 29 4XZ -0.00319 0.00187 -0.00204 0.00226 0.00344 30 4YZ 0.00205 -0.00106 0.00381 0.00320 -0.00386 31 3 H 1S 0.08752 -0.00997 0.12013 0.04231 -0.09973 32 2S 0.03209 -0.00706 0.05807 0.02809 -0.05057 33 4 Br 1S 0.00638 0.00005 0.00173 -0.00058 0.00060 34 2S -0.04157 -0.00035 -0.01135 0.00368 -0.00390 35 3S 0.04844 0.00040 0.01334 -0.00403 0.00453 36 4S 0.08722 0.00077 0.02378 -0.00829 0.00824 37 5S -0.07257 0.00095 -0.01925 -0.00240 -0.01266 38 6S -0.06839 -0.00447 -0.02303 0.03116 0.00768 39 7PX -0.00040 0.00481 -0.00176 -0.00509 0.00864 40 7PY -0.00720 0.00300 0.00086 0.00330 -0.00141 41 7PZ 0.00730 0.00251 0.00967 -0.00159 -0.00385 42 8PX 0.00121 -0.01471 0.00540 0.01559 -0.02648 43 8PY 0.02199 -0.00917 -0.00263 -0.01014 0.00431 44 8PZ -0.02231 -0.00768 -0.02959 0.00489 0.01179 45 9PX -0.00222 0.02552 -0.00967 -0.02747 0.04617 46 9PY -0.03724 0.01550 0.00463 0.01860 -0.00702 47 9PZ 0.03832 0.01311 0.05125 -0.00892 -0.02051 48 10PX -0.00197 0.01517 -0.00587 -0.01628 0.03041 49 10PY -0.01835 0.01113 0.00630 0.00444 -0.01056 50 10PZ 0.01679 0.00846 0.02996 -0.00337 -0.01223 51 11XX -0.01852 -0.00192 -0.00459 0.00150 -0.00389 52 11YY -0.02315 0.00280 -0.00269 0.00313 -0.00271 53 11ZZ -0.02390 -0.00142 -0.01081 0.00079 0.00053 54 11XY 0.00013 0.00203 -0.00164 -0.00405 0.00388 55 11XZ -0.00019 -0.00261 0.00014 0.00156 -0.00366 56 11YZ 0.00455 0.00021 0.00345 -0.00197 -0.00193 57 12XX -0.01042 0.00425 -0.00349 -0.00406 0.00122 58 12YY -0.00266 -0.00510 -0.00823 -0.00596 0.00020 59 12ZZ -0.00156 0.00266 0.00769 -0.00269 -0.00798 60 12XY -0.00034 -0.00389 0.00349 0.00894 -0.00832 61 12XZ 0.00032 0.00528 -0.00053 -0.00338 0.00786 62 12YZ -0.00704 -0.00030 -0.00591 0.00396 0.00301 63 5 C 1S 0.06111 -0.02323 0.00820 -0.01059 -0.00310 64 2S -0.12705 0.04894 -0.02074 0.02519 0.00428 65 2PX 0.02351 -0.08610 -0.06329 0.00243 0.02359 66 2PY 0.06620 -0.12631 -0.05267 0.07766 -0.04907 67 2PZ -0.01758 -0.04315 -0.00456 0.03109 -0.04603 68 3S -0.11084 0.04760 -0.00878 0.02045 0.02109 69 3PX -0.01233 -0.00642 -0.01530 0.00373 0.03939 70 3PY -0.00534 -0.00413 -0.00996 0.04878 0.02322 71 3PZ -0.01226 0.00164 -0.00389 0.00939 0.00809 72 4XX 0.00387 -0.00222 -0.00211 -0.00434 0.00037 73 4YY 0.00533 -0.00240 0.00240 -0.00215 -0.00597 74 4ZZ 0.00316 0.00015 0.00010 0.00577 0.00444 75 4XY 0.00037 0.00018 -0.00145 -0.00374 -0.00250 76 4XZ 0.00193 -0.00015 0.00088 -0.00066 -0.00328 77 4YZ 0.00366 -0.00100 0.00441 -0.00030 -0.00667 78 6 C 1S -0.03808 0.00001 -0.00497 -0.02019 -0.01096 79 2S 0.08117 -0.00009 0.00913 0.04124 0.01865 80 2PX -0.02760 -0.01394 -0.03383 0.03531 0.08486 81 2PY -0.02203 -0.02344 -0.05803 0.09447 0.09770 82 2PZ -0.12518 0.12715 0.03907 -0.08069 -0.00274 83 3S 0.05881 0.00792 0.00852 0.06011 0.06600 84 3PX 0.00223 -0.01632 -0.01259 0.01113 0.02598 85 3PY 0.01349 -0.02297 -0.02576 0.03193 0.01638 86 3PZ -0.04665 0.04759 0.01269 -0.02930 0.00813 87 4XX -0.00100 -0.00209 -0.00078 -0.00180 -0.00096 88 4YY 0.00319 -0.00359 -0.00082 -0.00056 -0.00299 89 4ZZ -0.00543 0.00346 -0.00175 0.00233 0.00404 90 4XY 0.00393 -0.00202 -0.00088 0.00012 -0.00142 91 4XZ -0.00114 -0.00110 -0.00150 -0.00148 0.00005 92 4YZ -0.00077 -0.00173 -0.00114 -0.00096 -0.00344 93 7 C 1S -0.02428 0.02672 0.00890 0.01152 0.01986 94 2S 0.05033 -0.05554 -0.01903 -0.02420 -0.04125 95 2PX 0.05097 0.00054 0.03247 -0.01747 -0.03947 96 2PY 0.09549 -0.00439 0.04555 -0.01144 -0.08043 97 2PZ -0.07245 0.11207 0.07613 -0.09557 -0.04547 98 3S 0.05442 -0.07218 -0.02765 -0.01644 -0.05650 99 3PX 0.01320 -0.00090 0.00911 -0.00708 -0.01539 100 3PY 0.02732 -0.00314 0.01074 -0.00574 -0.02967 101 3PZ -0.02498 0.04137 0.02870 -0.02977 -0.02056 102 4XX -0.00101 0.00105 0.00030 0.00162 0.00279 103 4YY 0.00051 0.00063 -0.00014 0.00390 0.00317 104 4ZZ -0.00171 -0.00044 -0.00115 -0.00115 -0.00106 105 4XY 0.00165 -0.00086 -0.00044 0.00151 0.00137 106 4XZ 0.00210 -0.00046 0.00037 -0.00107 -0.00122 107 4YZ 0.00371 -0.00027 0.00083 -0.00111 -0.00264 108 8 C 1S 0.05263 -0.01583 0.00480 -0.01861 -0.02766 109 2S -0.10893 0.03244 -0.01025 0.03856 0.05631 110 2PX 0.00867 0.02479 0.03760 -0.07860 -0.06920 111 2PY 0.01279 0.04204 0.05773 -0.12489 -0.11837 112 2PZ 0.04679 0.01333 0.05308 -0.00900 -0.08952 113 3S -0.08677 0.02153 -0.01592 0.04934 0.07165 114 3PX 0.01026 0.00742 0.01334 -0.02902 -0.02185 115 3PY 0.01686 0.01300 0.02048 -0.04577 -0.04017 116 3PZ 0.01712 0.00344 0.01912 -0.00330 -0.03117 117 4XX 0.00221 -0.00076 -0.00003 -0.00057 0.00013 118 4YY -0.00086 0.00087 -0.00039 0.00078 0.00226 119 4ZZ 0.00597 -0.00451 -0.00092 0.00010 -0.00405 120 4XY -0.00368 0.00169 -0.00036 0.00122 0.00360 121 4XZ -0.00042 0.00089 0.00033 0.00054 0.00080 122 4YZ -0.00072 0.00171 0.00085 0.00087 0.00133 123 9 C 1S -0.05450 0.02622 -0.00298 0.00340 0.03006 124 2S 0.11260 -0.05456 0.00558 -0.00728 -0.06280 125 2PX 0.00456 0.02015 0.00851 -0.05792 0.00572 126 2PY 0.00483 0.04150 0.02120 -0.09118 -0.00768 127 2PZ 0.09874 -0.10100 -0.06785 0.05400 0.05053 128 3S 0.10739 -0.07219 0.00142 0.00191 -0.07887 129 3PX -0.00198 0.00541 0.00579 -0.01836 -0.00267 130 3PY -0.00506 0.01279 0.00963 -0.02853 -0.01021 131 3PZ 0.04253 -0.03857 -0.01955 0.02253 0.00865 132 4XX -0.00300 0.00097 -0.00097 0.00034 0.00326 133 4YY -0.00014 0.00007 -0.00122 0.00089 0.00263 134 4ZZ -0.00284 0.00006 -0.00009 0.00218 -0.00001 135 4XY 0.00262 -0.00120 -0.00073 -0.00004 0.00096 136 4XZ -0.00146 0.00028 -0.00086 0.00133 0.00283 137 4YZ -0.00250 0.00041 -0.00139 0.00204 0.00522 138 10 C 1S -0.00033 0.00232 0.01517 -0.00510 -0.03371 139 2S 0.00205 -0.00580 -0.03242 0.00899 0.06901 140 2PX -0.06317 0.01157 -0.01304 0.03033 0.03717 141 2PY -0.10111 0.03121 -0.00307 0.07077 0.02169 142 2PZ 0.08458 -0.12297 -0.07951 0.10371 0.08958 143 3S -0.00898 0.00285 -0.03746 0.03217 0.10268 144 3PX -0.01169 -0.00542 -0.00497 0.01210 0.00645 145 3PY -0.01578 -0.00427 0.00202 0.02822 -0.00920 146 3PZ 0.02941 -0.05425 -0.03343 0.03000 0.02373 147 4XX 0.00114 -0.00169 -0.00007 -0.00091 -0.00247 148 4YY 0.00359 -0.00346 0.00054 0.00079 -0.00578 149 4ZZ -0.00395 0.00284 -0.00079 0.00214 0.00560 150 4XY 0.00208 -0.00227 -0.00104 0.00009 -0.00141 151 4XZ 0.00319 -0.00108 0.00028 -0.00008 -0.00064 152 4YZ 0.00489 -0.00222 0.00001 -0.00173 0.00045 153 11 H 1S 0.02371 -0.05433 -0.05149 0.06695 0.08286 154 2S 0.01205 -0.02233 -0.02320 0.04048 0.05021 155 12 H 1S 0.07477 -0.07276 -0.02937 0.05334 -0.00935 156 2S 0.02681 -0.03424 -0.01734 0.03166 -0.00067 157 13 H 1S -0.05536 -0.00968 -0.04389 0.09008 0.10785 158 2S -0.01803 -0.00629 -0.02456 0.04988 0.06532 159 14 H 1S 0.03794 -0.07406 -0.05229 0.03769 0.01554 160 2S 0.01483 -0.03458 -0.02878 0.02442 0.01200 161 15 H 1S 0.06168 -0.05354 -0.03452 0.08316 0.05956 162 2S 0.01822 -0.02270 -0.01959 0.04453 0.04180 163 16 C 1S -0.03439 0.01241 0.00440 0.00517 0.04475 164 2S 0.07339 -0.02737 -0.00767 -0.01008 -0.09625 165 2PX 0.13005 0.10117 0.11317 0.07875 0.05599 166 2PY -0.09437 -0.05714 -0.02606 0.09409 -0.09010 167 2PZ -0.05507 -0.03430 -0.00558 0.06246 -0.06793 168 3S 0.07529 -0.02621 -0.00888 -0.03244 -0.13322 169 3PX 0.01352 0.02564 -0.02095 0.01461 -0.00600 170 3PY -0.00257 -0.02125 0.01411 -0.01608 0.00127 171 3PZ -0.00322 -0.01138 0.01234 -0.00440 -0.00522 172 4XX 0.00095 -0.00067 -0.00466 -0.00642 0.00326 173 4YY -0.00362 0.00244 0.00496 0.00448 0.00441 174 4ZZ -0.00297 0.00115 0.00218 0.00225 0.00262 175 4XY 0.00322 -0.00483 0.01142 -0.00261 0.00645 176 4XZ 0.00180 -0.00254 0.00584 -0.00177 0.00430 177 4YZ -0.00086 0.00141 0.00281 0.00339 0.00023 178 17 C 1S 0.01667 0.00272 -0.04885 -0.01289 -0.03298 179 2S -0.03630 -0.00492 0.10201 0.02987 0.06565 180 2PX 0.07348 0.14410 -0.11542 0.07653 -0.09991 181 2PY 0.12088 0.02261 -0.02361 -0.11681 0.02862 182 2PZ 0.06207 0.00817 -0.00489 -0.06175 0.01160 183 3S -0.01987 -0.01792 0.14397 -0.00687 0.11752 184 3PX 0.04976 0.05773 -0.01846 0.02044 -0.01762 185 3PY 0.03356 0.00438 -0.01906 -0.05214 0.02861 186 3PZ 0.01573 0.00133 -0.00678 -0.02769 0.01073 187 4XX -0.00301 0.00007 0.00233 0.00223 0.00591 188 4YY 0.00195 -0.00282 -0.00373 -0.00426 -0.00607 189 4ZZ 0.00096 -0.00090 -0.00353 -0.00112 -0.00452 190 4XY 0.00447 0.00020 0.00837 -0.00146 0.00709 191 4XZ 0.00276 0.00008 0.00423 -0.00065 0.00349 192 4YZ 0.00074 -0.00172 -0.00008 -0.00202 -0.00263 193 18 C 1S 0.02665 0.00666 0.04547 0.00192 0.04071 194 2S -0.05530 -0.01413 -0.09537 -0.00460 -0.08421 195 2PX 0.09164 -0.01343 -0.04762 -0.14601 0.07989 196 2PY 0.06875 0.13173 -0.01455 0.06745 0.07863 197 2PZ 0.03432 0.07137 -0.00505 0.04125 0.03729 198 3S -0.07843 -0.03435 -0.11765 -0.00276 -0.11850 199 3PX 0.02970 0.00194 0.00052 -0.03305 0.01773 200 3PY 0.02225 0.04409 -0.00509 0.02632 0.02348 201 3PZ 0.01127 0.02359 -0.00253 0.01552 0.01163 202 4XX 0.00007 -0.00348 0.00898 -0.00120 0.00943 203 4YY -0.00000 0.00022 -0.00283 -0.00017 -0.00524 204 4ZZ 0.00120 0.00015 0.00178 0.00016 0.00045 205 4XY 0.00163 -0.00017 -0.00443 -0.00269 -0.00064 206 4XZ 0.00096 0.00003 -0.00263 -0.00148 -0.00047 207 4YZ -0.00108 0.00017 -0.00365 0.00007 -0.00518 208 19 C 1S -0.02405 0.01291 -0.04079 0.00834 -0.04055 209 2S 0.04987 -0.02792 0.08537 -0.01716 0.08505 210 2PX -0.04640 -0.10214 0.20278 0.04987 0.00995 211 2PY -0.00477 0.11426 -0.06112 0.14360 -0.06499 212 2PZ -0.00171 0.06431 -0.03685 0.07758 -0.03737 213 3S 0.04321 -0.03599 0.10609 -0.02251 0.11702 214 3PX -0.01651 -0.04110 0.07449 0.01994 -0.00074 215 3PY -0.00036 0.04483 -0.02205 0.05199 -0.02141 216 3PZ 0.00013 0.02524 -0.01305 0.02824 -0.01283 217 4XX 0.00007 -0.00182 0.00028 -0.00265 0.00050 218 4YY -0.00309 -0.00040 -0.00130 0.00179 -0.00369 219 4ZZ -0.00242 0.00028 -0.00234 0.00104 -0.00321 220 4XY -0.00403 -0.00020 -0.00744 0.00130 -0.00867 221 4XZ -0.00224 -0.00008 -0.00413 0.00075 -0.00466 222 4YZ -0.00043 -0.00051 0.00125 0.00078 -0.00022 223 20 C 1S 0.04349 -0.00344 0.03358 -0.01873 0.04292 224 2S -0.08992 0.00718 -0.07021 0.03956 -0.08919 225 2PX -0.09107 -0.10873 0.09143 0.05565 -0.12313 226 2PY -0.05705 -0.06174 -0.06454 -0.12248 -0.00300 227 2PZ -0.02927 -0.03131 -0.03594 -0.06660 -0.00145 228 3S -0.11567 -0.01091 -0.08477 0.05368 -0.12466 229 3PX -0.02878 -0.03470 0.03165 0.01466 -0.03996 230 3PY -0.02656 -0.01525 -0.01780 -0.01950 -0.00281 231 3PZ -0.01395 -0.00755 -0.01005 -0.01051 -0.00144 232 4XX -0.00092 -0.00009 -0.00316 -0.00066 -0.00605 233 4YY 0.00152 -0.00266 0.00638 -0.00088 0.00641 234 4ZZ 0.00260 -0.00132 0.00377 -0.00129 0.00411 235 4XY -0.00055 0.00264 -0.00298 0.00515 -0.00630 236 4XZ -0.00018 0.00142 -0.00158 0.00266 -0.00300 237 4YZ -0.00097 -0.00130 0.00249 0.00022 0.00225 238 21 C 1S -0.00796 0.02156 -0.02379 0.03115 -0.04016 239 2S 0.01562 -0.04627 0.04673 -0.06787 0.08290 240 2PX -0.10705 -0.03023 -0.11370 -0.11782 0.04648 241 2PY -0.07344 -0.12836 0.12092 -0.02163 0.06171 242 2PZ -0.03814 -0.06955 0.07234 -0.00454 0.02635 243 3S 0.02957 -0.05397 0.10357 -0.06223 0.12116 244 3PX -0.01440 -0.01588 -0.04065 -0.06685 0.01015 245 3PY -0.04355 -0.05363 0.02450 -0.00464 0.00692 246 3PZ -0.02335 -0.02922 0.01618 0.00153 -0.00007 247 4XX -0.00212 -0.00139 -0.00292 0.00497 -0.01191 248 4YY -0.00015 -0.00060 0.00291 -0.00145 0.00592 249 4ZZ -0.00093 0.00064 -0.00095 0.00072 -0.00036 250 4XY 0.00616 -0.00086 0.00683 -0.00113 0.00224 251 4XZ 0.00343 -0.00036 0.00345 -0.00106 0.00193 252 4YZ 0.00049 -0.00095 0.00300 -0.00204 0.00588 253 22 H 1S -0.03956 -0.09055 0.08978 -0.04718 0.08582 254 2S -0.01493 -0.03722 0.05572 -0.02148 0.05826 255 23 H 1S -0.08562 -0.05753 -0.00203 0.02085 -0.10722 256 2S -0.03366 -0.03098 0.00350 0.00756 -0.06046 257 24 H 1S 0.00619 -0.09081 0.14308 -0.04229 0.07195 258 2S 0.00244 -0.04232 0.07535 -0.02375 0.03962 259 25 H 1S -0.06317 -0.07658 -0.03300 -0.03066 -0.09456 260 2S -0.02532 -0.03838 -0.01145 -0.01648 -0.05397 261 26 H 1S -0.06968 -0.07230 0.10667 -0.00196 0.08582 262 2S -0.02327 -0.03487 0.05894 -0.00359 0.06264 263 27 H 1S -0.05457 0.09700 0.05919 0.11968 0.06090 264 2S -0.02141 0.04008 0.03986 0.05688 0.04142 46 47 48 49 50 O O O O O Eigenvalues -- -0.48896 -0.47627 -0.46984 -0.46000 -0.45902 1 1 C 1S -0.00428 0.01613 -0.00265 -0.00182 -0.00181 2 2S 0.00857 -0.03170 0.00372 0.00197 0.00648 3 2PX 0.01891 -0.06759 0.03944 0.05691 -0.20139 4 2PY -0.01578 0.05718 0.04432 0.16012 0.01766 5 2PZ 0.06744 -0.03740 0.01985 0.10833 -0.00492 6 3S 0.00235 -0.09895 0.01737 -0.00742 -0.01740 7 3PX -0.05587 -0.02600 0.01134 -0.02105 -0.05124 8 3PY -0.00938 0.05015 0.00794 0.06871 0.02175 9 3PZ 0.02623 0.00240 0.00180 0.04872 -0.00542 10 4XX -0.00589 0.00348 -0.00587 -0.00725 0.00626 11 4YY 0.00512 -0.00201 0.00482 0.00925 -0.00499 12 4ZZ 0.00059 0.00179 0.00124 0.00210 -0.00180 13 4XY -0.00251 -0.00380 0.00241 0.00463 0.00408 14 4XZ -0.00514 0.00082 0.00193 0.00300 0.00367 15 4YZ 0.00334 -0.00196 0.00372 0.00632 -0.00466 16 2 C 1S 0.02191 -0.00810 0.00387 0.01748 0.00299 17 2S -0.04313 0.01262 -0.00881 -0.03307 -0.00112 18 2PX -0.01180 0.04554 -0.05231 -0.06976 0.20288 19 2PY 0.07353 0.13432 -0.01806 0.01593 -0.09750 20 2PZ 0.20956 -0.05574 -0.03245 0.00842 -0.05640 21 3S -0.12470 0.03950 -0.01550 -0.11634 -0.00793 22 3PX -0.02720 0.03038 -0.02226 -0.02572 0.09123 23 3PY 0.02881 0.05839 -0.00179 0.03691 -0.05703 24 3PZ 0.11758 -0.05357 -0.01654 0.00853 -0.00193 25 4XX 0.00006 -0.00057 0.00031 -0.00101 0.00756 26 4YY -0.00161 -0.00243 0.00114 0.00320 0.00037 27 4ZZ 0.00593 0.00306 -0.00055 0.00142 -0.01086 28 4XY -0.00359 -0.00047 0.00295 0.00475 0.00531 29 4XZ -0.00381 0.00001 0.00244 0.00457 -0.00032 30 4YZ 0.00238 -0.00246 0.00057 0.00323 -0.00547 31 3 H 1S 0.10409 -0.00001 -0.01470 0.00352 -0.10163 32 2S 0.06545 0.00824 -0.01024 0.00132 -0.07701 33 4 Br 1S -0.00355 0.00596 0.00041 -0.00012 -0.00292 34 2S 0.02322 -0.03919 -0.00272 0.00074 0.01945 35 3S -0.02731 0.04632 0.00331 -0.00075 -0.02350 36 4S -0.04879 0.08205 0.00552 -0.00177 -0.03996 37 5S 0.03537 -0.06939 -0.00489 0.00168 0.03464 38 6S 0.06138 -0.07565 -0.00467 0.00033 0.03641 39 7PX -0.00416 0.00543 -0.00098 -0.00014 0.01029 40 7PY 0.01652 -0.02022 -0.00161 0.00402 0.01010 41 7PZ -0.00288 0.01297 0.00054 0.00381 -0.01102 42 8PX 0.01275 -0.01665 0.00301 0.00045 -0.03159 43 8PY -0.05065 0.06201 0.00494 -0.01234 -0.03097 44 8PZ 0.00882 -0.03978 -0.00165 -0.01168 0.03382 45 9PX -0.02237 0.02936 -0.00536 -0.00101 0.05583 46 9PY 0.08898 -0.10883 -0.00874 0.02171 0.05431 47 9PZ -0.01546 0.07087 0.00279 0.02024 -0.05999 48 10PX -0.01367 0.01700 -0.00358 -0.00075 0.04074 49 10PY 0.04747 -0.06577 -0.00406 0.01666 0.03101 50 10PZ -0.00442 0.03665 0.00172 0.01523 -0.03306 51 11XX 0.01048 -0.01750 -0.00155 -0.00053 0.00705 52 11YY 0.01879 -0.02438 -0.00215 0.00208 0.01173 53 11ZZ 0.00764 -0.02085 -0.00081 -0.00057 0.01322 54 11XY -0.00224 0.00237 -0.00095 -0.00147 0.00468 55 11XZ 0.00075 -0.00220 0.00030 -0.00024 -0.00291 56 11YZ -0.00362 0.00570 0.00028 0.00034 -0.00347 57 12XX 0.00243 -0.01088 -0.00044 0.00129 0.01190 58 12YY -0.01058 0.00108 0.00017 -0.00387 0.00334 59 12ZZ 0.01049 -0.00561 -0.00230 0.00127 -0.00076 60 12XY 0.00428 -0.00467 0.00249 0.00403 -0.01185 61 12XZ -0.00153 0.00438 -0.00060 0.00010 0.00723 62 12YZ 0.00562 -0.00981 -0.00023 -0.00051 0.00467 63 5 C 1S 0.02012 0.02223 -0.02079 -0.05166 -0.02169 64 2S -0.04248 -0.04480 0.04672 0.10761 0.04789 65 2PX -0.07756 -0.04680 -0.01749 -0.03540 0.02262 66 2PY -0.09292 0.00207 0.03837 -0.01429 -0.09445 67 2PZ 0.07653 -0.14423 -0.01353 -0.06514 0.14126 68 3S -0.06405 -0.07508 0.05434 0.17924 0.06702 69 3PX 0.00300 -0.02467 -0.01280 0.01379 0.01526 70 3PY 0.01045 0.00247 0.01500 0.02838 -0.02398 71 3PZ 0.00459 -0.00684 -0.00085 -0.00217 0.01988 72 4XX -0.00170 -0.00029 -0.00131 -0.00418 0.00189 73 4YY -0.00489 0.00027 0.00028 -0.00187 -0.00360 74 4ZZ 0.01062 0.00507 -0.00253 -0.00503 -0.00204 75 4XY -0.00529 -0.00122 0.00155 -0.00013 0.00262 76 4XZ 0.00023 -0.00232 0.00077 0.00041 0.00032 77 4YZ 0.00011 -0.00400 0.00032 0.00200 -0.00345 78 6 C 1S -0.04556 -0.01862 0.01087 0.02618 0.00523 79 2S 0.09478 0.03644 -0.02109 -0.05419 -0.00594 80 2PX -0.01299 0.04951 -0.02166 0.00495 -0.04095 81 2PY 0.00656 0.12168 0.01134 0.00254 -0.09543 82 2PZ -0.10159 0.05759 0.04344 0.15411 -0.06832 83 3S 0.11705 0.08111 -0.03102 -0.05103 -0.04059 84 3PX -0.01517 0.02038 -0.01319 -0.01310 -0.02214 85 3PY -0.01067 0.04920 0.00632 -0.01805 -0.04469 86 3PZ -0.03522 0.03655 0.01178 0.04604 -0.04331 87 4XX -0.00358 -0.00256 -0.00007 0.00027 0.00068 88 4YY -0.00209 -0.00164 -0.00035 -0.00393 -0.00039 89 4ZZ -0.00023 0.00243 0.00203 0.00632 0.00114 90 4XY 0.00022 0.00049 0.00008 -0.00372 -0.00024 91 4XZ -0.00561 -0.00309 0.00126 0.00516 0.00254 92 4YZ -0.00825 -0.00366 0.00425 0.00943 0.00106 93 7 C 1S 0.03958 0.02146 -0.01334 -0.02539 -0.00469 94 2S -0.08232 -0.04321 0.02805 0.05123 0.00870 95 2PX 0.05714 -0.06518 -0.02817 -0.05241 0.06629 96 2PY 0.10107 -0.09442 -0.01550 -0.07127 0.10782 97 2PZ 0.02563 0.08040 -0.04391 -0.14439 -0.11479 98 3S -0.10757 -0.05983 0.03543 0.06058 0.01124 99 3PX 0.01259 -0.02044 -0.01237 -0.02656 0.01737 100 3PY 0.02373 -0.02288 -0.00534 -0.03971 0.02613 101 3PZ 0.01421 0.01958 -0.01367 -0.04695 -0.02966 102 4XX 0.00424 0.00141 -0.00211 -0.00274 0.00008 103 4YY 0.00790 0.00376 -0.00191 -0.00516 -0.00048 104 4ZZ -0.00653 -0.00225 0.00292 0.00665 0.00113 105 4XY 0.00316 0.00061 -0.00107 -0.00184 0.00074 106 4XZ -0.00183 -0.00322 0.00092 0.00457 0.00304 107 4YZ -0.00166 -0.00390 0.00232 0.00682 0.00411 108 8 C 1S -0.03264 -0.02578 0.01418 0.03574 0.01116 109 2S 0.06686 0.05319 -0.02903 -0.07561 -0.02363 110 2PX -0.06579 -0.02076 -0.00344 -0.03225 -0.03621 111 2PY -0.11142 -0.01059 0.01256 -0.04488 -0.08140 112 2PZ 0.08731 -0.13614 -0.01448 -0.06978 0.13197 113 3S 0.08802 0.07074 -0.04084 -0.10674 -0.03702 114 3PX -0.02261 -0.00734 -0.00313 -0.01102 -0.01127 115 3PY -0.03733 -0.00186 0.00477 -0.01408 -0.02801 116 3PZ 0.03369 -0.04878 -0.00547 -0.02298 0.04407 117 4XX -0.00057 -0.00045 -0.00023 0.00100 0.00067 118 4YY 0.00274 0.00363 -0.00050 -0.00089 -0.00092 119 4ZZ -0.00591 -0.00666 0.00323 0.00709 0.00316 120 4XY 0.00378 0.00351 -0.00180 -0.00258 -0.00066 121 4XZ 0.00249 0.00048 -0.00083 -0.00198 0.00129 122 4YZ 0.00453 0.00127 -0.00153 -0.00361 0.00154 123 9 C 1S 0.02693 0.02949 -0.01247 -0.02446 -0.00668 124 2S -0.05565 -0.06124 0.02597 0.04858 0.01456 125 2PX -0.05146 0.06544 -0.01624 -0.03648 -0.06398 126 2PY -0.07398 0.12406 -0.01153 -0.06491 -0.12519 127 2PZ -0.09621 0.03472 0.04698 0.16586 -0.05352 128 3S -0.07619 -0.07786 0.03287 0.05946 0.01130 129 3PX -0.01647 0.01976 -0.00859 -0.01953 -0.02654 130 3PY -0.02360 0.04117 -0.00550 -0.03376 -0.05061 131 3PZ -0.02049 0.00319 0.01317 0.04168 -0.01953 132 4XX 0.00136 0.00202 -0.00108 -0.00085 0.00031 133 4YY 0.00010 0.00309 0.00073 0.00275 -0.00064 134 4ZZ 0.00291 -0.00143 -0.00073 -0.00295 0.00037 135 4XY -0.00137 0.00030 0.00044 0.00290 0.00054 136 4XZ 0.00318 0.00413 -0.00172 -0.00553 -0.00178 137 4YZ 0.00504 0.00664 -0.00347 -0.00911 -0.00279 138 10 C 1S -0.01586 -0.03308 0.01118 0.02600 0.00429 139 2S 0.02802 0.07100 -0.02211 -0.05307 -0.00873 140 2PX 0.07214 -0.06354 -0.02376 -0.02084 0.10062 141 2PY 0.13333 -0.07703 -0.00482 -0.01465 0.12070 142 2PZ 0.02887 0.09459 -0.03028 -0.09293 -0.09632 143 3S 0.08527 0.06648 -0.03307 -0.06425 0.01168 144 3PX 0.02656 -0.02864 -0.01323 -0.02443 0.03509 145 3PY 0.05413 -0.03236 -0.00474 -0.02814 0.03115 146 3PZ -0.01487 0.03681 -0.00783 -0.03223 -0.03541 147 4XX -0.00320 -0.00390 0.00083 0.00218 0.00151 148 4YY -0.00459 -0.00510 0.00279 0.00474 -0.00016 149 4ZZ 0.00613 0.00477 -0.00220 -0.00407 -0.00052 150 4XY -0.00210 -0.00258 0.00083 0.00090 0.00125 151 4XZ 0.00068 0.00428 -0.00065 -0.00496 -0.00472 152 4YZ -0.00040 0.00469 -0.00292 -0.00873 -0.00507 153 11 H 1S 0.05852 0.07147 -0.03260 -0.08607 -0.03683 154 2S 0.04675 0.04658 -0.02256 -0.05593 -0.03091 155 12 H 1S -0.03231 -0.07112 0.03981 0.12619 0.04121 156 2S -0.01897 -0.04300 0.02655 0.09051 0.02805 157 13 H 1S 0.09015 0.05628 -0.01803 0.00148 0.01917 158 2S 0.05624 0.03539 -0.01011 0.01023 0.01747 159 14 H 1S -0.07129 -0.04818 0.04315 0.12238 0.04929 160 2S -0.04044 -0.03121 0.02899 0.08611 0.03820 161 15 H 1S 0.08580 0.04833 -0.03036 -0.09432 -0.01853 162 2S 0.05779 0.02780 -0.02239 -0.06364 -0.01015 163 16 C 1S -0.01872 -0.03818 0.00582 -0.00968 -0.00909 164 2S 0.03808 0.08157 -0.01258 0.02061 0.01954 165 2PX -0.09560 0.11069 -0.09660 0.04439 0.16931 166 2PY -0.12486 -0.04340 -0.09828 -0.10751 -0.04107 167 2PZ -0.02813 -0.06969 -0.05488 -0.04615 -0.04042 168 3S 0.08341 0.15437 -0.02415 0.05166 0.04437 169 3PX -0.02068 -0.00036 0.00680 -0.00404 0.02034 170 3PY 0.00921 0.01300 -0.00151 0.00300 -0.01545 171 3PZ 0.02530 -0.01559 -0.00290 0.00935 -0.01106 172 4XX -0.00380 -0.00234 -0.01224 -0.00234 0.00304 173 4YY -0.00060 -0.00097 0.01015 0.00122 -0.00197 174 4ZZ 0.00019 -0.00289 0.00333 0.00029 -0.00126 175 4XY -0.00099 0.00018 -0.00259 0.00106 0.00203 176 4XZ -0.00217 0.00170 -0.00099 0.00038 0.00113 177 4YZ 0.00168 -0.00033 0.00625 0.00135 -0.00140 178 17 C 1S 0.00707 0.01130 -0.02189 -0.00143 0.00431 179 2S -0.01756 -0.02208 0.04971 0.00045 -0.00606 180 2PX -0.01974 0.11750 0.22021 -0.08948 0.14743 181 2PY 0.14123 0.07763 0.10175 0.10235 0.00078 182 2PZ 0.09114 0.01715 0.04577 0.06567 -0.00904 183 3S 0.02902 -0.01518 0.08494 0.04549 -0.01371 184 3PX 0.00945 0.06027 0.06818 -0.00158 0.07331 185 3PY 0.05562 0.00573 0.05323 0.03507 -0.02199 186 3PZ 0.03638 -0.01076 0.02566 0.02323 -0.01624 187 4XX -0.00478 -0.01007 -0.00367 -0.00278 -0.00697 188 4YY 0.00417 0.00755 -0.00228 0.00356 0.00314 189 4ZZ 0.00212 0.00194 -0.00138 0.00072 0.00117 190 4XY 0.00033 -0.00043 -0.00634 0.00593 -0.00084 191 4XZ 0.00068 -0.00003 -0.00336 0.00331 -0.00054 192 4YZ 0.00354 0.00301 -0.00061 0.00269 0.00119 193 18 C 1S -0.00915 -0.01472 -0.00878 0.00634 -0.00333 194 2S 0.02040 0.02889 0.02304 -0.01462 0.00570 195 2PX 0.13310 -0.07542 0.05299 0.07879 -0.14041 196 2PY -0.05807 -0.09984 0.22643 -0.12848 -0.04014 197 2PZ -0.02774 -0.06281 0.11870 -0.06633 -0.02129 198 3S 0.01307 0.03013 0.03348 -0.03726 -0.00757 199 3PX 0.04379 0.00399 0.03843 0.02889 -0.01901 200 3PY -0.03014 -0.03919 0.07175 -0.05408 -0.01977 201 3PZ -0.01454 -0.02544 0.03676 -0.02742 -0.01211 202 4XX -0.00235 -0.00725 0.00059 -0.00124 -0.00463 203 4YY 0.00140 0.00662 -0.00543 0.00324 0.00418 204 4ZZ 0.00042 0.00047 -0.00142 0.00123 0.00084 205 4XY 0.00192 -0.00433 -0.00579 0.00117 -0.00619 206 4XZ 0.00092 -0.00193 -0.00309 0.00061 -0.00319 207 4YZ 0.00152 0.00437 -0.00331 0.00210 0.00282 208 19 C 1S 0.01229 0.02709 -0.00275 0.01211 0.01318 209 2S -0.02676 -0.06033 0.00620 -0.02793 -0.03178 210 2PX -0.08032 0.12513 -0.08294 0.01121 0.17492 211 2PY -0.11772 -0.05961 -0.07472 -0.10795 -0.02579 212 2PZ -0.05698 -0.04304 -0.04005 -0.05480 -0.02090 213 3S -0.03425 -0.08427 0.00680 -0.03557 -0.03765 214 3PX -0.02885 0.04546 0.00032 -0.00750 0.05976 215 3PY -0.03966 -0.01455 0.00340 -0.04706 0.00091 216 3PZ -0.01807 -0.01330 0.00115 -0.02326 -0.00255 217 4XX 0.00298 0.00324 0.01086 -0.00027 0.00279 218 4YY -0.00091 0.00230 -0.00877 0.00246 0.00146 219 4ZZ 0.00042 0.00138 -0.00275 0.00117 0.00058 220 4XY 0.00276 0.00159 0.00198 -0.00083 -0.00323 221 4XZ 0.00113 0.00130 0.00086 -0.00062 -0.00166 222 4YZ -0.00093 0.00015 -0.00547 0.00137 0.00064 223 20 C 1S -0.01052 -0.01063 0.01109 -0.01098 0.00795 224 2S 0.01957 0.02028 -0.02814 0.02118 -0.01644 225 2PX 0.01450 0.17820 0.21316 -0.04004 0.11606 226 2PY 0.13983 0.04920 0.08138 0.10746 -0.01549 227 2PZ 0.08339 0.01265 0.03862 0.06417 -0.01532 228 3S 0.02902 0.01168 -0.03072 0.03497 -0.05380 229 3PX 0.00245 0.07443 0.05557 -0.01074 0.06067 230 3PY 0.03500 0.00114 0.04710 0.01922 -0.01686 231 3PZ 0.02195 -0.00549 0.02395 0.01284 -0.01222 232 4XX 0.00481 0.00892 0.00277 0.00567 0.00452 233 4YY -0.00363 -0.00498 0.00264 -0.00533 -0.00143 234 4ZZ -0.00174 -0.00229 0.00070 -0.00227 -0.00003 235 4XY -0.00025 0.00130 0.00634 -0.00328 -0.00126 236 4XZ -0.00084 0.00119 0.00346 -0.00225 -0.00053 237 4YZ -0.00152 -0.00261 0.00150 -0.00261 -0.00124 238 21 C 1S 0.01128 0.01216 0.01917 0.00674 -0.00938 239 2S -0.02222 -0.02528 -0.04442 -0.01194 0.01919 240 2PX 0.12973 -0.10732 0.07815 0.05209 -0.13693 241 2PY -0.04411 -0.03436 0.22212 -0.15508 -0.00845 242 2PZ -0.01136 -0.03598 0.11839 -0.07855 -0.00913 243 3S -0.06098 -0.00975 -0.08205 -0.02906 0.07207 244 3PX 0.06522 -0.00632 0.04059 0.02527 -0.02659 245 3PY -0.01506 -0.03102 0.08279 -0.06079 -0.02694 246 3PZ -0.00193 -0.02650 0.04392 -0.02997 -0.01974 247 4XX 0.00181 0.00800 -0.00188 0.00354 0.00212 248 4YY -0.00148 -0.00585 0.00649 -0.00569 -0.00244 249 4ZZ 0.00000 -0.00067 0.00235 -0.00130 -0.00113 250 4XY -0.00052 0.00555 0.00480 -0.00108 0.00692 251 4XZ -0.00133 0.00398 0.00270 -0.00102 0.00421 252 4YZ -0.00203 -0.00382 0.00352 -0.00417 -0.00100 253 22 H 1S -0.02518 -0.05260 0.13702 -0.10183 -0.01146 254 2S -0.01289 -0.02936 0.10471 -0.06431 -0.00538 255 23 H 1S 0.04964 0.11800 0.12247 0.01512 0.05225 256 2S 0.03461 0.08038 0.09444 0.01040 0.03743 257 24 H 1S -0.00122 0.05282 -0.00274 0.03764 0.07890 258 2S 0.00240 0.04414 -0.00293 0.03163 0.06410 259 25 H 1S 0.03421 0.08959 -0.14240 0.07098 0.04336 260 2S 0.01832 0.06077 -0.10687 0.05210 0.03174 261 26 H 1S -0.03349 -0.09492 -0.12445 0.02499 -0.08296 262 2S -0.02049 -0.06520 -0.10164 0.02673 -0.04951 263 27 H 1S 0.02135 -0.01800 0.04805 0.12431 -0.03320 264 2S 0.02466 -0.02372 0.04469 0.08687 -0.02981 51 52 53 54 55 O O O O O Eigenvalues -- -0.43819 -0.43283 -0.42930 -0.40851 -0.40373 1 1 C 1S -0.00126 -0.00595 -0.00671 -0.00006 -0.02936 2 2S 0.00599 0.01690 0.00997 0.00210 0.06880 3 2PX -0.06581 -0.05530 0.06331 -0.04069 0.05869 4 2PY -0.10052 -0.07503 0.16831 0.00450 -0.10525 5 2PZ 0.03911 0.17730 0.08247 0.01502 -0.05066 6 3S -0.01533 -0.00841 0.04048 -0.02307 0.14315 7 3PX -0.01375 -0.01207 0.00968 -0.01121 0.01395 8 3PY -0.04487 -0.04397 0.07591 0.00083 -0.05158 9 3PZ 0.02943 0.09825 0.03229 0.00947 -0.02302 10 4XX 0.00371 0.00142 -0.00694 0.00138 -0.00377 11 4YY -0.00228 0.00292 0.00752 -0.00406 -0.00270 12 4ZZ -0.00313 -0.00473 0.00203 0.00292 -0.00028 13 4XY -0.00120 0.00433 0.01126 0.00790 -0.00257 14 4XZ -0.00198 0.00204 0.00770 -0.01000 -0.00458 15 4YZ -0.00334 -0.00112 0.00599 0.00299 0.00054 16 2 C 1S -0.00013 -0.00194 0.00178 -0.00067 0.00459 17 2S 0.00103 0.00799 -0.00224 0.00534 -0.00873 18 2PX 0.07786 0.05181 -0.08574 0.03529 -0.02664 19 2PY -0.02952 -0.14117 -0.17050 -0.11427 -0.00184 20 2PZ 0.08290 0.10200 -0.13896 0.18130 0.05003 21 3S -0.00461 -0.00099 0.00631 -0.01915 -0.02970 22 3PX 0.04427 0.03573 -0.05211 0.03236 -0.03175 23 3PY -0.01424 -0.06494 -0.10177 -0.05462 -0.00688 24 3PZ 0.03732 0.04973 -0.06810 0.09661 0.01883 25 4XX 0.00148 0.00222 -0.00084 0.00021 0.00416 26 4YY -0.00457 -0.00579 0.00345 -0.00662 -0.00455 27 4ZZ 0.00079 -0.00088 -0.00549 0.00197 0.00157 28 4XY -0.00496 -0.00335 0.00994 -0.00163 -0.00260 29 4XZ 0.00148 0.00684 0.00638 -0.00145 -0.00076 30 4YZ 0.00525 0.00845 -0.00082 0.01254 0.00196 31 3 H 1S 0.02691 0.01358 -0.09522 0.07247 0.03021 32 2S 0.02667 0.00941 -0.06302 0.05865 0.02746 33 4 Br 1S -0.00399 -0.00540 -0.00040 -0.00478 -0.00082 34 2S 0.02627 0.03537 0.00270 0.03115 0.00522 35 3S -0.03107 -0.04147 -0.00331 -0.03624 -0.00586 36 4S -0.05526 -0.07510 -0.00556 -0.06671 -0.01153 37 5S 0.04672 0.05080 0.00068 0.03548 0.00589 38 6S 0.04882 0.10093 0.01805 0.11679 0.02200 39 7PX -0.00323 -0.01218 0.00054 -0.00497 -0.00744 40 7PY 0.02000 0.02664 -0.00162 0.03930 0.00616 41 7PZ -0.00680 -0.02463 -0.01183 -0.02580 -0.00553 42 8PX 0.00990 0.03740 -0.00164 0.01528 0.02288 43 8PY -0.06143 -0.08189 0.00497 -0.12089 -0.01897 44 8PZ 0.02091 0.07568 0.03635 0.07936 0.01700 45 9PX -0.01743 -0.06644 0.00252 -0.02834 -0.04042 46 9PY 0.11036 0.14869 -0.00896 0.22006 0.03465 47 9PZ -0.03824 -0.13659 -0.06517 -0.14429 -0.03065 48 10PX -0.01425 -0.04998 0.00598 -0.01647 -0.03250 49 10PY 0.07174 0.08684 -0.00878 0.13757 0.02123 50 10PZ -0.01975 -0.08579 -0.03990 -0.09234 -0.02139 51 11XX 0.01203 0.01607 -0.00010 0.01134 0.00195 52 11YY 0.01741 0.02145 -0.00138 0.02249 0.00350 53 11ZZ 0.01266 0.01855 0.00606 0.01489 0.00230 54 11XY -0.00052 -0.00377 -0.00106 -0.00192 -0.00184 55 11XZ 0.00080 0.00184 0.00007 0.00139 0.00158 56 11YZ -0.00272 -0.00894 -0.00284 -0.00931 -0.00164 57 12XX 0.00653 0.00161 0.00221 0.00236 -0.00109 58 12YY -0.00490 -0.00841 0.00538 -0.02149 -0.00432 59 12ZZ 0.00553 -0.00287 -0.01022 -0.00528 -0.00141 60 12XY 0.00200 0.00988 0.00209 0.00508 0.00497 61 12XZ -0.00222 -0.00486 0.00062 -0.00435 -0.00401 62 12YZ 0.00527 0.01931 0.00530 0.02107 0.00407 63 5 C 1S -0.00334 0.00226 0.00592 -0.00294 -0.00058 64 2S 0.00584 -0.00707 -0.01079 0.00583 0.00426 65 2PX 0.02128 0.07976 0.12976 0.08046 -0.09136 66 2PY -0.02580 0.03240 0.19130 -0.01441 0.03554 67 2PZ -0.15518 -0.02790 0.06610 -0.03607 -0.01338 68 3S 0.01595 -0.00672 -0.05370 0.00352 -0.01530 69 3PX 0.01349 0.03919 0.02300 0.04936 -0.05283 70 3PY -0.01139 0.01826 0.03229 0.00712 0.01871 71 3PZ -0.00084 -0.02289 0.01044 -0.00737 -0.00131 72 4XX -0.00052 0.00173 0.00101 -0.00023 0.00139 73 4YY -0.00618 -0.00028 0.00133 -0.00219 -0.00202 74 4ZZ 0.00582 -0.00131 -0.00113 0.00218 0.00095 75 4XY -0.00273 0.00148 0.00186 -0.00083 0.00123 76 4XZ 0.00678 0.00103 0.00229 0.00213 0.00146 77 4YZ 0.01027 -0.00095 0.00271 0.00403 0.00029 78 6 C 1S -0.02307 0.00413 0.00861 -0.00390 -0.00555 79 2S 0.05255 -0.01073 -0.01740 0.00545 0.01125 80 2PX -0.04745 0.10230 -0.02544 0.09476 -0.06510 81 2PY -0.13495 0.13940 -0.04074 0.05475 0.05213 82 2PZ 0.20938 -0.04887 -0.08077 0.00946 0.01835 83 3S 0.09645 -0.01853 -0.05217 0.02487 0.02286 84 3PX -0.01509 0.03228 0.01242 0.04142 -0.03846 85 3PY -0.04666 0.04601 0.01997 0.00525 0.02453 86 3PZ 0.08418 -0.01406 -0.01452 0.01664 0.00850 87 4XX -0.00078 -0.00030 0.00289 -0.00064 -0.00042 88 4YY -0.00130 0.00054 0.00742 -0.00014 -0.00192 89 4ZZ -0.00544 0.00390 -0.00894 0.00159 0.00110 90 4XY 0.00002 0.00018 0.00464 -0.00050 0.00118 91 4XZ 0.00429 -0.00103 -0.00032 0.00050 -0.00302 92 4YZ 0.00515 -0.00534 -0.00007 -0.00439 0.00108 93 7 C 1S -0.01170 0.00704 -0.01777 0.00189 0.00205 94 2S 0.02909 -0.01552 0.03965 -0.00330 -0.00347 95 2PX 0.03974 -0.06378 0.02567 -0.01780 -0.05983 96 2PY 0.02956 -0.12285 0.02387 -0.10348 0.02368 97 2PZ 0.19536 -0.03258 0.17260 0.03095 0.00717 98 3S 0.03348 -0.02786 0.08182 -0.01476 -0.01252 99 3PX -0.00077 -0.01099 0.02227 -0.00088 -0.03381 100 3PY -0.01778 -0.02810 0.02997 -0.03734 0.01155 101 3PZ 0.06507 -0.01665 0.05837 0.00296 0.00142 102 4XX 0.00159 -0.00031 -0.00147 0.00074 -0.00132 103 4YY 0.00280 -0.00223 -0.00198 -0.00131 0.00194 104 4ZZ -0.00980 0.00498 -0.00224 0.00070 -0.00047 105 4XY 0.00258 -0.00156 -0.00113 -0.00028 -0.00023 106 4XZ 0.00153 -0.00179 -0.00371 -0.00029 -0.00231 107 4YZ 0.00259 -0.00461 -0.00615 -0.00362 0.00163 108 8 C 1S 0.00295 -0.00353 -0.01317 -0.00004 0.00120 109 2S -0.00715 0.00846 0.03266 0.00085 -0.00273 110 2PX -0.00665 0.04646 0.12136 0.05468 -0.05652 111 2PY -0.01560 0.06219 0.19309 0.03741 0.01420 112 2PZ -0.13180 -0.04310 0.06617 -0.07259 -0.02644 113 3S -0.00820 0.01511 0.04457 0.00404 -0.00271 114 3PX -0.00295 0.01985 0.03538 0.02549 -0.02888 115 3PY -0.01210 0.02546 0.05376 0.01166 0.01286 116 3PZ -0.00622 -0.03482 0.03543 -0.03011 -0.00898 117 4XX 0.00181 -0.00062 -0.00223 0.00073 -0.00179 118 4YY 0.00467 -0.00335 -0.00537 -0.00266 0.00326 119 4ZZ -0.00513 0.00224 0.00128 0.00109 -0.00064 120 4XY 0.00330 -0.00168 -0.00392 -0.00040 -0.00054 121 4XZ -0.00531 0.00166 -0.00339 -0.00078 -0.00030 122 4YZ -0.00861 0.00191 -0.00578 -0.00200 0.00054 123 9 C 1S 0.01505 -0.01271 -0.00379 -0.00799 0.00007 124 2S -0.03606 0.02902 0.00812 0.01649 0.00035 125 2PX -0.06364 0.09029 -0.03422 0.05128 -0.03950 126 2PY -0.13648 0.12351 -0.05587 0.01727 0.04361 127 2PZ 0.20167 -0.02745 -0.09149 0.04774 0.02979 128 3S -0.05942 0.04038 0.02782 0.02487 -0.00329 129 3PX -0.01390 0.02889 0.00556 0.02448 -0.02534 130 3PY -0.03572 0.03684 0.00854 0.00401 0.01868 131 3PZ 0.07559 -0.00996 -0.00637 0.01764 0.01026 132 4XX 0.00047 0.00018 -0.00275 0.00059 -0.00141 133 4YY -0.00028 -0.00100 -0.00768 -0.00156 0.00286 134 4ZZ 0.00661 -0.00342 0.00961 -0.00007 -0.00110 135 4XY 0.00001 0.00053 -0.00513 0.00089 -0.00051 136 4XZ -0.00328 0.00082 0.00046 -0.00225 0.00120 137 4YZ -0.00542 0.00202 0.00014 -0.00195 -0.00139 138 10 C 1S 0.01979 0.00152 0.01364 0.01210 0.00063 139 2S -0.04474 -0.00210 -0.03196 -0.02439 -0.00031 140 2PX 0.03833 -0.04779 0.03946 0.00702 -0.07369 141 2PY 0.01922 -0.13143 0.04779 -0.08072 0.01766 142 2PZ 0.20339 -0.05997 0.18859 -0.01383 -0.01725 143 3S -0.07462 0.00236 -0.05554 -0.03427 -0.00312 144 3PX 0.00297 -0.00373 0.03276 0.00894 -0.04048 145 3PY -0.01918 -0.04057 0.04508 -0.03174 0.01148 146 3PZ 0.07236 -0.03027 0.06882 -0.01272 -0.00619 147 4XX 0.00017 0.00229 0.00112 0.00220 -0.00011 148 4YY -0.00299 0.00265 0.00117 0.00256 0.00084 149 4ZZ 0.00983 -0.00667 0.00399 -0.00290 -0.00117 150 4XY -0.00211 0.00265 0.00112 0.00183 0.00023 151 4XZ -0.00142 0.00033 0.00378 -0.00227 0.00254 152 4YZ -0.00153 0.00363 0.00611 0.00118 -0.00249 153 11 H 1S 0.10792 -0.05891 0.10573 -0.02974 -0.01569 154 2S 0.09920 -0.04186 0.08148 -0.01605 -0.01176 155 12 H 1S 0.13530 -0.06232 -0.00838 0.01450 0.00584 156 2S 0.11537 -0.05585 -0.00740 0.01034 0.00470 157 13 H 1S 0.02592 -0.03588 -0.13266 -0.02719 0.01432 158 2S 0.02274 -0.03024 -0.11689 -0.02350 0.01360 159 14 H 1S -0.10948 0.03452 -0.08844 -0.00544 -0.00324 160 2S -0.09484 0.03062 -0.07757 -0.00601 -0.00280 161 15 H 1S -0.13029 0.09042 0.00766 0.04004 0.00474 162 2S -0.11110 0.07537 0.00347 0.04380 0.00303 163 16 C 1S -0.00116 0.00248 0.00875 -0.00133 0.01056 164 2S 0.00269 -0.00644 -0.01985 0.00256 -0.02719 165 2PX 0.01266 0.05513 0.06326 0.03383 -0.13193 166 2PY -0.02179 -0.12012 -0.06246 0.07292 0.06414 167 2PZ 0.08143 0.16410 -0.05056 -0.14993 0.00918 168 3S 0.00138 -0.00364 -0.01980 -0.00025 0.00399 169 3PX -0.00516 0.00253 0.01773 -0.00678 0.01208 170 3PY -0.01564 -0.05140 -0.00834 0.05656 -0.01996 171 3PZ 0.03905 0.09126 -0.01087 -0.08522 -0.03077 172 4XX 0.00212 0.00088 -0.00300 0.00017 0.00363 173 4YY -0.00259 -0.00187 0.00410 -0.00333 -0.00062 174 4ZZ 0.00004 0.00148 0.00157 0.00224 0.00092 175 4XY 0.00047 0.00042 -0.00097 0.00399 -0.01219 176 4XZ -0.00073 -0.00096 -0.00030 -0.00396 -0.00815 177 4YZ -0.00078 0.00070 0.00247 0.00159 0.00088 178 17 C 1S 0.00524 0.00155 -0.01153 0.00540 -0.01431 179 2S -0.00938 -0.00329 0.02318 -0.01260 0.03786 180 2PX 0.04171 0.05570 0.00530 0.00016 0.17911 181 2PY -0.04674 -0.05632 0.04645 0.08642 -0.09140 182 2PZ 0.03099 0.11106 0.01455 -0.13885 -0.08855 183 3S -0.02823 -0.00097 0.05835 -0.01341 0.00676 184 3PX 0.01754 0.02965 0.01391 0.00807 0.02800 185 3PY -0.01923 -0.03103 0.01642 0.05299 -0.05841 186 3PZ 0.02345 0.06002 0.00215 -0.07261 -0.05081 187 4XX -0.00059 -0.00165 -0.00106 0.00008 -0.00576 188 4YY -0.00121 -0.00350 -0.00045 0.00175 -0.00040 189 4ZZ 0.00202 0.00374 -0.00122 -0.00148 0.00002 190 4XY -0.00236 -0.00242 0.00319 0.00407 -0.00875 191 4XZ 0.00051 0.00396 0.00143 -0.00610 -0.00611 192 4YZ 0.00117 0.00296 -0.00014 -0.00167 -0.00035 193 18 C 1S -0.00374 -0.00060 0.00831 -0.00336 0.00968 194 2S 0.00755 0.00085 -0.01742 0.00668 -0.01817 195 2PX -0.03758 -0.03232 0.01713 0.01319 -0.22099 196 2PY -0.00599 -0.04441 -0.00490 0.07426 0.10156 197 2PZ 0.03858 0.08427 -0.01089 -0.14536 0.02392 198 3S 0.01320 -0.00428 -0.03771 0.01107 -0.03903 199 3PX -0.01446 -0.00436 0.01639 0.00357 -0.07159 200 3PY -0.00390 -0.02525 -0.00729 0.04267 0.03860 201 3PZ 0.01791 0.04187 -0.00828 -0.08126 0.00199 202 4XX -0.00101 -0.00112 0.00119 -0.00084 0.00302 203 4YY -0.00111 -0.00311 -0.00016 0.00618 -0.00235 204 4ZZ 0.00135 0.00398 0.00001 -0.00592 -0.00110 205 4XY -0.00055 -0.00190 -0.00298 0.00121 -0.01197 206 4XZ -0.00049 -0.00136 -0.00160 -0.00062 -0.00683 207 4YZ 0.00150 0.00346 -0.00068 -0.00397 -0.00326 208 19 C 1S -0.00003 0.00385 0.00572 0.00202 -0.00256 209 2S 0.00003 -0.00981 -0.01519 -0.00371 -0.00308 210 2PX 0.02176 0.04637 0.03607 -0.02420 0.23072 211 2PY 0.01233 -0.06139 -0.09880 0.08819 -0.09555 212 2PZ 0.04235 0.06504 -0.06135 -0.14171 -0.09453 213 3S 0.00281 -0.00928 -0.01584 -0.00800 0.02891 214 3PX 0.00743 0.01507 0.00993 -0.00841 0.07145 215 3PY 0.00334 -0.02654 -0.03343 0.04900 -0.02409 216 3PZ 0.02205 0.04102 -0.02230 -0.08087 -0.03589 217 4XX -0.00004 0.00130 0.00304 0.00032 0.00570 218 4YY -0.00087 -0.00223 0.00002 0.00324 0.00193 219 4ZZ 0.00085 0.00241 -0.00021 -0.00395 -0.00090 220 4XY 0.00089 0.00015 -0.00434 -0.00058 -0.02090 221 4XZ -0.00111 -0.00408 -0.00213 0.00653 -0.01015 222 4YZ 0.00054 0.00167 -0.00002 -0.00308 0.00160 223 20 C 1S 0.00331 0.00325 -0.00093 -0.00000 0.00899 224 2S -0.00601 -0.00682 -0.00021 -0.00065 -0.01391 225 2PX 0.02182 0.02480 -0.01103 0.03869 -0.20591 226 2PY -0.05020 -0.03758 0.09763 0.06810 0.12269 227 2PZ 0.01228 0.08912 0.04638 -0.15136 0.03620 228 3S -0.02175 -0.02402 0.00772 -0.00548 -0.04394 229 3PX 0.01437 0.01709 -0.00532 0.01618 -0.06520 230 3PY -0.02029 -0.02467 0.02940 0.03863 0.04306 231 3PZ 0.00860 0.04185 0.01249 -0.08329 0.00485 232 4XX -0.00100 0.00133 0.00475 0.00191 -0.00586 233 4YY 0.00120 -0.00012 -0.00342 -0.00257 0.00115 234 4ZZ 0.00046 -0.00039 -0.00122 0.00144 0.00206 235 4XY 0.00159 0.00178 -0.00326 -0.00151 -0.01597 236 4XZ -0.00140 -0.00517 -0.00152 0.00796 -0.00692 237 4YZ 0.00026 -0.00095 -0.00173 0.00125 0.00089 238 21 C 1S -0.00432 -0.00335 0.00357 0.00078 -0.01408 239 2S 0.00815 0.00641 -0.00625 -0.00291 0.03574 240 2PX -0.03367 -0.02264 0.03655 -0.04480 0.19950 241 2PY 0.00808 -0.07514 -0.09159 0.09070 -0.08858 242 2PZ 0.06207 0.10898 -0.06017 -0.13903 -0.08627 243 3S 0.02962 0.02765 -0.02052 0.01280 0.00788 244 3PX -0.00678 -0.00114 0.00997 -0.01546 0.08607 245 3PY -0.01012 -0.05183 -0.03249 0.03841 -0.00448 246 3PZ 0.02589 0.05545 -0.02344 -0.08476 -0.02254 247 4XX -0.00079 0.00010 0.00230 0.00068 -0.00183 248 4YY 0.00260 0.00304 -0.00450 -0.00556 -0.00377 249 4ZZ -0.00135 -0.00414 -0.00073 0.00535 0.00036 250 4XY 0.00227 0.00373 -0.00061 0.00146 -0.00796 251 4XZ -0.00076 -0.00274 -0.00010 0.00196 -0.00438 252 4YZ -0.00014 -0.00310 -0.00258 0.00407 -0.00083 253 22 H 1S 0.02223 -0.00682 -0.06385 0.00355 -0.04542 254 2S 0.01543 -0.00261 -0.04088 0.00616 -0.05576 255 23 H 1S 0.00047 0.01189 0.01785 0.02397 -0.11607 256 2S -0.00029 0.00936 0.01551 0.02024 -0.09999 257 24 H 1S -0.00216 0.02694 0.05920 -0.01831 0.18578 258 2S -0.00130 0.02379 0.05038 -0.01477 0.16270 259 25 H 1S -0.00004 0.00347 -0.00603 0.00467 -0.05860 260 2S -0.00130 0.00267 -0.00331 0.00356 -0.04784 261 26 H 1S -0.01905 -0.02752 -0.00043 -0.00154 -0.08213 262 2S -0.00521 -0.01168 -0.00125 0.01509 -0.10985 263 27 H 1S -0.05081 0.01384 0.13540 0.00040 -0.03227 264 2S -0.03618 0.01365 0.09817 0.00662 -0.03690 56 57 58 59 60 O O O O O Eigenvalues -- -0.39054 -0.37105 -0.36575 -0.36011 -0.33357 1 1 C 1S -0.00044 0.00434 0.00113 -0.00164 0.00887 2 2S 0.00043 -0.01307 -0.00433 0.00598 -0.02737 3 2PX -0.05079 0.11300 0.01974 -0.01095 0.03895 4 2PY 0.04653 0.02525 0.05032 -0.02486 0.09726 5 2PZ 0.04341 -0.00405 0.06636 0.05226 -0.18261 6 3S -0.00786 -0.00466 0.00925 -0.00370 -0.02148 7 3PX -0.02600 0.03896 0.01582 -0.00270 -0.00134 8 3PY 0.02412 0.00234 0.01084 -0.01939 0.08451 9 3PZ 0.02141 -0.00673 0.03060 0.03851 -0.13959 10 4XX -0.00672 -0.00757 -0.00138 0.00082 -0.00261 11 4YY 0.00588 0.00660 0.00327 0.00028 -0.00319 12 4ZZ 0.00187 0.00195 0.00001 -0.00094 0.00548 13 4XY 0.00358 -0.00033 0.00809 0.00166 0.00330 14 4XZ 0.00163 0.00087 0.00408 -0.00002 -0.00840 15 4YZ 0.00445 0.00406 0.00322 0.00078 0.00134 16 2 C 1S 0.00923 0.00166 -0.02499 -0.00384 -0.00681 17 2S -0.01778 -0.00793 0.05827 0.00922 0.01846 18 2PX 0.00882 -0.10669 -0.07302 0.00667 -0.05963 19 2PY -0.02913 0.02657 -0.15895 -0.02855 -0.06512 20 2PZ 0.00156 -0.02331 -0.07960 0.00111 0.08761 21 3S -0.04769 0.00784 0.12812 0.01345 0.00279 22 3PX 0.00096 -0.05453 -0.04950 0.00394 -0.01978 23 3PY -0.02060 0.02591 -0.08935 -0.01590 -0.04278 24 3PZ 0.00176 -0.01169 -0.04629 -0.00076 0.05183 25 4XX 0.00518 -0.00862 0.00037 0.00038 -0.00372 26 4YY -0.00343 0.00851 -0.00076 -0.00402 -0.00254 27 4ZZ -0.00165 0.00276 -0.00522 0.00137 0.00239 28 4XY 0.00386 -0.00232 0.00325 -0.00307 0.00833 29 4XZ 0.00289 -0.00089 0.00505 0.00519 -0.01163 30 4YZ 0.00072 0.00029 0.00186 0.00664 0.01039 31 3 H 1S -0.01900 0.01878 -0.04794 0.00583 0.07104 32 2S -0.01012 0.01170 -0.05495 0.01627 0.06955 33 4 Br 1S -0.00044 0.00083 -0.00101 -0.00119 0.00007 34 2S 0.00281 -0.00542 0.00670 0.00783 -0.00063 35 3S -0.00316 0.00641 -0.00806 -0.00926 0.00109 36 4S -0.00622 0.01150 -0.01397 -0.01665 0.00076 37 5S -0.00354 -0.00138 0.01458 0.01603 -0.01904 38 6S 0.02915 -0.03311 0.00581 0.01071 0.04700 39 7PX -0.00115 -0.00195 -0.00888 -0.01107 0.05412 40 7PY 0.00540 -0.00819 0.00376 0.01422 0.03735 41 7PZ -0.00865 0.01648 -0.01235 0.00031 -0.01157 42 8PX 0.00355 0.00602 0.02733 0.03409 -0.16674 43 8PY -0.01661 0.02523 -0.01158 -0.04380 -0.11512 44 8PZ 0.02661 -0.05071 0.03802 -0.00093 0.03568 45 9PX -0.00625 -0.01149 -0.04936 -0.06155 0.30191 46 9PY 0.03077 -0.04693 0.02108 0.07962 0.21128 47 9PZ -0.04826 0.09190 -0.06954 0.00067 -0.06629 48 10PX -0.00554 -0.00436 -0.03759 -0.04963 0.25337 49 10PY 0.01545 -0.02520 0.01985 0.06247 0.15899 50 10PZ -0.03202 0.06680 -0.04927 0.00598 -0.04496 51 11XX -0.00004 -0.00112 0.00292 0.00390 -0.00521 52 11YY 0.00185 -0.00328 0.00152 0.00449 0.00383 53 11ZZ 0.00239 -0.00425 0.00653 0.00418 -0.00037 54 11XY -0.00086 -0.00081 -0.00185 -0.00165 0.00242 55 11XZ -0.00036 0.00094 0.00153 0.00116 -0.00121 56 11YZ -0.00234 0.00276 -0.00090 -0.00007 -0.00352 57 12XX -0.00064 -0.00114 0.00379 0.00171 0.00328 58 12YY -0.00440 0.00334 0.00535 -0.00104 -0.02150 59 12ZZ -0.00618 0.00676 -0.00502 0.00119 -0.00929 60 12XY 0.00226 0.00162 0.00511 0.00509 -0.00792 61 12XZ 0.00094 -0.00204 -0.00357 -0.00328 0.00402 62 12YZ 0.00491 -0.00597 0.00298 0.00050 0.01004 63 5 C 1S -0.00676 -0.00002 0.00900 -0.00020 -0.00522 64 2S 0.01614 0.00179 -0.02401 -0.00144 0.01507 65 2PX -0.07847 0.13952 0.06829 0.03071 0.04081 66 2PY 0.06498 -0.05122 0.13881 0.07930 0.06395 67 2PZ 0.00728 -0.01786 0.07584 -0.23862 -0.03947 68 3S 0.00583 0.00612 0.01496 0.00858 0.01129 69 3PX -0.04120 0.07351 -0.02028 0.01018 0.00883 70 3PY 0.04550 -0.04772 -0.01255 0.03295 0.01398 71 3PZ 0.00411 -0.01420 0.00167 -0.11020 -0.00903 72 4XX 0.00202 -0.00678 0.00582 0.00058 0.00070 73 4YY -0.00489 0.00882 0.01013 -0.00287 -0.00043 74 4ZZ 0.00083 -0.00028 -0.01129 0.00216 0.00140 75 4XY 0.00124 -0.00262 0.00977 -0.00053 0.00181 76 4XZ 0.00098 -0.00063 0.00416 0.00483 0.00122 77 4YZ -0.00153 0.00218 0.00573 0.00815 0.00670 78 6 C 1S 0.00211 -0.00286 -0.00706 -0.00190 -0.00671 79 2S -0.00524 0.01043 0.02043 0.01237 0.01604 80 2PX -0.06714 0.12340 -0.14748 -0.02742 0.01181 81 2PY 0.08485 -0.11026 -0.18373 -0.04566 -0.00650 82 2PZ 0.00408 -0.00484 -0.08824 0.20349 0.02258 83 3S -0.00362 -0.01047 -0.01417 -0.03298 0.01732 84 3PX -0.04188 0.07414 -0.05667 -0.01018 0.02169 85 3PY 0.04048 -0.04843 -0.05313 -0.00597 -0.00302 86 3PZ 0.00840 -0.01241 -0.06312 0.04635 0.00957 87 4XX 0.00116 -0.00433 0.00264 0.00004 0.00052 88 4YY -0.00163 0.00509 0.00338 -0.00644 -0.00199 89 4ZZ 0.00138 -0.00097 -0.01076 0.00058 -0.00028 90 4XY 0.00216 -0.00266 0.00337 -0.00346 0.00044 91 4XZ -0.00342 0.00538 0.00177 0.00993 0.00182 92 4YZ 0.00077 -0.00023 0.00545 0.01681 0.00271 93 7 C 1S -0.00369 0.00093 0.00290 0.00397 0.00245 94 2S 0.00835 -0.00184 -0.00070 -0.01536 -0.00558 95 2PX -0.09657 0.17539 0.09607 0.02300 0.00366 96 2PY 0.01052 -0.05729 0.21788 0.09326 0.01609 97 2PZ 0.01386 -0.02186 0.07505 -0.22609 -0.01996 98 3S 0.01171 0.00265 -0.02626 0.00853 -0.00513 99 3PX -0.04958 0.10054 0.02502 0.00892 -0.00041 100 3PY 0.01603 -0.03903 0.07665 0.04028 0.01423 101 3PZ 0.00572 -0.00632 0.01636 -0.06159 -0.00983 102 4XX -0.00254 0.00202 0.00381 -0.00165 0.00064 103 4YY -0.00026 -0.00011 0.00966 -0.00562 -0.00019 104 4ZZ 0.00244 -0.00140 -0.01670 0.01363 0.00047 105 4XY -0.00160 0.00126 0.00598 -0.00256 0.00053 106 4XZ -0.00390 0.00742 -0.00119 0.00735 0.00020 107 4YZ 0.00068 -0.00287 0.00254 0.01231 0.00148 108 8 C 1S -0.00067 -0.00041 0.00218 -0.00014 -0.00057 109 2S 0.00362 -0.00007 -0.01363 -0.00063 0.00046 110 2PX -0.03758 0.14293 -0.15229 -0.05247 -0.02663 111 2PY 0.09470 -0.13223 -0.17940 -0.06531 -0.00810 112 2PZ 0.01000 0.00556 -0.09308 0.25214 0.01553 113 3S -0.00003 0.00312 0.02107 0.00460 0.00862 114 3PX -0.03039 0.08836 -0.04871 -0.02168 -0.01232 115 3PY 0.03939 -0.06837 -0.03877 -0.01856 0.00183 116 3PZ 0.00426 0.00029 -0.02600 0.09612 0.00274 117 4XX -0.00394 0.00675 0.00427 -0.00115 -0.00004 118 4YY 0.00021 -0.00429 0.01687 -0.00194 0.00116 119 4ZZ 0.00239 -0.00152 -0.01369 0.00367 -0.00051 120 4XY -0.00402 0.00523 0.01148 -0.00162 0.00059 121 4XZ -0.00172 0.00297 0.00390 0.00590 0.00063 122 4YZ -0.00158 0.00070 0.00821 0.01000 0.00277 123 9 C 1S -0.00290 0.00022 0.00503 -0.00365 -0.00498 124 2S 0.00627 0.00055 -0.00675 0.01628 0.01222 125 2PX -0.08869 0.18066 0.09055 0.01178 0.00611 126 2PY 0.01104 -0.06417 0.20690 0.07350 0.06164 127 2PZ -0.00902 -0.01619 0.11237 -0.23102 -0.01400 128 3S 0.00866 0.00156 -0.03055 -0.02060 0.01881 129 3PX -0.04535 0.10174 0.02192 -0.00971 -0.00058 130 3PY 0.01494 -0.04428 0.07147 0.01165 0.02660 131 3PZ 0.00046 -0.00566 0.04542 -0.06547 -0.00109 132 4XX -0.00287 0.00419 0.00267 -0.00102 -0.00055 133 4YY 0.00069 -0.00370 0.00750 -0.00487 -0.00031 134 4ZZ 0.00231 -0.00123 -0.01128 -0.00101 -0.00143 135 4XY -0.00249 0.00316 0.00399 -0.00402 -0.00058 136 4XZ 0.00133 -0.00378 0.00474 0.01074 0.00250 137 4YZ -0.00316 0.00579 0.00651 0.01672 0.00318 138 10 C 1S 0.00416 -0.00194 -0.00848 0.00120 0.00741 139 2S -0.00972 0.00495 0.02530 -0.00969 -0.01437 140 2PX -0.05870 0.13011 -0.13804 -0.05798 -0.05477 141 2PY 0.07415 -0.12152 -0.17755 -0.07414 -0.05195 142 2PZ 0.01970 0.00213 -0.07485 0.20175 0.03033 143 3S -0.00576 0.00025 -0.00666 0.03318 -0.03565 144 3PX -0.03636 0.08286 -0.05692 -0.02578 -0.02958 145 3PY 0.03785 -0.05909 -0.06757 -0.02680 -0.01182 146 3PZ 0.00035 0.00464 0.00963 0.04809 0.01710 147 4XX 0.00053 -0.00274 0.00315 -0.00148 0.00151 148 4YY -0.00009 0.00260 0.00578 -0.00559 0.00164 149 4ZZ 0.00109 -0.00033 -0.01446 0.01271 -0.00139 150 4XY 0.00047 -0.00125 0.00439 -0.00249 0.00149 151 4XZ 0.00347 -0.00522 0.00060 0.00891 0.00177 152 4YZ -0.00240 0.00505 -0.00012 0.01257 0.00260 153 11 H 1S 0.01220 -0.00006 -0.09265 0.12965 0.00052 154 2S 0.01375 -0.00262 -0.10783 0.13690 0.00120 155 12 H 1S 0.01558 -0.02531 -0.06152 -0.15774 -0.03284 156 2S 0.01307 -0.02404 -0.06079 -0.16334 -0.03700 157 13 H 1S -0.04153 0.02612 0.18173 0.01543 0.01445 158 2S -0.03912 0.02549 0.18377 0.01614 0.01514 159 14 H 1S 0.00634 -0.00009 -0.10456 0.14063 0.00860 160 2S 0.00483 0.00170 -0.10419 0.14496 0.00917 161 15 H 1S 0.01691 -0.01654 -0.06145 -0.14217 -0.01483 162 2S 0.01758 -0.02299 -0.07093 -0.15141 -0.02021 163 16 C 1S 0.00045 -0.00283 0.00578 0.00111 -0.00248 164 2S -0.00078 0.00604 -0.01062 -0.00140 0.00336 165 2PX -0.09684 -0.12606 0.02790 0.01139 -0.02297 166 2PY -0.17864 -0.07733 -0.04274 -0.01223 0.10259 167 2PZ -0.09905 -0.04245 -0.01262 0.02082 -0.17932 168 3S 0.00045 -0.00545 -0.03991 -0.00869 0.02265 169 3PX -0.06434 -0.04090 0.00790 0.00027 -0.00527 170 3PY -0.06032 -0.03067 -0.01899 -0.00153 0.06501 171 3PZ -0.03404 -0.01734 -0.00593 0.01164 -0.10070 172 4XX -0.00751 -0.00732 -0.00212 0.00055 -0.00112 173 4YY 0.00513 0.00528 0.00160 -0.00162 0.00575 174 4ZZ 0.00216 0.00127 0.00190 0.00150 -0.00552 175 4XY 0.00361 -0.00575 0.00237 0.00149 -0.00404 176 4XZ 0.00151 -0.00238 -0.00017 -0.00169 0.00495 177 4YZ 0.00353 0.00325 0.00189 0.00088 -0.00312 178 17 C 1S -0.00069 0.00323 -0.00452 0.00002 -0.00019 179 2S 0.00491 -0.00181 0.00934 0.00096 0.00039 180 2PX 0.01894 0.14337 -0.02599 -0.00594 0.00830 181 2PY 0.17937 0.08100 0.03532 0.00369 0.00722 182 2PZ 0.08566 0.04110 0.00983 -0.01141 -0.00781 183 3S -0.00045 -0.03107 0.02380 -0.00330 0.00279 184 3PX -0.00469 0.06801 -0.00933 -0.00012 -0.00426 185 3PY 0.05530 0.03847 0.01248 0.00717 0.00675 186 3PZ 0.02312 0.02189 0.00270 -0.00094 -0.00834 187 4XX -0.01434 -0.01212 -0.00014 0.00053 -0.00044 188 4YY 0.00938 0.00580 -0.00040 -0.00116 0.00780 189 4ZZ 0.00297 0.00227 0.00033 0.00121 -0.00774 190 4XY -0.00151 -0.00768 0.00265 0.00131 -0.00341 191 4XZ -0.00084 -0.00329 0.00019 -0.00112 0.00407 192 4YZ 0.00578 0.00315 0.00071 0.00082 -0.00550 193 18 C 1S 0.00077 -0.00190 0.00256 -0.00004 -0.00027 194 2S -0.00962 0.00249 -0.00644 -0.00034 0.00025 195 2PX -0.06451 -0.11797 0.02203 0.00385 -0.00330 196 2PY -0.18603 -0.05488 -0.01325 0.01889 -0.07310 197 2PZ -0.11051 -0.01912 -0.03392 -0.03388 0.13803 198 3S 0.02237 0.00704 -0.00700 0.00292 0.00540 199 3PX -0.02161 -0.04233 0.01030 -0.00271 -0.00086 200 3PY -0.05170 -0.02549 -0.00124 0.01268 -0.04631 201 3PZ -0.03384 -0.00914 -0.01766 -0.02157 0.09370 202 4XX -0.01239 -0.00757 -0.00066 0.00021 -0.00000 203 4YY 0.01542 0.00730 0.00192 0.00076 -0.00272 204 4ZZ 0.00319 0.00218 -0.00026 -0.00110 0.00267 205 4XY 0.00432 -0.00298 0.00126 0.00067 -0.00387 206 4XZ 0.00254 -0.00108 -0.00010 -0.00111 0.00665 207 4YZ 0.00959 0.00495 0.00031 -0.00086 0.00245 208 19 C 1S -0.00128 0.00334 0.00045 0.00006 0.00018 209 2S 0.00573 -0.00946 -0.00044 -0.00003 -0.00051 210 2PX 0.08035 0.12173 -0.01091 -0.00527 0.01009 211 2PY 0.20428 0.05120 0.02189 0.02270 -0.10906 212 2PZ 0.09654 0.03523 -0.02175 -0.04569 0.20217 213 3S -0.00807 0.00028 -0.00397 0.00051 -0.00240 214 3PX 0.03271 0.04282 -0.00254 -0.00296 0.00582 215 3PY 0.06989 0.02334 0.01016 0.01239 -0.06887 216 3PZ 0.02982 0.01817 -0.01453 -0.02793 0.12558 217 4XX -0.01198 -0.00261 -0.00112 0.00012 -0.00022 218 4YY 0.00727 0.00363 0.00097 0.00070 -0.00266 219 4ZZ 0.00199 0.00133 -0.00039 -0.00093 0.00306 220 4XY 0.00431 -0.00493 0.00102 -0.00034 0.00192 221 4XZ 0.00309 -0.00288 0.00147 0.00129 -0.00460 222 4YZ 0.00399 0.00268 -0.00016 -0.00070 0.00210 223 20 C 1S -0.00262 -0.00193 -0.00116 0.00026 -0.00094 224 2S 0.01034 0.00852 0.00171 -0.00075 0.00203 225 2PX -0.08731 -0.10674 0.00607 0.00543 -0.00693 226 2PY -0.18568 -0.04293 0.00279 0.01967 -0.06964 227 2PZ -0.11076 -0.01216 -0.02647 -0.03548 0.13398 228 3S -0.00303 -0.00790 0.01160 -0.00168 0.00587 229 3PX -0.02550 -0.03233 -0.00071 0.00293 -0.00394 230 3PY -0.06335 -0.01094 0.00679 0.01119 -0.04785 231 3PZ -0.04076 0.00005 -0.01379 -0.02326 0.09054 232 4XX -0.01554 -0.00985 0.00025 0.00051 -0.00076 233 4YY 0.00800 0.00445 -0.00076 -0.00132 0.00646 234 4ZZ 0.00293 0.00153 0.00038 0.00099 -0.00610 235 4XY -0.00217 -0.00603 0.00031 -0.00020 0.00048 236 4XZ -0.00031 -0.00332 0.00102 0.00118 -0.00230 237 4YZ 0.00511 0.00246 0.00048 0.00071 -0.00448 238 21 C 1S 0.00156 0.00611 0.00230 -0.00060 0.00194 239 2S -0.01126 -0.01608 -0.00623 0.00106 -0.00420 240 2PX 0.07293 0.13971 -0.00649 -0.00945 0.01612 241 2PY 0.15552 0.03971 0.00596 0.00460 0.00988 242 2PZ 0.07528 0.02336 -0.00848 -0.01274 -0.01812 243 3S 0.02774 -0.01755 -0.00407 0.00649 -0.01638 244 3PX 0.01205 0.04786 -0.01499 -0.00354 0.00798 245 3PY 0.04071 0.01456 0.00209 -0.00045 0.01221 246 3PZ 0.01752 0.00955 -0.00485 -0.00820 -0.01623 247 4XX -0.01372 -0.00588 -0.00074 0.00005 0.00043 248 4YY 0.01468 0.00670 0.00012 -0.00110 0.00233 249 4ZZ 0.00410 0.00179 0.00075 0.00084 -0.00254 250 4XY 0.00214 -0.00271 0.00118 0.00129 -0.00637 251 4XZ 0.00126 -0.00105 -0.00055 -0.00160 0.00980 252 4YZ 0.01016 0.00404 0.00094 0.00056 -0.00154 253 22 H 1S 0.13685 0.04826 0.00224 -0.00161 -0.00038 254 2S 0.13340 0.04991 0.00832 -0.00081 0.00096 255 23 H 1S -0.10865 -0.08526 0.00355 0.00426 -0.00561 256 2S -0.09966 -0.08329 0.00325 0.00416 -0.00570 257 24 H 1S -0.05780 0.03697 -0.01144 -0.00186 0.00327 258 2S -0.05332 0.03686 -0.01105 -0.00193 0.00309 259 25 H 1S 0.15926 0.05988 0.01467 -0.00124 0.00064 260 2S 0.14777 0.05364 0.01530 -0.00138 0.00162 261 26 H 1S -0.07994 -0.10755 0.00917 0.00446 -0.00556 262 2S -0.09774 -0.05639 -0.00132 0.00801 -0.01288 263 27 H 1S 0.04553 0.04325 0.06024 0.00510 -0.00631 264 2S 0.05117 0.04947 0.05840 0.00631 0.00683 61 62 63 64 65 O O O O O Eigenvalues -- -0.31180 -0.30562 -0.30043 -0.26916 -0.26706 1 1 C 1S 0.00501 0.01743 0.00029 -0.00917 -0.01310 2 2S -0.01107 -0.05063 -0.00206 0.02308 0.03342 3 2PX 0.00767 0.06945 0.00349 -0.04442 -0.08466 4 2PY -0.02983 -0.06302 0.00066 -0.01198 -0.01179 5 2PZ 0.00970 0.06496 0.00016 0.00365 -0.01778 6 3S -0.01969 -0.05735 0.00557 0.04574 0.06234 7 3PX 0.00987 0.02659 -0.00623 -0.04595 -0.08032 8 3PY -0.04622 -0.01688 0.00514 0.01195 0.02098 9 3PZ -0.01336 0.04464 -0.00570 0.00638 0.00004 10 4XX -0.00019 -0.00312 -0.00023 0.00107 0.00240 11 4YY 0.00532 0.00589 0.00165 -0.00127 -0.00244 12 4ZZ -0.00429 -0.00292 -0.00151 -0.00087 -0.00169 13 4XY -0.00173 -0.00872 0.00054 -0.00020 -0.00057 14 4XZ 0.00412 0.00651 -0.00127 0.00130 0.00093 15 4YZ -0.00181 -0.00777 -0.00126 -0.00025 -0.00188 16 2 C 1S 0.00342 -0.00106 0.00057 -0.00075 -0.00255 17 2S -0.00107 -0.00076 0.00034 0.00505 0.01654 18 2PX -0.00093 -0.06854 -0.00304 0.02131 0.03508 19 2PY -0.04509 0.01972 0.00297 -0.00609 -0.02242 20 2PZ -0.08315 0.01765 0.00125 -0.02287 -0.02814 21 3S -0.04854 0.01355 -0.00950 -0.00880 -0.02858 22 3PX 0.02749 -0.01009 -0.00932 -0.02784 -0.03158 23 3PY 0.04199 -0.00256 -0.00388 -0.01122 -0.01911 24 3PZ -0.01226 -0.00949 0.01647 -0.03886 -0.01180 25 4XX -0.00121 -0.00754 -0.00031 0.00769 0.01416 26 4YY 0.01564 0.00134 0.00028 -0.00550 -0.00935 27 4ZZ -0.01375 0.00732 0.00060 -0.00300 -0.00660 28 4XY 0.00077 0.00516 0.00001 0.00316 0.00719 29 4XZ 0.00100 -0.00406 0.00013 0.00082 0.00303 30 4YZ -0.00019 -0.00203 -0.00039 0.00016 -0.00046 31 3 H 1S -0.07002 0.03646 0.00157 -0.02281 -0.04137 32 2S -0.07652 0.03845 -0.00663 -0.00683 -0.05455 33 4 Br 1S -0.00008 -0.00024 0.00002 0.00018 0.00106 34 2S 0.00046 0.00186 -0.00013 -0.00106 -0.00730 35 3S -0.00042 -0.00272 0.00016 0.00098 0.00926 36 4S -0.00120 -0.00319 0.00029 0.00268 0.01454 37 5S 0.00197 0.00640 -0.00295 0.00865 -0.03246 38 6S -0.00417 -0.00702 0.00881 -0.03201 0.03285 39 7PX 0.01399 0.08739 0.00289 -0.00430 0.00717 40 7PY 0.05542 -0.01567 -0.00232 0.00786 0.02475 41 7PZ 0.08638 -0.01938 -0.00196 -0.00188 0.00349 42 8PX -0.04312 -0.26944 -0.00891 0.01328 -0.02218 43 8PY -0.17087 0.04833 0.00716 -0.02425 -0.07644 44 8PZ -0.26630 0.05977 0.00604 0.00579 -0.01077 45 9PX 0.07885 0.49142 0.01650 -0.02437 0.04282 46 9PY 0.31108 -0.08854 -0.01339 0.04395 0.14309 47 9PZ 0.48483 -0.10885 -0.01092 -0.01059 0.01930 48 10PX 0.06362 0.41908 0.01375 -0.02150 0.02687 49 10PY 0.26648 -0.07407 -0.01465 0.04974 0.11333 50 10PZ 0.40880 -0.09166 -0.00705 -0.01295 0.01960 51 11XX 0.00060 0.00206 -0.00008 -0.00067 -0.00549 52 11YY 0.00184 0.00068 -0.00014 -0.00096 -0.00542 53 11ZZ -0.00189 0.00129 -0.00003 0.00042 -0.00187 54 11XY -0.00019 0.00095 -0.00015 0.00060 -0.00104 55 11XZ -0.00142 -0.00062 -0.00012 -0.00000 -0.00113 56 11YZ 0.00114 0.00047 0.00010 0.00024 -0.00027 57 12XX -0.00064 0.00330 -0.00149 0.00612 -0.00625 58 12YY -0.00871 0.00589 0.00069 0.00325 -0.00881 59 12ZZ 0.00991 0.00232 -0.00111 0.00291 -0.01654 60 12XY 0.00145 -0.00740 0.00017 -0.00170 0.00325 61 12XZ 0.00546 0.00522 0.00067 -0.00015 0.00413 62 12YZ -0.00482 -0.00172 -0.00132 0.00166 0.00139 63 5 C 1S -0.01103 -0.00101 0.00006 -0.00042 -0.00376 64 2S 0.01762 0.00656 -0.00231 0.00461 0.00864 65 2PX 0.07320 -0.00017 -0.00043 -0.12025 -0.24947 66 2PY 0.03583 0.01627 0.00063 0.07866 0.18127 67 2PZ 0.03569 -0.01212 -0.00299 0.01424 0.01544 68 3S 0.12640 -0.01805 0.01081 -0.01809 0.02383 69 3PX 0.06174 -0.01133 0.00534 -0.09285 -0.17517 70 3PY 0.02846 -0.00959 -0.00201 0.03583 0.10589 71 3PZ 0.03620 0.02185 -0.01544 0.01448 0.00250 72 4XX 0.00161 -0.00092 -0.00050 0.00443 0.00230 73 4YY -0.00089 0.00126 0.00005 -0.00471 -0.00156 74 4ZZ -0.00182 0.00078 -0.00009 0.00062 -0.00138 75 4XY 0.00303 0.00023 -0.00041 0.00363 0.00173 76 4XZ -0.00106 -0.00060 0.00121 -0.01550 0.00727 77 4YZ -0.00128 0.00173 -0.00060 0.00780 -0.00485 78 6 C 1S -0.00681 -0.00111 -0.00073 0.00096 -0.00084 79 2S 0.01265 0.00400 0.00501 -0.00328 0.00375 80 2PX 0.03079 0.00605 -0.01452 0.17778 -0.22690 81 2PY 0.03237 -0.00748 0.01402 -0.10467 0.14075 82 2PZ -0.06938 0.01142 -0.00025 -0.01950 0.00295 83 3S 0.04696 0.00956 -0.01433 0.00199 -0.00361 84 3PX 0.00932 0.01685 -0.02092 0.12986 -0.16505 85 3PY -0.00309 0.00312 0.01213 -0.06883 0.09942 86 3PZ -0.05330 0.01968 -0.01102 -0.00765 -0.01524 87 4XX 0.00186 -0.00007 0.00024 -0.01002 -0.00430 88 4YY -0.00168 -0.00011 0.00023 0.00992 0.00378 89 4ZZ 0.00108 0.00045 0.00043 0.00066 0.00101 90 4XY 0.00242 0.00049 0.00019 -0.00598 -0.00140 91 4XZ -0.00045 0.00052 -0.00008 -0.00647 -0.00930 92 4YZ -0.00331 0.00120 -0.00034 0.00462 0.00621 93 7 C 1S 0.00233 0.00001 0.00026 -0.00015 -0.00009 94 2S -0.00296 -0.00039 -0.00068 -0.00018 0.00031 95 2PX -0.04200 0.00795 -0.01368 0.28573 0.02554 96 2PY 0.00367 0.00097 0.00618 -0.17168 -0.01381 97 2PZ 0.02681 -0.00474 0.00031 -0.01336 0.00121 98 3S -0.03178 0.01010 0.00093 0.00491 -0.00075 99 3PX -0.03038 0.00677 -0.00672 0.20455 0.01882 100 3PY 0.00197 0.00717 0.00229 -0.11782 -0.01450 101 3PZ 0.00949 -0.00467 0.00511 -0.01215 0.00483 102 4XX 0.00179 0.00008 -0.00045 0.00339 -0.01263 103 4YY -0.00031 -0.00021 0.00049 -0.00289 0.01312 104 4ZZ -0.00175 0.00014 0.00014 -0.00079 -0.00074 105 4XY 0.00128 0.00014 -0.00023 0.00164 -0.00821 106 4XZ -0.00377 0.00030 -0.00001 0.00385 0.00483 107 4YZ -0.00243 0.00047 -0.00003 -0.00310 -0.00263 108 8 C 1S -0.00466 0.00062 -0.00015 -0.00031 -0.00107 109 2S 0.01012 -0.00125 0.00031 0.00069 0.00222 110 2PX -0.04600 -0.00296 0.00204 0.11862 0.25352 111 2PY 0.05414 -0.00521 -0.00021 -0.06961 -0.15032 112 2PZ -0.02125 0.00274 -0.00043 -0.00731 -0.01298 113 3S 0.01483 -0.00175 -0.00168 0.00002 0.00089 114 3PX -0.03124 -0.00228 0.00064 0.08227 0.17836 115 3PY 0.03248 -0.00499 -0.00116 -0.04980 -0.10692 116 3PZ -0.01079 -0.00234 0.00047 -0.00825 -0.00751 117 4XX -0.00167 0.00023 -0.00017 0.00406 0.00266 118 4YY 0.00078 0.00021 0.00005 -0.00518 -0.00230 119 4ZZ -0.00026 -0.00014 -0.00004 0.00103 -0.00061 120 4XY -0.00100 0.00027 -0.00022 0.00348 0.00121 121 4XZ -0.00110 -0.00009 0.00088 -0.01350 0.00746 122 4YZ -0.00006 0.00060 -0.00044 0.00759 -0.00454 123 9 C 1S -0.00193 -0.00141 -0.00010 0.00021 -0.00071 124 2S 0.00351 0.00198 0.00014 -0.00050 0.00183 125 2PX -0.03939 0.00038 0.01425 -0.16219 0.23560 126 2PY 0.03901 0.01255 -0.00820 0.09634 -0.13595 127 2PZ 0.01203 -0.00069 -0.00065 0.00680 -0.00777 128 3S 0.00698 0.01999 -0.00028 0.00388 -0.00013 129 3PX -0.02643 0.00214 0.00898 -0.11182 0.16755 130 3PY 0.02624 0.01298 -0.00619 0.06738 -0.09947 131 3PZ -0.00069 -0.00161 0.00071 -0.00023 -0.00671 132 4XX 0.00003 -0.00039 0.00038 -0.01023 -0.00341 133 4YY -0.00029 0.00033 -0.00054 0.00999 0.00249 134 4ZZ 0.00009 -0.00039 -0.00002 0.00044 0.00063 135 4XY -0.00005 0.00007 0.00018 -0.00590 -0.00163 136 4XZ 0.00178 0.00034 0.00010 -0.00694 -0.00853 137 4YZ -0.00160 0.00072 0.00000 0.00426 0.00566 138 10 C 1S -0.00016 0.00257 0.00043 -0.00176 0.00000 139 2S 0.00212 -0.00472 -0.00314 0.00605 0.00041 140 2PX -0.01105 -0.01661 0.01434 -0.28553 -0.01838 141 2PY -0.00161 -0.00975 -0.01068 0.17710 0.00687 142 2PZ -0.00290 0.00380 0.00077 0.00394 0.00554 143 3S -0.01785 -0.03503 0.00792 -0.00440 -0.00176 144 3PX -0.01328 -0.00276 0.01424 -0.20862 -0.01714 145 3PY -0.00923 0.00204 -0.00614 0.12418 0.00192 146 3PZ 0.01103 0.00963 -0.00337 0.01559 0.00830 147 4XX 0.00298 0.00008 -0.00055 0.00183 -0.01319 148 4YY -0.00100 0.00010 0.00019 -0.00125 0.01415 149 4ZZ -0.00288 -0.00059 -0.00042 -0.00044 -0.00101 150 4XY 0.00226 -0.00009 -0.00028 0.00119 -0.00821 151 4XZ -0.00031 0.00043 -0.00008 0.00397 0.00507 152 4YZ -0.00030 0.00047 0.00010 -0.00277 -0.00243 153 11 H 1S -0.01061 -0.00264 -0.00050 -0.00196 -0.00020 154 2S -0.01928 0.00144 0.00101 -0.00964 -0.00591 155 12 H 1S 0.00176 -0.00525 -0.00026 0.00158 -0.00212 156 2S 0.00374 -0.00507 -0.00093 0.00294 -0.00279 157 13 H 1S -0.00677 0.00357 -0.00053 -0.00078 -0.00023 158 2S -0.00870 0.00295 -0.00085 -0.00172 -0.00066 159 14 H 1S -0.02044 0.00245 0.00039 -0.00257 -0.00280 160 2S -0.02025 0.00183 0.00206 -0.00384 -0.00190 161 15 H 1S 0.04136 -0.00482 0.00465 0.00180 0.00389 162 2S 0.00165 -0.00261 -0.00465 0.00121 -0.01297 163 16 C 1S -0.00073 -0.00419 -0.00008 0.00040 0.00204 164 2S 0.00402 0.00445 0.00030 -0.00084 -0.00473 165 2PX -0.00238 -0.02178 -0.00127 0.00798 0.02113 166 2PY -0.02850 -0.09009 -0.00725 -0.01794 -0.00046 167 2PZ 0.06694 0.19108 0.01241 0.01440 0.01093 168 3S -0.01618 0.04408 -0.00155 0.01714 0.03004 169 3PX 0.02302 0.00060 -0.00162 -0.01469 -0.01706 170 3PY -0.03751 -0.06049 -0.00125 -0.00941 0.00598 171 3PZ 0.04426 0.12534 0.01473 0.01759 0.01344 172 4XX 0.00043 -0.00176 -0.00057 0.00120 0.00328 173 4YY -0.00047 -0.00235 0.01115 0.00012 -0.00158 174 4ZZ 0.00049 0.00243 -0.01067 -0.00068 -0.00046 175 4XY 0.00047 -0.00021 0.00554 0.00007 0.00170 176 4XZ -0.00100 -0.00127 -0.01100 -0.00068 0.00167 177 4YZ 0.00024 0.00154 -0.00848 -0.00066 -0.00101 178 17 C 1S 0.00218 0.00004 -0.00030 0.00225 -0.00828 179 2S -0.00400 -0.00034 0.00063 -0.00252 0.01888 180 2PX 0.01146 0.00643 0.00726 0.00673 -0.06680 181 2PY -0.01537 -0.02522 -0.14732 -0.00923 -0.02077 182 2PZ 0.01893 0.04356 0.27409 0.02421 -0.00892 183 3S -0.01472 -0.00392 0.00556 -0.01764 0.05316 184 3PX -0.01532 -0.00543 0.01130 0.03290 -0.00013 185 3PY -0.00813 -0.01864 -0.09777 -0.00941 -0.04138 186 3PZ 0.01244 0.02558 0.18872 -0.00463 -0.01587 187 4XX -0.00011 -0.00086 0.00042 0.00010 0.00289 188 4YY -0.00243 -0.00700 0.00423 0.00007 -0.00056 189 4ZZ 0.00255 0.00751 -0.00440 0.00057 0.00026 190 4XY -0.00032 0.00066 -0.00427 -0.00054 0.00345 191 4XZ -0.00136 -0.00306 0.00762 0.00144 0.00088 192 4YZ 0.00169 0.00560 -0.00290 0.00022 0.00025 193 18 C 1S -0.00130 -0.00052 0.00022 0.00026 0.00418 194 2S 0.00217 0.00131 -0.00006 0.00073 -0.00671 195 2PX -0.00764 -0.00877 0.00630 0.00123 0.02643 196 2PY 0.02099 0.05821 -0.13548 -0.00835 0.00339 197 2PZ -0.02969 -0.10274 0.25191 0.01435 -0.01648 198 3S 0.01881 0.00578 -0.00481 -0.02340 -0.05531 199 3PX -0.00547 -0.00401 0.00382 0.00646 0.02087 200 3PY 0.02053 0.04116 -0.09461 -0.01601 -0.01080 201 3PZ -0.01671 -0.06908 0.16745 0.01166 -0.02087 202 4XX -0.00033 -0.00034 -0.00039 -0.00048 0.00240 203 4YY 0.00038 0.00136 -0.00555 -0.00034 -0.00163 204 4ZZ -0.00039 -0.00097 0.00599 0.00076 -0.00036 205 4XY 0.00114 0.00352 0.00454 0.00078 0.00151 206 4XZ -0.00280 -0.00695 -0.00801 -0.00098 0.00019 207 4YZ -0.00021 -0.00108 0.00406 0.00041 -0.00165 208 19 C 1S 0.00044 -0.00036 -0.00007 0.00014 -0.00317 209 2S -0.00078 0.00097 0.00001 -0.00080 0.00671 210 2PX 0.00225 -0.00054 -0.00007 0.00034 -0.02218 211 2PY 0.03299 0.09235 0.00562 0.00582 0.00236 212 2PZ -0.06198 -0.16769 -0.01060 -0.00910 -0.01490 213 3S -0.00692 -0.00259 0.00323 0.00532 0.02198 214 3PX 0.00301 -0.00009 -0.00115 -0.00206 -0.01607 215 3PY 0.01988 0.05922 0.00488 0.00840 0.00681 216 3PZ -0.04202 -0.11208 -0.00670 -0.00571 -0.00767 217 4XX 0.00025 0.00012 -0.00038 0.00012 -0.00049 218 4YY 0.00086 0.00153 0.01090 0.00079 -0.00060 219 4ZZ -0.00092 -0.00150 -0.01050 -0.00092 0.00004 220 4XY -0.00078 -0.00219 0.00538 0.00049 0.00103 221 4XZ 0.00073 0.00289 -0.01069 -0.00056 0.00118 222 4YZ -0.00070 -0.00093 -0.00828 -0.00065 0.00010 223 20 C 1S 0.00020 -0.00123 -0.00005 0.00108 0.00131 224 2S -0.00022 0.00286 0.00013 -0.00238 -0.00321 225 2PX -0.00134 -0.01220 -0.00665 0.00445 0.01213 226 2PY 0.02278 0.04873 0.14228 0.00960 -0.00536 227 2PZ -0.03942 -0.08146 -0.25926 -0.02433 0.00122 228 3S 0.00300 0.00789 -0.00108 -0.00827 -0.00944 229 3PX -0.00214 -0.00864 -0.00370 0.00388 0.00759 230 3PY 0.01290 0.03107 0.09614 0.00999 -0.00042 231 3PZ -0.02710 -0.05827 -0.17319 -0.01552 0.00285 232 4XX 0.00005 -0.00077 0.00026 0.00030 0.00125 233 4YY -0.00209 -0.00595 0.00456 -0.00012 -0.00111 234 4ZZ 0.00212 0.00638 -0.00485 0.00009 0.00059 235 4XY -0.00015 0.00001 -0.00466 -0.00016 0.00100 236 4XZ 0.00016 -0.00056 0.00814 0.00037 0.00003 237 4YZ 0.00151 0.00486 -0.00321 0.00004 0.00019 238 21 C 1S -0.00052 0.00221 0.00044 -0.00136 -0.00475 239 2S 0.00129 -0.00379 -0.00112 0.00244 0.01042 240 2PX -0.00062 0.01942 -0.00360 -0.00650 -0.02785 241 2PY -0.00825 -0.03610 0.14407 0.00730 -0.00993 242 2PZ 0.01259 0.06957 -0.26243 -0.00775 0.01406 243 3S -0.00338 -0.02378 -0.00189 0.01385 0.02858 244 3PX 0.00320 0.01697 -0.00361 -0.00727 -0.01735 245 3PY 0.00295 -0.01820 0.09831 0.00112 -0.00992 246 3PZ 0.00923 0.05023 -0.18197 -0.00744 0.00791 247 4XX 0.00008 -0.00004 -0.00036 -0.00058 -0.00035 248 4YY -0.00072 -0.00054 -0.00508 -0.00005 -0.00029 249 4ZZ 0.00051 0.00104 0.00548 0.00034 -0.00047 250 4XY 0.00157 0.00388 0.00430 0.00157 0.00113 251 4XZ -0.00333 -0.00939 -0.00751 -0.00082 0.00041 252 4YZ 0.00020 0.00004 0.00370 0.00045 -0.00037 253 22 H 1S -0.00072 -0.00066 0.00043 0.00299 -0.00149 254 2S -0.00730 -0.00212 0.00175 0.00463 -0.00318 255 23 H 1S -0.00020 -0.00565 -0.00049 0.00168 0.00817 256 2S 0.00021 -0.00590 -0.00079 0.00194 0.00972 257 24 H 1S 0.00212 0.00220 0.00036 -0.00037 -0.00888 258 2S 0.00170 0.00167 0.00071 0.00069 -0.01029 259 25 H 1S -0.00097 -0.00062 0.00009 0.00093 -0.00804 260 2S 0.00058 -0.00038 -0.00146 0.00186 -0.01178 261 26 H 1S -0.00465 -0.00463 0.00013 0.00094 0.02854 262 2S -0.01733 -0.01090 0.00402 0.03213 0.00742 263 27 H 1S -0.00544 -0.01913 -0.00008 -0.00698 -0.02145 264 2S 0.03003 -0.01557 -0.00191 -0.01621 -0.03297 66 67 68 69 70 V V V V V Eigenvalues -- -0.16594 -0.06298 -0.04224 -0.02343 -0.01650 1 1 C 1S 0.00599 -0.01063 0.00255 -0.01716 -0.01286 2 2S -0.01657 0.04116 -0.00458 0.04005 0.02200 3 2PX 0.01383 -0.02230 0.00063 -0.06392 -0.04071 4 2PY -0.22693 0.00371 -0.01725 -0.07184 -0.06992 5 2PZ 0.35929 0.01603 0.01608 0.10836 0.09270 6 3S -0.04760 0.05229 -0.03873 0.12550 0.15611 7 3PX 0.01713 -0.00869 0.02138 -0.09452 -0.10127 8 3PY -0.18549 0.01599 -0.03682 -0.02931 -0.05251 9 3PZ 0.31001 0.04080 0.03901 0.17179 0.09701 10 4XX -0.00273 0.00719 -0.00128 -0.00324 -0.00356 11 4YY 0.00048 0.00004 -0.00471 -0.00761 -0.00445 12 4ZZ 0.00115 -0.00532 0.00594 0.00653 0.00464 13 4XY 0.00079 -0.01580 0.00083 0.00249 0.00439 14 4XZ -0.00012 0.01370 0.00118 -0.00961 -0.00582 15 4YZ -0.00178 0.00074 0.00350 0.00085 0.00186 16 2 C 1S 0.01435 -0.05436 0.00692 0.00857 0.01668 17 2S -0.03620 0.11243 -0.02074 -0.01588 -0.03317 18 2PX 0.00978 -0.07762 0.01143 -0.01523 0.00336 19 2PY -0.04673 0.27793 -0.04247 -0.02329 -0.04850 20 2PZ 0.00266 -0.22436 0.02678 0.04505 0.02720 21 3S -0.04614 0.39772 -0.03200 -0.03635 -0.14842 22 3PX 0.03730 -0.11454 0.04495 -0.08193 -0.08966 23 3PY -0.04500 0.34028 -0.04019 -0.06958 -0.09574 24 3PZ 0.02555 -0.27817 -0.04549 0.12060 -0.02301 25 4XX -0.00226 0.00862 -0.00091 0.01518 0.00917 26 4YY 0.00697 -0.01645 0.00052 -0.00842 -0.00426 27 4ZZ 0.00140 -0.00894 0.00147 -0.00394 -0.00011 28 4XY -0.00836 0.00762 -0.00112 0.00293 0.00032 29 4XZ 0.01759 -0.00187 -0.00001 0.01452 0.00602 30 4YZ -0.01001 0.00855 -0.00033 -0.00755 -0.00355 31 3 H 1S -0.05619 -0.01897 0.00549 -0.05511 -0.02644 32 2S -0.07191 -0.09429 0.07614 -0.20991 0.02819 33 4 Br 1S -0.00481 0.00904 -0.00131 -0.00168 -0.00289 34 2S 0.03243 -0.06052 0.00886 0.01111 0.02020 35 3S -0.03978 0.07369 -0.01088 -0.01322 -0.02621 36 4S -0.06745 0.12788 -0.01868 -0.02418 -0.04026 37 5S 0.08754 -0.08146 0.02714 -0.00310 0.09263 38 6S 0.01737 -0.29734 -0.00305 0.10664 -0.07388 39 7PX 0.02722 -0.00231 0.00048 0.00840 0.00179 40 7PY -0.02594 0.04408 -0.00488 -0.00329 -0.00898 41 7PZ 0.02185 -0.03313 0.00480 0.00634 0.00577 42 8PX -0.08421 0.00715 -0.00146 -0.02612 -0.00550 43 8PY 0.08029 -0.13665 0.01512 0.01012 0.02795 44 8PZ -0.06763 0.10274 -0.01488 -0.01970 -0.01792 45 9PX 0.15731 -0.01215 0.00127 0.05171 0.00772 46 9PY -0.15112 0.25295 -0.02736 -0.01422 -0.05590 47 9PZ 0.12804 -0.19134 0.02785 0.03792 0.03433 48 10PX 0.15235 -0.03694 0.00932 0.05323 0.03162 49 10PY -0.16274 0.42274 -0.03484 -0.08000 -0.06072 50 10PZ 0.13234 -0.31179 0.03468 0.06347 0.05357 51 11XX 0.02111 -0.01553 0.00330 0.00403 0.00940 52 11YY 0.01700 -0.05030 0.00662 0.00553 0.01436 53 11ZZ 0.01629 -0.03410 0.00493 0.00834 0.01247 54 11XY -0.00748 0.00348 0.00003 -0.00803 -0.00155 55 11XZ 0.00434 -0.00224 0.00133 0.00330 0.00433 56 11YZ -0.00484 0.02998 -0.00498 -0.00354 -0.00564 57 12XX 0.00632 -0.03676 0.01022 -0.00503 0.03515 58 12YY 0.02702 0.03044 -0.00205 0.00082 0.02195 59 12ZZ 0.02417 -0.00144 0.00616 -0.01684 0.02993 60 12XY 0.01853 -0.00551 -0.00085 0.02345 0.00096 61 12XZ -0.00988 0.00267 -0.00458 -0.00853 -0.01324 62 12YZ 0.00425 -0.05759 0.01491 0.00218 0.01338 63 5 C 1S 0.00034 0.00236 0.00160 -0.00220 0.00116 64 2S -0.00083 -0.00164 0.00550 0.00780 0.00218 65 2PX -0.01718 -0.13330 0.01072 -0.21354 -0.11251 66 2PY 0.00984 0.04982 -0.00697 0.14675 0.07858 67 2PZ 0.00122 0.00698 0.00429 0.01316 0.00898 68 3S -0.00962 0.02620 -0.07199 -0.00360 -0.07661 69 3PX -0.01151 -0.15227 -0.01081 -0.27413 -0.15952 70 3PY 0.02706 0.03610 -0.00174 0.16314 0.05284 71 3PZ -0.01896 0.04492 0.04810 -0.05478 0.00179 72 4XX 0.00166 -0.00924 0.00276 -0.00987 0.00174 73 4YY -0.00195 0.01692 -0.00211 0.00836 -0.00471 74 4ZZ -0.00032 -0.00482 0.00116 0.00133 0.00238 75 4XY 0.00031 -0.00048 0.00114 -0.00752 0.00007 76 4XZ 0.00223 -0.01314 -0.00277 0.01359 -0.02168 77 4YZ -0.00079 -0.00615 0.00265 -0.00499 0.01413 78 6 C 1S 0.00063 0.00606 0.00097 -0.00244 -0.00083 79 2S -0.00262 -0.01632 -0.01127 0.01025 0.00018 80 2PX -0.02281 0.12343 0.01947 -0.01270 0.27855 81 2PY 0.00884 -0.07659 -0.02207 0.01468 -0.16494 82 2PZ 0.00490 -0.04371 0.00743 0.00717 -0.01601 83 3S -0.00659 -0.02132 0.03556 -0.02305 0.00747 84 3PX -0.01562 0.16613 0.07175 -0.03475 0.37026 85 3PY 0.00199 -0.08004 -0.02555 0.02217 -0.19703 86 3PZ -0.00184 -0.03321 0.05591 -0.04123 -0.01093 87 4XX -0.00041 -0.00212 0.00299 -0.01525 0.00800 88 4YY 0.00016 0.00160 -0.00417 0.01494 -0.00766 89 4ZZ -0.00058 0.00235 -0.00135 0.00053 -0.00034 90 4XY -0.00024 -0.00017 0.00176 -0.00879 0.00396 91 4XZ -0.00092 -0.00528 0.00142 -0.01407 -0.00331 92 4YZ 0.00063 0.00321 -0.00021 0.00963 0.00218 93 7 C 1S -0.00043 -0.00160 -0.00052 -0.00022 0.00013 94 2S 0.00041 0.00327 0.00109 -0.00098 -0.00112 95 2PX 0.00932 0.00382 -0.05098 0.23547 -0.17740 96 2PY -0.00316 -0.00308 0.03351 -0.14219 0.10560 97 2PZ -0.00070 0.00408 0.00404 -0.01381 0.00959 98 3S 0.00182 0.01466 0.01011 0.00883 0.01254 99 3PX 0.00438 0.01459 -0.06668 0.30325 -0.22439 100 3PY -0.00552 0.00847 0.05576 -0.19416 0.14391 101 3PZ 0.00243 -0.00354 -0.01114 -0.00135 0.00665 102 4XX -0.00148 0.00957 0.00046 0.00589 0.01699 103 4YY 0.00132 -0.00970 -0.00049 -0.00662 -0.01661 104 4ZZ -0.00002 -0.00064 -0.00013 0.00058 -0.00041 105 4XY -0.00087 0.00629 0.00021 0.00428 0.01048 106 4XZ 0.00045 -0.00454 0.00083 -0.00843 -0.00097 107 4YZ 0.00009 0.00000 -0.00002 0.00483 -0.00054 108 8 C 1S 0.00025 -0.00153 0.00079 -0.00042 0.00034 109 2S -0.00051 0.00349 -0.00151 0.00099 -0.00127 110 2PX 0.02260 -0.13807 0.01388 -0.20774 -0.10790 111 2PY -0.01485 0.08801 -0.00961 0.12448 0.06478 112 2PZ -0.00019 0.00320 0.00012 0.01218 0.00308 113 3S 0.00160 -0.00191 0.00478 -0.00004 0.00643 114 3PX 0.02065 -0.16007 0.01814 -0.26598 -0.14029 115 3PY -0.01331 0.10024 -0.00986 0.15531 0.08402 116 3PZ 0.00467 -0.00645 -0.00476 0.02383 0.00309 117 4XX 0.00011 0.00167 -0.00076 0.00677 -0.00080 118 4YY 0.00002 -0.00205 0.00164 -0.00813 0.00259 119 4ZZ 0.00006 -0.00028 -0.00039 0.00118 -0.00170 120 4XY 0.00014 0.00065 -0.00060 0.00484 -0.00216 121 4XZ -0.00014 0.00274 0.00407 -0.01141 0.02182 122 4YZ 0.00025 -0.00356 -0.00244 0.00673 -0.01272 123 9 C 1S -0.00023 0.00760 -0.00070 -0.00174 -0.00173 124 2S 0.00112 -0.01686 0.00157 0.00504 0.00324 125 2PX 0.00152 0.06055 0.04669 -0.04440 0.28215 126 2PY 0.00105 -0.07035 -0.02412 0.03094 -0.16380 127 2PZ 0.00003 -0.00975 -0.00068 0.00188 -0.00834 128 3S -0.00042 -0.06428 0.01267 0.01157 0.02482 129 3PX -0.00433 0.07752 0.05692 -0.05905 0.36920 130 3PY 0.00453 -0.08456 -0.02632 0.04006 -0.21477 131 3PZ 0.00934 -0.04294 -0.00146 0.01892 -0.00454 132 4XX -0.00119 0.00670 -0.00222 0.01481 -0.00633 133 4YY 0.00119 -0.00441 0.00230 -0.01455 0.00635 134 4ZZ 0.00006 -0.00034 0.00011 -0.00083 -0.00045 135 4XY -0.00073 0.00418 -0.00110 0.00785 -0.00440 136 4XZ -0.00095 0.00684 -0.00112 0.01407 0.00381 137 4YZ 0.00075 -0.00605 0.00062 -0.00801 -0.00189 138 10 C 1S 0.00039 -0.01619 0.00119 0.00150 0.00148 139 2S -0.00150 0.04088 0.00334 -0.00617 -0.00529 140 2PX -0.02223 0.11442 -0.04251 0.24341 -0.17178 141 2PY 0.01059 -0.01238 0.02387 -0.15233 0.09923 142 2PZ 0.00067 -0.01918 -0.00155 0.00357 0.00603 143 3S 0.01188 0.07022 -0.03526 0.02599 -0.01035 144 3PX -0.00309 0.07130 -0.06303 0.33980 -0.21117 145 3PY 0.01453 -0.07697 0.03752 -0.18037 0.14526 146 3PZ -0.01521 0.02771 0.00434 -0.00832 0.01209 147 4XX 0.00042 -0.00950 -0.00124 -0.00317 -0.01736 148 4YY 0.00021 0.00379 0.00272 0.00561 0.01871 149 4ZZ 0.00018 0.00325 0.00094 -0.00174 -0.00144 150 4XY 0.00045 -0.00853 -0.00062 -0.00168 -0.01027 151 4XZ 0.00060 0.00264 -0.00076 0.00898 0.00103 152 4YZ -0.00074 -0.00186 0.00066 -0.00592 0.00007 153 11 H 1S -0.00134 0.01334 -0.00007 -0.00276 -0.00422 154 2S 0.01045 -0.03231 0.00501 -0.01585 -0.00781 155 12 H 1S -0.00078 0.00963 -0.00026 -0.00427 -0.00195 156 2S -0.00344 0.03641 0.00005 -0.01864 -0.01041 157 13 H 1S 0.00071 -0.00418 0.00127 -0.00036 0.00067 158 2S 0.00151 -0.00998 0.00372 -0.00354 -0.00028 159 14 H 1S 0.00048 -0.00714 0.00063 -0.00012 -0.00082 160 2S 0.00129 -0.01615 -0.00325 0.00261 -0.00559 161 15 H 1S -0.00367 0.00462 -0.00912 -0.00087 -0.00432 162 2S -0.00152 0.00145 0.03165 -0.03737 -0.00989 163 16 C 1S -0.00035 -0.00573 0.00114 -0.00276 0.00143 164 2S -0.00273 0.01690 -0.00439 -0.00006 -0.00526 165 2PX 0.00015 -0.01232 0.00079 -0.00162 0.00621 166 2PY 0.01926 -0.07513 0.03021 0.08873 0.04704 167 2PZ -0.02759 0.15417 -0.05741 -0.18404 -0.11839 168 3S 0.01745 0.06150 -0.00285 0.10862 0.02141 169 3PX -0.00377 -0.00324 0.00407 -0.04551 0.02448 170 3PY 0.01485 -0.09836 0.03135 0.11823 0.08487 171 3PZ -0.02669 0.16178 -0.08827 -0.21797 -0.13115 172 4XX 0.00016 -0.00123 0.00133 0.00144 0.00224 173 4YY -0.01478 -0.00483 -0.01708 -0.00363 0.00101 174 4ZZ 0.01441 0.00613 0.01584 0.00161 -0.00287 175 4XY 0.01062 0.00049 -0.00924 0.00049 0.00104 176 4XZ -0.01800 -0.00125 0.01784 -0.00176 -0.00699 177 4YZ 0.00922 0.00486 0.01259 0.00042 -0.00327 178 17 C 1S 0.00032 -0.00031 0.00094 -0.00258 0.00810 179 2S -0.00144 0.00240 -0.00308 0.00812 -0.01938 180 2PX -0.01020 -0.00110 -0.00296 -0.02113 0.03080 181 2PY 0.10144 0.06542 0.12909 -0.03073 -0.05215 182 2PZ -0.20501 -0.11021 -0.24309 0.03340 0.10534 183 3S -0.00238 -0.01032 -0.01509 0.01243 -0.06471 184 3PX -0.01286 0.01051 -0.03554 0.06140 0.02193 185 3PY 0.08406 0.05269 0.16588 -0.09593 -0.03524 186 3PZ -0.17582 -0.16108 -0.31525 0.03151 0.10772 187 4XX 0.00005 -0.00107 0.00049 -0.00089 -0.00001 188 4YY 0.00103 -0.00618 0.01134 0.01176 0.00497 189 4ZZ -0.00113 0.00648 -0.01273 -0.01005 -0.00577 190 4XY 0.00083 0.00008 -0.00766 0.00103 0.00003 191 4XZ -0.00194 0.00181 0.01296 0.00253 0.00106 192 4YZ -0.00097 0.00485 -0.00908 -0.00774 -0.00397 193 18 C 1S -0.00024 0.00103 -0.00050 0.00374 -0.00069 194 2S 0.00068 -0.00115 -0.00062 -0.00365 0.00025 195 2PX 0.00057 0.00232 0.00606 0.01214 -0.00243 196 2PY -0.00827 0.00882 -0.16297 -0.05828 -0.00424 197 2PZ 0.01864 -0.01881 0.30512 0.09550 0.01943 198 3S 0.00067 -0.02472 0.02439 -0.09987 0.01390 199 3PX -0.00008 0.01380 0.00923 0.02501 -0.00510 200 3PY -0.00113 0.00615 -0.19242 -0.09580 -0.00019 201 3PZ 0.00695 -0.01809 0.39477 0.09910 0.03628 202 4XX 0.00108 0.00048 0.00034 0.00096 -0.00182 203 4YY 0.00200 0.00093 0.00714 0.00060 0.00001 204 4ZZ -0.00310 -0.00112 -0.00750 -0.00093 0.00170 205 4XY -0.00863 -0.00600 -0.00481 0.00577 0.00587 206 4XZ 0.01592 0.01125 0.00805 -0.00909 -0.01091 207 4YZ -0.00180 -0.00046 -0.00497 -0.00229 0.00157 208 19 C 1S -0.00029 -0.00091 0.00039 -0.00287 0.00154 209 2S 0.00065 0.00205 -0.00027 0.00490 -0.00345 210 2PX 0.00345 0.00257 -0.00098 -0.00953 0.00077 211 2PY -0.12606 -0.07191 0.02641 0.07736 0.06522 212 2PZ 0.23072 0.13626 -0.05003 -0.14713 -0.11463 213 3S 0.00008 0.00503 -0.01533 0.03815 -0.02072 214 3PX 0.00205 0.00603 0.00428 -0.02137 0.00042 215 3PY -0.11171 -0.08150 0.02928 0.10836 0.08542 216 3PZ 0.20371 0.16118 -0.06229 -0.18615 -0.15584 217 4XX 0.00002 -0.00019 -0.00076 -0.00049 0.00075 218 4YY 0.00085 0.00407 0.01664 -0.00178 -0.00601 219 4ZZ -0.00096 -0.00402 -0.01592 0.00177 0.00540 220 4XY -0.00026 0.00002 0.00938 0.00293 -0.00081 221 4XZ 0.00057 0.00016 -0.01865 -0.00364 0.00084 222 4YZ -0.00077 -0.00298 -0.01281 0.00132 0.00400 223 20 C 1S 0.00030 -0.00038 0.00031 0.00191 0.00265 224 2S -0.00023 0.00092 -0.00089 -0.00341 -0.00696 225 2PX 0.00129 -0.00291 -0.00523 0.00729 0.00741 226 2PY -0.00270 0.05354 0.13743 -0.04806 -0.07310 227 2PZ 0.00386 -0.09751 -0.25122 0.07785 0.12605 228 3S -0.00761 0.00510 0.00040 -0.03314 -0.02045 229 3PX 0.00334 -0.00671 -0.00929 0.01463 0.00019 230 3PY 0.00011 0.07037 0.17260 -0.05780 -0.10319 231 3PZ -0.00972 -0.11660 -0.32644 0.09550 0.16133 232 4XX 0.00036 -0.00062 -0.00022 0.00013 0.00089 233 4YY 0.01246 0.00759 -0.01104 -0.00850 -0.00450 234 4ZZ -0.01269 -0.00706 0.01129 0.00881 0.00409 235 4XY -0.00353 -0.00094 0.00643 0.00088 -0.00118 236 4XZ 0.00604 0.00096 -0.01082 -0.00095 0.00231 237 4YZ -0.00928 -0.00501 0.00785 0.00634 0.00333 238 21 C 1S -0.00088 0.00082 -0.00064 -0.00282 -0.00109 239 2S 0.00201 -0.00103 0.00138 0.00591 0.00260 240 2PX -0.00871 0.00752 0.00269 -0.00313 -0.00345 241 2PY 0.11151 0.03600 -0.16032 -0.02749 0.01664 242 2PZ -0.20449 -0.04800 0.28861 0.06240 -0.03155 243 3S 0.00815 -0.00990 0.00391 0.03770 -0.01340 244 3PX 0.00205 0.00779 0.00820 0.01419 0.01581 245 3PY 0.09062 0.04339 -0.20840 -0.04415 0.01929 246 3PZ -0.17144 -0.03833 0.37681 0.08024 -0.03873 247 4XX -0.00013 0.00008 -0.00055 -0.00049 -0.00139 248 4YY -0.00230 -0.00092 -0.00856 -0.00103 0.00211 249 4ZZ 0.00227 0.00107 0.00895 0.00121 -0.00143 250 4XY 0.00013 0.00652 0.00520 -0.00502 -0.00469 251 4XZ -0.00017 -0.01155 -0.00950 0.01295 0.01242 252 4YZ 0.00144 0.00025 0.00622 0.00130 -0.00035 253 22 H 1S -0.00010 0.00116 -0.00047 0.00360 0.00542 254 2S -0.00300 -0.01374 0.00008 -0.00813 0.01425 255 23 H 1S 0.00083 -0.00250 0.00110 0.00120 0.00268 256 2S 0.00120 -0.00572 0.00439 0.00311 0.01746 257 24 H 1S -0.00030 -0.00089 0.00061 -0.00380 0.00212 258 2S -0.00048 -0.00335 0.00071 -0.00986 0.01075 259 25 H 1S -0.00201 0.00027 0.00065 -0.00343 0.00363 260 2S -0.00261 0.00476 0.00599 -0.00804 0.01981 261 26 H 1S 0.00046 0.00190 -0.00110 0.00317 0.00579 262 2S -0.00758 0.01379 -0.02180 0.04403 0.06538 263 27 H 1S -0.00244 -0.01355 0.00402 -0.01952 -0.00331 264 2S 0.00638 -0.08737 0.03195 -0.09250 -0.01717 71 72 73 74 75 V V V V V Eigenvalues -- 0.00125 0.06543 0.08247 0.09420 0.11577 1 1 C 1S 0.01969 0.02956 -0.03339 -0.02963 -0.03492 2 2S -0.02608 -0.06186 0.07357 0.04947 0.04325 3 2PX 0.06682 -0.05265 0.03420 0.07887 0.03712 4 2PY -0.11310 -0.19503 0.00112 0.09760 0.09052 5 2PZ 0.23248 -0.09525 -0.00165 0.04428 0.02557 6 3S -0.25078 -0.45493 0.38987 0.53037 0.56955 7 3PX 0.14478 -0.19181 0.11378 0.30601 -0.04459 8 3PY -0.20303 -0.51689 0.05378 0.24734 0.30043 9 3PZ 0.31599 -0.18935 -0.02848 0.08299 0.19912 10 4XX 0.00729 -0.01227 0.00069 0.00710 -0.00609 11 4YY -0.00895 0.00449 -0.00372 -0.00744 -0.00367 12 4ZZ 0.00756 0.00905 -0.00409 -0.00517 -0.00090 13 4XY -0.00292 0.01195 -0.00260 0.00303 -0.00209 14 4XZ -0.00026 0.01232 -0.00444 -0.00066 0.01124 15 4YZ 0.01080 0.00691 -0.00631 -0.00738 -0.00497 16 2 C 1S -0.05533 0.02679 -0.01178 -0.03920 0.05937 17 2S 0.09904 -0.02879 0.00281 0.06580 -0.09259 18 2PX -0.04966 -0.00337 -0.03626 -0.04858 0.05177 19 2PY 0.22934 -0.05010 0.06707 -0.06218 -0.03025 20 2PZ -0.20559 -0.18808 0.11834 0.03054 -0.16082 21 3S 0.52597 -0.59117 0.37770 0.58690 -0.98889 22 3PX 0.04720 0.04531 -0.14516 -0.07846 0.12933 23 3PY 0.37648 -0.13690 0.12134 -0.15416 -0.23711 24 3PZ -0.24947 -0.40945 0.28030 0.11858 -0.52609 25 4XX -0.01354 0.00256 0.00388 -0.00075 0.00217 26 4YY 0.00026 -0.00652 0.00187 -0.00528 -0.00168 27 4ZZ -0.00190 0.01122 -0.00798 -0.00283 0.00979 28 4XY -0.00968 -0.01761 0.00399 0.00176 0.00350 29 4XZ 0.00885 -0.00964 0.00246 0.00079 -0.00331 30 4YZ 0.00648 0.00502 -0.00307 -0.00959 0.00570 31 3 H 1S -0.02075 0.07072 -0.03413 -0.03845 0.07386 32 2S -0.09498 0.82116 -0.56012 -0.36670 1.09909 33 4 Br 1S 0.00489 0.00444 -0.00225 -0.00053 0.00117 34 2S -0.03265 -0.03352 0.01710 0.00483 -0.00897 35 3S 0.03952 0.04816 -0.02470 -0.00837 0.01307 36 4S 0.06984 0.05994 -0.03044 -0.00619 0.01577 37 5S 0.01323 -0.28156 0.15001 0.06110 -0.10159 38 6S -0.33619 0.45760 -0.25056 -0.10769 0.19274 39 7PX 0.00634 0.00004 0.00081 0.00135 0.00211 40 7PY 0.02308 0.00503 -0.00227 0.00429 0.00198 41 7PZ -0.01662 -0.00243 -0.00059 0.00916 -0.00241 42 8PX -0.01968 -0.00003 -0.00257 -0.00426 -0.00675 43 8PY -0.07156 -0.01565 0.00708 -0.01337 -0.00623 44 8PZ 0.05149 0.00776 0.00174 -0.02878 0.00770 45 9PX 0.03778 -0.00552 0.00714 0.00989 0.02250 46 9PY 0.12762 0.03058 -0.01390 0.02686 0.01527 47 9PZ -0.08955 -0.02519 0.00139 0.06923 -0.02652 48 10PX 0.02405 0.02800 0.00192 0.01004 -0.03355 49 10PY 0.31030 0.03881 -0.01607 0.01272 -0.00925 50 10PZ -0.24056 0.04604 -0.03972 0.01536 0.07096 51 11XX 0.00813 -0.01740 0.00806 0.00518 -0.00939 52 11YY -0.03738 -0.03118 0.01672 -0.00104 -0.01008 53 11ZZ -0.02409 -0.02013 0.01052 0.00825 0.00082 54 11XY -0.00257 -0.00269 -0.00110 0.00118 0.00654 55 11XZ 0.00211 0.00449 0.00011 0.00188 0.00287 56 11YZ 0.02716 -0.00791 0.00813 -0.00076 -0.00654 57 12XX -0.04558 -0.12842 0.07378 0.02605 -0.03299 58 12YY 0.06767 -0.08701 0.04410 0.04849 -0.02809 59 12ZZ 0.03746 -0.11176 0.05669 0.01597 -0.05325 60 12XY 0.01357 0.00881 0.00212 -0.00774 -0.02135 61 12XZ -0.01161 -0.01369 0.00054 -0.00579 -0.01248 62 12YZ -0.05639 0.02305 -0.02491 0.00083 0.01224 63 5 C 1S 0.00482 0.02270 -0.00561 0.01741 -0.00559 64 2S -0.01736 -0.05751 0.00348 -0.02861 0.01478 65 2PX 0.12001 -0.06368 0.00542 -0.03118 0.03595 66 2PY -0.12568 -0.04208 0.02961 -0.03219 0.02634 67 2PZ -0.01991 -0.02775 0.02311 0.00062 -0.01393 68 3S 0.08485 -0.27184 0.16174 -0.14690 -0.23714 69 3PX 0.18904 -0.03039 -0.05059 -0.09456 0.06431 70 3PY -0.12516 0.07713 -0.08779 -0.09697 0.15191 71 3PZ -0.02836 0.01910 -0.03923 -0.04706 0.11131 72 4XX 0.00011 0.00842 -0.00346 0.00055 0.00465 73 4YY 0.00907 0.00719 -0.00440 0.01206 -0.00017 74 4ZZ -0.00718 -0.01361 0.00837 -0.00708 -0.00889 75 4XY 0.00577 0.00429 -0.01046 0.00853 -0.00467 76 4XZ -0.00570 -0.00329 0.00157 0.00756 -0.00758 77 4YZ -0.01013 -0.00593 0.00255 0.01236 -0.01311 78 6 C 1S 0.00821 0.02519 -0.01792 0.02657 0.00596 79 2S -0.01184 -0.06474 0.03143 -0.05204 -0.04372 80 2PX -0.06717 -0.06617 0.01542 -0.01811 -0.05471 81 2PY 0.03390 -0.01097 0.03693 -0.04836 0.05612 82 2PZ -0.03362 0.00469 -0.01295 0.07803 -0.07375 83 3S -0.10490 -0.15557 0.12674 -0.32398 0.22188 84 3PX -0.08675 -0.08270 0.04174 -0.10417 -0.00107 85 3PY 0.05447 -0.05632 0.10373 -0.22135 0.12969 86 3PZ -0.04069 0.13554 -0.14650 0.06590 0.04954 87 4XX 0.00506 -0.00017 0.00636 0.00097 0.00226 88 4YY -0.00460 0.00390 -0.00524 0.00090 0.00092 89 4ZZ 0.00239 0.00150 -0.00535 0.00336 -0.00182 90 4XY 0.00378 -0.00029 -0.00573 0.00037 -0.00069 91 4XZ 0.00810 -0.00391 0.00299 -0.00918 0.00718 92 4YZ -0.00695 -0.00241 0.00274 -0.01639 0.01026 93 7 C 1S -0.00177 0.00462 -0.00678 0.04489 -0.02569 94 2S 0.00266 -0.01276 -0.01241 -0.08588 0.03464 95 2PX -0.06656 0.05383 -0.08160 -0.00965 0.01938 96 2PY 0.04166 -0.01301 0.01014 0.03643 -0.01128 97 2PZ 0.00514 0.02034 -0.03541 0.12516 -0.08530 98 3S 0.02691 -0.09306 0.20385 -0.65321 0.38337 99 3PX -0.08200 0.09200 -0.06720 -0.00893 0.04845 100 3PY 0.07299 -0.01503 0.00923 0.02019 -0.03148 101 3PZ 0.01782 -0.00014 -0.00804 0.31275 -0.28886 102 4XX -0.00816 -0.00150 -0.00037 -0.00305 -0.00173 103 4YY 0.00854 -0.00309 0.00289 -0.00906 0.00280 104 4ZZ -0.00050 0.00317 -0.00878 0.01681 -0.00923 105 4XY -0.00467 -0.00259 -0.00013 -0.00626 -0.00151 106 4XZ 0.00440 -0.00120 0.00126 0.00629 -0.00526 107 4YZ -0.00386 0.00315 -0.00302 0.00633 -0.00374 108 8 C 1S -0.00125 0.01332 -0.01501 0.03486 -0.00477 109 2S 0.00296 -0.03276 0.02408 -0.06508 -0.00549 110 2PX 0.14099 -0.03222 0.02180 0.08916 -0.04893 111 2PY -0.08167 0.04329 -0.06632 0.10448 -0.02366 112 2PZ -0.00920 0.00040 -0.00593 0.03485 -0.03048 113 3S -0.01250 -0.08689 0.12620 -0.51525 0.24834 114 3PX 0.19024 -0.01258 0.00903 0.19938 -0.05742 115 3PY -0.11722 0.12025 -0.17575 0.24504 -0.01751 116 3PZ -0.01930 0.01843 -0.03406 0.08317 0.00764 117 4XX -0.00380 0.00277 -0.00446 0.00323 -0.00058 118 4YY 0.00307 0.00219 -0.00398 0.01308 -0.00398 119 4ZZ -0.00011 -0.00303 0.00277 -0.01171 0.00387 120 4XY -0.00221 0.00452 -0.00678 0.00856 -0.00112 121 4XZ -0.00272 -0.00029 -0.00175 0.00480 -0.00082 122 4YZ 0.00023 0.00287 -0.00299 0.00829 0.00144 123 9 C 1S 0.01057 0.01455 -0.01488 0.03578 -0.00706 124 2S -0.02355 -0.02619 0.01492 -0.06457 0.01767 125 2PX -0.10619 0.02107 -0.06893 0.02823 0.00925 126 2PY 0.02728 0.00529 -0.00427 0.09198 0.01240 127 2PZ -0.00718 -0.02990 0.04061 -0.08334 -0.00817 128 3S -0.10529 -0.25737 0.29819 -0.52269 -0.02881 129 3PX -0.14332 0.01813 -0.07899 0.06858 0.01843 130 3PY 0.03890 -0.02655 0.01715 0.18445 -0.01238 131 3PZ -0.04423 -0.03785 0.04919 -0.20582 0.09816 132 4XX -0.00400 0.00257 -0.00127 -0.00142 0.00285 133 4YY 0.00552 0.00027 -0.00180 -0.00008 0.00035 134 4ZZ 0.00043 -0.00132 -0.00116 0.00619 -0.00607 135 4XY -0.00111 0.00170 -0.00106 -0.00070 0.00089 136 4XZ -0.00918 -0.00163 0.00165 -0.00981 0.00026 137 4YZ 0.00352 -0.00895 0.00956 -0.01412 -0.00250 138 10 C 1S -0.01695 0.00948 -0.01417 0.03850 0.01076 139 2S 0.03719 -0.03308 0.02102 -0.07438 -0.02747 140 2PX -0.02238 0.01185 0.01122 -0.01846 0.00456 141 2PY 0.06202 -0.00983 0.00162 -0.02728 -0.01376 142 2PZ -0.02003 -0.08991 0.08487 -0.06738 -0.10523 143 3S 0.12703 -0.05331 0.14784 -0.43730 -0.16697 144 3PX -0.07344 -0.01375 0.07877 -0.04767 -0.00771 145 3PY 0.00716 -0.06408 0.04038 -0.11464 0.00430 146 3PZ -0.00297 -0.29093 0.26564 -0.16121 -0.39405 147 4XX 0.00647 -0.00420 0.00448 -0.00126 0.00068 148 4YY -0.01506 -0.00371 -0.00029 -0.00617 0.00194 149 4ZZ 0.00526 0.00560 -0.00821 0.01539 -0.00509 150 4XY 0.00140 -0.00582 0.00262 -0.00135 -0.00160 151 4XZ -0.00529 0.00305 -0.00276 0.00511 -0.00116 152 4YZ 0.00221 0.00377 -0.00406 0.00681 0.00291 153 11 H 1S 0.01584 0.02329 -0.02779 0.05969 -0.00378 154 2S -0.00506 0.40239 -0.42301 0.55798 0.47511 155 12 H 1S 0.01229 0.02818 -0.02859 0.05602 0.00176 156 2S 0.06168 0.21427 -0.27838 0.70517 -0.03107 157 13 H 1S -0.00382 0.02128 -0.02826 0.06279 -0.00720 158 2S -0.00870 0.19247 -0.28692 0.76275 -0.18499 159 14 H 1S -0.00407 0.00953 -0.01908 0.06430 -0.04047 160 2S -0.00605 0.10725 -0.17183 0.79282 -0.53270 161 15 H 1S 0.01137 0.01344 -0.02884 0.06247 -0.04060 162 2S 0.01594 0.27850 -0.30104 0.54628 -0.23245 163 16 C 1S -0.00674 0.01675 0.00571 0.00655 0.01604 164 2S 0.02065 -0.03869 -0.01494 -0.01777 -0.05733 165 2PX -0.02899 0.00127 0.01762 0.04383 0.04784 166 2PY 0.14195 -0.04905 0.00428 0.01158 -0.03859 167 2PZ -0.20078 -0.02500 -0.00896 0.01492 0.11305 168 3S -0.00982 -0.31040 0.01383 0.00618 0.15100 169 3PX -0.02457 -0.00760 0.07867 0.12153 0.06752 170 3PY 0.17279 0.09258 -0.07485 -0.17856 -0.10863 171 3PZ -0.28590 0.00319 -0.02614 -0.07366 0.10545 172 4XX -0.00359 0.01953 0.00030 -0.01265 -0.00651 173 4YY -0.00324 -0.01542 0.00205 0.01231 0.00675 174 4ZZ 0.00648 -0.00489 -0.00005 0.00227 0.00352 175 4XY 0.00631 -0.00668 -0.01707 -0.00536 -0.00100 176 4XZ -0.00742 -0.00439 -0.00962 -0.00263 -0.00316 177 4YZ 0.00486 -0.00813 0.00339 0.00773 0.00974 178 17 C 1S -0.00162 0.02871 0.02892 -0.00512 0.00210 179 2S 0.00272 -0.07820 -0.05373 0.01982 0.00912 180 2PX 0.00133 0.01864 0.07452 0.04279 0.07341 181 2PY -0.02271 -0.04546 0.03962 0.05336 0.11800 182 2PZ 0.04773 -0.01236 0.00674 0.02746 -0.05726 183 3S 0.02464 -0.12971 -0.38128 -0.11818 -0.26851 184 3PX -0.02429 0.08492 0.24906 0.07942 0.08432 185 3PY -0.02522 0.06029 -0.03909 -0.06613 0.12890 186 3PZ 0.08951 0.04445 -0.03084 -0.05467 -0.11982 187 4XX -0.00020 0.00687 0.01528 0.00463 0.00980 188 4YY 0.01354 0.00105 -0.00584 -0.00716 -0.01097 189 4ZZ -0.01362 -0.00229 -0.00331 -0.00083 -0.00083 190 4XY -0.00282 0.00008 0.01253 0.00775 0.00175 191 4XZ -0.00038 -0.00016 0.00553 0.00443 0.00759 192 4YZ -0.01024 0.00267 -0.00356 -0.00513 -0.00580 193 18 C 1S -0.00214 0.00735 0.04334 0.02513 0.02365 194 2S 0.00393 -0.01094 -0.08045 -0.04842 -0.04680 195 2PX -0.00299 -0.02124 0.01846 0.03392 0.04438 196 2PY -0.06284 0.03912 0.11219 0.04788 0.05858 197 2PZ 0.11971 0.02039 0.06016 0.02737 0.14719 198 3S 0.03757 -0.14073 -0.65112 -0.34396 -0.33700 199 3PX -0.00480 -0.05419 0.09061 0.11596 0.08827 200 3PY -0.07667 0.03531 0.25252 0.15837 0.26054 201 3PZ 0.15121 0.01820 0.13009 0.08930 0.33838 202 4XX -0.00057 -0.00370 -0.01238 -0.00546 -0.00868 203 4YY 0.00200 0.00330 0.01541 0.00781 0.01364 204 4ZZ -0.00183 0.00075 0.00320 0.00210 -0.00199 205 4XY 0.00668 0.00489 0.00727 0.00067 0.00036 206 4XZ -0.01292 0.00164 0.00519 0.00049 -0.00033 207 4YZ -0.00206 0.00222 0.00980 0.00511 0.00331 208 19 C 1S -0.00058 0.02266 0.03327 0.00638 0.00840 209 2S 0.00165 -0.04986 -0.06494 -0.00767 -0.00532 210 2PX -0.00196 -0.05999 -0.11728 -0.02667 -0.02164 211 2PY 0.10410 0.01462 0.08851 0.04096 0.10859 212 2PZ -0.18866 0.00244 0.05668 0.02080 -0.05859 213 3S 0.00634 -0.21389 -0.49357 -0.18137 -0.32181 214 3PX 0.00056 -0.15850 -0.27239 -0.04464 -0.05857 215 3PY 0.14268 0.07439 0.20038 0.05053 0.09344 216 3PZ -0.26195 0.03399 0.12444 0.02453 -0.14384 217 4XX -0.00038 0.00381 0.00658 0.00169 0.00592 218 4YY -0.00456 0.00025 -0.00047 -0.00113 -0.00855 219 4ZZ 0.00497 0.00024 -0.00148 -0.00026 0.00163 220 4XY 0.00218 -0.01065 -0.01880 -0.00422 0.00041 221 4XZ -0.00377 -0.00539 -0.01075 -0.00248 -0.00473 222 4YZ 0.00341 0.00212 0.00037 -0.00081 -0.00236 223 20 C 1S -0.00338 0.02113 0.03729 0.00384 0.00047 224 2S 0.00806 -0.03654 -0.06879 -0.01226 -0.01797 225 2PX -0.00203 -0.07627 -0.11558 -0.00544 0.06978 226 2PY -0.07675 -0.03248 -0.02133 0.00753 -0.02883 227 2PZ 0.15746 0.00026 -0.02114 0.00369 0.10135 228 3S 0.03006 -0.36726 -0.55902 0.03768 0.18708 229 3PX 0.00473 -0.10006 -0.24601 -0.06623 0.06790 230 3PY -0.09158 -0.07113 -0.08273 0.00130 -0.16776 231 3PZ 0.20056 -0.02026 -0.05508 0.00652 0.10889 232 4XX -0.00155 0.01507 0.01241 -0.00184 -0.00596 233 4YY -0.00877 -0.00872 -0.00493 0.00255 0.00496 234 4ZZ 0.00953 -0.00322 -0.00225 0.00019 0.00170 235 4XY -0.00105 0.00690 0.01385 0.00292 -0.00286 236 4XZ 0.00213 0.00477 0.00621 0.00134 0.00481 237 4YZ 0.00722 -0.00592 -0.00233 0.00233 0.00633 238 21 C 1S 0.00312 0.02088 0.03575 0.00665 -0.03059 239 2S -0.00761 -0.04182 -0.07498 -0.01460 0.05181 240 2PX 0.01317 -0.07301 0.01176 0.04548 0.03716 241 2PY 0.00450 -0.12607 -0.05661 0.05353 0.19524 242 2PZ 0.00354 -0.08752 -0.01404 0.03119 -0.01232 243 3S -0.00930 -0.28755 -0.39875 -0.04080 0.47997 244 3PX -0.00050 -0.10443 0.09952 0.06535 0.16214 245 3PY -0.00829 -0.37480 -0.14844 0.19861 0.50618 246 3PZ 0.03619 -0.20383 -0.07427 0.09706 0.08514 247 4XX 0.00316 -0.01231 -0.00776 0.00355 0.00199 248 4YY -0.00274 0.01047 0.01239 0.00081 0.00074 249 4ZZ 0.00017 0.00341 0.00212 -0.00120 -0.00640 250 4XY -0.01137 0.00090 0.00471 0.00129 0.00288 251 4XZ 0.01571 0.00065 0.00308 0.00055 0.00028 252 4YZ 0.00034 0.00687 0.00957 0.00058 -0.00558 253 22 H 1S -0.00683 0.04702 0.06294 -0.00042 -0.03339 254 2S -0.02382 0.68885 0.49162 -0.20193 -0.82740 255 23 H 1S -0.00528 0.05562 0.05862 -0.00181 -0.01594 256 2S -0.02663 0.44153 0.68653 0.04431 -0.19288 257 24 H 1S -0.00010 0.04374 0.07354 0.01425 0.00991 258 2S -0.00594 0.38489 0.80117 0.20138 0.23465 259 25 H 1S -0.00054 0.01193 0.07038 0.03800 0.05017 260 2S -0.01201 0.15782 0.77920 0.43287 0.69529 261 26 H 1S -0.00448 0.01480 0.07053 0.02713 0.02941 262 2S -0.04853 0.22563 0.56323 0.19036 0.33920 263 27 H 1S 0.01497 0.08153 -0.04231 -0.04033 -0.04194 264 2S 0.03233 0.97932 -0.31309 -0.64562 -0.61292 76 77 78 79 80 V V V V V Eigenvalues -- 0.11951 0.12985 0.13637 0.14049 0.15223 1 1 C 1S -0.00224 0.05272 0.01698 0.01162 -0.04398 2 2S 0.00021 -0.07972 -0.02373 -0.00447 0.06323 3 2PX 0.02290 0.14621 -0.03366 0.08009 0.08111 4 2PY -0.02846 0.03902 -0.07093 -0.02949 0.09704 5 2PZ 0.09755 0.01050 -0.00662 -0.05041 0.08327 6 3S 0.03592 -0.72752 -0.34197 -0.22701 0.80303 7 3PX 0.01125 0.56586 -0.11711 0.30368 0.12308 8 3PY -0.06561 0.04270 -0.22525 -0.02476 0.22908 9 3PZ 0.32060 -0.02059 -0.08239 -0.08208 0.19908 10 4XX -0.00038 0.02629 -0.00128 0.01482 -0.00500 11 4YY -0.01662 -0.00375 0.00180 -0.00805 -0.00753 12 4ZZ 0.01476 -0.00755 0.00280 -0.00476 0.00153 13 4XY 0.00782 0.00130 0.00160 0.00252 0.00250 14 4XZ -0.00937 0.00053 0.00010 0.00243 0.00306 15 4YZ 0.00972 -0.00020 0.00329 -0.00990 -0.00350 16 2 C 1S 0.00539 -0.05930 0.00923 -0.03806 0.00077 17 2S -0.00886 0.09359 -0.00221 0.06122 0.00955 18 2PX 0.01394 0.13256 -0.00057 0.05743 -0.04161 19 2PY 0.01807 -0.01727 0.00784 -0.02170 -0.03615 20 2PZ -0.08181 0.01239 -0.01117 0.01229 -0.07856 21 3S -0.12107 0.94779 -0.31699 0.71877 -0.15711 22 3PX 0.05252 0.48034 0.07648 0.09508 -0.08331 23 3PY -0.00662 0.10443 0.20555 -0.12027 -0.13244 24 3PZ -0.22420 0.07004 0.04206 0.04870 -0.19416 25 4XX -0.00237 -0.02740 0.00223 -0.00731 -0.00176 26 4YY -0.00152 0.01125 0.00274 0.00153 0.00044 27 4ZZ 0.00428 0.00511 -0.00136 0.00277 0.00190 28 4XY -0.00541 -0.00196 -0.00673 -0.00258 0.00008 29 4XZ 0.00900 -0.00438 -0.00254 -0.00407 -0.00041 30 4YZ 0.00041 0.00109 0.00472 -0.00495 -0.00401 31 3 H 1S -0.00118 0.01185 0.00475 -0.00104 0.00792 32 2S 0.27971 -0.20807 0.04115 -0.19924 0.26259 33 4 Br 1S -0.00111 -0.00121 0.00553 -0.00267 0.00215 34 2S 0.00850 0.01019 -0.04325 0.02112 -0.01579 35 3S -0.01235 -0.01647 0.06460 -0.03194 0.02185 36 4S -0.01516 -0.01535 0.07401 -0.03546 0.03016 37 5S 0.08683 0.16185 -0.39745 0.20759 -0.10073 38 6S -0.16599 -0.35072 0.66696 -0.36278 0.13731 39 7PX 0.00486 -0.00137 0.00064 -0.00082 0.00315 40 7PY 0.00115 0.00002 0.00356 -0.00160 0.00613 41 7PZ -0.00109 0.00230 0.00419 -0.00127 0.00925 42 8PX -0.01520 0.00422 -0.00194 0.00254 -0.00992 43 8PY -0.00358 0.00005 -0.01117 0.00510 -0.01911 44 8PZ 0.00338 -0.00735 -0.01309 0.00390 -0.02915 45 9PX 0.03181 -0.00603 0.00132 -0.00454 0.02477 46 9PY 0.00615 -0.00709 0.02554 -0.01481 0.03728 47 9PZ -0.00599 0.02525 0.02763 -0.00532 0.07222 48 10PX 0.02440 -0.04097 0.01003 -0.00641 0.00354 49 10PY 0.03278 0.07196 0.01870 0.01259 0.04945 50 10PZ -0.01667 -0.07075 0.00209 -0.01759 0.00972 51 11XX 0.01437 0.01824 -0.02507 0.01526 -0.00427 52 11YY -0.00270 0.00259 -0.02912 0.01133 -0.01814 53 11ZZ 0.00612 0.00337 -0.03886 0.01954 -0.00860 54 11XY -0.00405 0.00694 -0.00426 0.00290 0.00379 55 11XZ 0.00611 -0.00886 -0.00134 -0.00181 0.00540 56 11YZ 0.00465 0.00452 -0.01386 0.00983 -0.00663 57 12XX 0.00564 0.03547 -0.18393 0.08940 -0.05796 58 12YY 0.06037 0.08180 -0.17036 0.09943 -0.01129 59 12ZZ 0.03335 0.08005 -0.13459 0.06879 -0.03505 60 12XY 0.01472 -0.01770 0.01666 -0.01026 -0.01766 61 12XZ -0.02313 0.02877 0.00327 0.00843 -0.02084 62 12YZ -0.01430 -0.00291 0.05535 -0.03538 0.02302 63 5 C 1S 0.00121 0.00359 -0.00266 0.01896 -0.01668 64 2S -0.01397 0.01195 -0.02456 -0.02532 0.06326 65 2PX 0.00780 0.13423 -0.00536 0.01752 0.02393 66 2PY -0.00531 -0.12661 0.00123 -0.05338 -0.11197 67 2PZ -0.02161 -0.01890 0.02031 -0.00603 -0.02052 68 3S -0.00977 0.02845 0.16436 -0.16713 -0.12418 69 3PX 0.02238 0.21529 0.13418 -0.13003 0.09695 70 3PY -0.01417 -0.18605 0.21729 -0.22927 -0.03875 71 3PZ -0.02815 -0.02581 0.02286 -0.05243 -0.01801 72 4XX 0.00235 0.01048 0.00624 0.00813 0.00294 73 4YY 0.00124 -0.01132 -0.00111 -0.00022 0.00741 74 4ZZ -0.00591 0.00431 -0.00449 0.00213 -0.01260 75 4XY 0.00004 0.01713 -0.00456 0.00173 0.00484 76 4XZ -0.00522 0.00587 0.00315 0.00250 0.00388 77 4YZ -0.00594 -0.00148 0.00658 -0.00059 0.00743 78 6 C 1S 0.00011 -0.00621 0.04209 -0.01776 0.03904 79 2S 0.00194 0.03429 -0.08964 0.01915 -0.05890 80 2PX -0.00076 -0.15903 -0.10277 -0.05864 -0.10177 81 2PY 0.03471 0.08554 -0.08130 0.10365 -0.09352 82 2PZ -0.06099 0.03021 0.13628 -0.04400 0.08064 83 3S 0.05063 -0.03366 -0.63555 0.26357 -0.57372 84 3PX -0.01704 -0.27502 -0.27283 -0.04700 -0.30103 85 3PY 0.11263 0.14588 -0.33444 0.24032 -0.37003 86 3PZ -0.11359 0.03536 0.39986 -0.23614 0.33462 87 4XX 0.00049 -0.01318 0.00630 0.00320 -0.00359 88 4YY 0.00197 0.00802 0.00349 -0.00325 -0.00020 89 4ZZ 0.00217 0.00409 -0.00577 -0.00206 0.01231 90 4XY -0.00140 -0.00095 -0.00467 -0.00976 -0.00197 91 4XZ 0.00258 0.00154 -0.00293 0.00102 0.00153 92 4YZ 0.00259 -0.00444 -0.00558 -0.00195 -0.00612 93 7 C 1S -0.00957 0.00123 0.01515 -0.00066 0.00861 94 2S 0.00562 0.01685 -0.03675 -0.04795 0.00377 95 2PX 0.01084 0.22604 0.01198 -0.00157 0.03989 96 2PY -0.01452 -0.13924 0.01918 -0.05634 -0.02453 97 2PZ -0.04780 -0.00031 0.12956 -0.07382 0.00258 98 3S 0.20785 -0.04856 -0.47492 0.27108 -0.36396 99 3PX 0.03993 0.34557 0.15133 0.07566 0.13220 100 3PY -0.04280 -0.21350 0.11603 -0.14842 0.07480 101 3PZ -0.09035 0.01623 0.20973 -0.03831 -0.16856 102 4XX 0.00068 -0.00094 -0.00046 -0.00203 0.00104 103 4YY -0.00034 0.00243 -0.00583 0.00031 0.00241 104 4ZZ -0.00350 0.00408 -0.00168 -0.00708 -0.00323 105 4XY 0.00114 0.00288 -0.00622 -0.00051 -0.00008 106 4XZ -0.00328 -0.01088 0.00337 -0.00450 -0.00041 107 4YZ -0.00254 0.00835 0.00760 0.00039 0.00412 108 8 C 1S -0.00200 -0.00154 -0.00460 -0.00311 -0.03492 109 2S -0.00178 0.01297 -0.01168 -0.00540 0.03191 110 2PX -0.03935 -0.21528 -0.04489 -0.07655 -0.11835 111 2PY 0.01010 0.11925 -0.01873 0.01949 -0.10722 112 2PZ -0.01468 0.00977 0.02738 -0.01410 -0.03823 113 3S 0.05174 -0.01765 0.16805 -0.02085 0.95371 114 3PX -0.06621 -0.41289 -0.02037 -0.15802 -0.20098 115 3PY 0.00180 0.19932 0.03589 -0.04829 -0.16333 116 3PZ 0.01684 -0.00530 -0.10714 0.02389 -0.13584 117 4XX 0.00030 0.01045 -0.00028 0.00051 -0.00130 118 4YY -0.00285 -0.01020 0.00062 -0.00659 -0.00401 119 4ZZ 0.00101 0.00160 -0.00445 0.00056 0.00337 120 4XY -0.00067 0.00655 0.00087 -0.00247 0.00203 121 4XZ 0.00172 0.00187 -0.00508 0.00305 -0.00160 122 4YZ 0.00058 -0.00388 -0.00894 0.00216 -0.00408 123 9 C 1S 0.00533 -0.00097 -0.02051 0.00804 -0.01881 124 2S -0.01169 0.00376 0.01266 -0.02745 0.03349 125 2PX 0.03020 0.21335 -0.05167 0.05384 0.00112 126 2PY -0.00800 -0.15503 -0.10185 -0.00762 -0.08780 127 2PZ -0.02559 -0.00165 0.12775 -0.04495 0.09265 128 3S -0.11552 0.06568 0.42337 -0.07858 0.26678 129 3PX 0.07113 0.35689 -0.15048 0.17675 -0.00598 130 3PY 0.00030 -0.25096 -0.32945 0.08117 -0.20037 131 3PZ -0.02590 -0.03038 0.23726 -0.11673 0.43394 132 4XX -0.00064 -0.00545 -0.00248 -0.00205 -0.00085 133 4YY 0.00273 0.00739 -0.00429 0.00286 0.00135 134 4ZZ -0.00303 0.00002 0.00097 -0.00363 -0.00311 135 4XY -0.00038 -0.00251 -0.00257 -0.00101 -0.00052 136 4XZ -0.00013 0.01095 0.00624 0.00084 0.00373 137 4YZ -0.00267 -0.00462 0.00860 -0.00390 0.00321 138 10 C 1S 0.00222 -0.01005 -0.02449 0.00982 0.03237 139 2S -0.01485 0.03974 0.00189 -0.01912 -0.05829 140 2PX -0.04373 -0.17253 -0.01104 -0.07298 -0.06601 141 2PY 0.02249 0.11917 0.02835 0.02965 -0.02716 142 2PZ -0.05807 0.02113 0.17032 -0.05551 -0.05517 143 3S -0.07294 0.07718 0.66572 -0.27896 -0.38427 144 3PX -0.04537 -0.31879 0.01179 -0.06847 -0.13486 145 3PY 0.00986 0.20620 0.02990 0.04392 -0.02063 146 3PZ -0.17118 0.11257 0.27135 -0.06555 -0.37866 147 4XX -0.00199 -0.00688 -0.00160 -0.00013 -0.00153 148 4YY -0.00241 0.00509 -0.00099 -0.00282 -0.00048 149 4ZZ -0.00102 0.00556 -0.00554 0.00137 0.00760 150 4XY -0.00374 -0.00266 -0.00093 -0.00340 -0.00047 151 4XZ -0.00043 -0.00653 -0.00559 -0.00093 -0.00857 152 4YZ 0.00220 0.00350 -0.00709 0.00452 -0.00595 153 11 H 1S 0.00633 0.00561 -0.03533 0.01683 0.02380 154 2S 0.25575 -0.14788 -0.71720 0.26303 0.60271 155 12 H 1S 0.00982 -0.00382 -0.03972 0.01306 -0.02860 156 2S 0.12968 -0.06362 -0.77403 0.27640 -0.65485 157 13 H 1S -0.00378 -0.00497 -0.00497 -0.01008 -0.02477 158 2S -0.06391 -0.06049 -0.10742 -0.13309 -0.79897 159 14 H 1S -0.01792 0.00687 0.02127 -0.01624 -0.00561 160 2S -0.23575 0.05397 0.58561 -0.23561 0.01678 161 15 H 1S -0.00668 0.02106 0.02601 -0.02257 0.05193 162 2S -0.23864 0.06618 1.00538 -0.47219 0.94331 163 16 C 1S 0.00135 0.00946 -0.00586 -0.03412 -0.00938 164 2S -0.00719 0.00356 0.00746 0.09069 -0.01013 165 2PX 0.00094 -0.04638 0.01625 0.12039 0.07028 166 2PY 0.17545 0.08423 0.00989 -0.03248 -0.02821 167 2PZ -0.29202 0.07000 -0.00691 0.01354 -0.04355 168 3S 0.04918 -0.29263 -0.03867 0.18246 0.42376 169 3PX -0.02992 -0.06692 -0.11129 0.09032 0.35075 170 3PY 0.27631 -0.04231 0.04775 -0.11317 -0.06273 171 3PZ -0.46508 0.02392 -0.02399 0.01378 -0.10800 172 4XX -0.00314 -0.01390 -0.00375 -0.01365 -0.00219 173 4YY 0.00706 0.01506 -0.00171 0.00576 0.00090 174 4ZZ -0.00267 0.00464 0.00001 0.00471 -0.00057 175 4XY -0.00371 0.01029 -0.00229 -0.01930 -0.00889 176 4XZ 0.00502 0.00526 -0.00169 -0.01035 -0.00529 177 4YZ -0.00007 0.01054 -0.00113 0.00373 0.00201 178 17 C 1S 0.00445 -0.04330 0.02955 0.02538 -0.00101 179 2S -0.00293 0.09002 -0.05808 -0.02779 0.00496 180 2PX 0.04400 -0.08487 0.13007 0.14791 -0.01917 181 2PY -0.09998 0.04170 0.01630 0.02244 -0.02970 182 2PZ 0.24786 -0.00459 0.03772 -0.04593 0.01743 183 3S -0.12125 0.57639 -0.48646 -0.48519 -0.11092 184 3PX 0.12630 -0.23076 0.36260 0.57433 -0.12018 185 3PY -0.19360 -0.05940 0.08307 -0.09069 -0.08211 186 3PZ 0.44743 -0.06449 0.05808 -0.12116 -0.00718 187 4XX 0.00374 0.00294 0.00642 0.00262 -0.00815 188 4YY 0.00322 -0.00593 -0.00337 0.00340 0.00379 189 4ZZ -0.00560 0.00001 -0.00178 0.00158 0.00108 190 4XY 0.00937 -0.00530 0.00300 0.01861 0.00902 191 4XZ -0.01481 -0.00269 0.00004 0.01107 0.00328 192 4YZ -0.00661 -0.00478 -0.00196 0.00164 0.00036 193 18 C 1S 0.00881 0.01315 0.01723 0.04169 0.00136 194 2S -0.01253 -0.02345 -0.01438 -0.05748 -0.02607 195 2PX 0.01021 0.01324 0.02356 0.02073 -0.02362 196 2PY 0.17075 0.01876 0.11730 0.00348 -0.09076 197 2PZ -0.20599 0.03321 0.04464 0.03450 -0.06652 198 3S -0.18901 -0.17147 -0.49715 -0.88012 0.29682 199 3PX 0.00813 0.19648 -0.07311 -0.13582 -0.09218 200 3PY 0.32911 0.07514 0.23683 -0.01965 -0.10911 201 3PZ -0.35794 0.07505 0.10150 0.04604 -0.08878 202 4XX -0.00389 -0.00168 -0.00621 0.00273 0.00684 203 4YY -0.00635 0.00367 0.00387 0.00249 -0.00307 204 4ZZ 0.01091 -0.00007 0.00332 -0.00034 -0.00147 205 4XY -0.00016 0.00018 -0.00113 -0.00502 0.00233 206 4XZ 0.00130 0.00047 -0.00118 -0.00162 0.00034 207 4YZ 0.00939 0.00087 0.00259 -0.00140 0.00069 208 19 C 1S 0.00333 0.02670 -0.00468 -0.05278 -0.04112 209 2S -0.00476 -0.03528 0.00095 0.06466 0.07274 210 2PX 0.00062 -0.08512 0.03157 0.12306 0.06091 211 2PY -0.10542 0.05678 -0.01484 -0.09459 -0.02976 212 2PZ 0.24291 0.01100 0.00685 -0.08201 0.00085 213 3S -0.07608 -0.54553 0.19077 1.23473 0.57804 214 3PX -0.03592 -0.16941 -0.06548 0.15859 0.34208 215 3PY -0.20505 0.11562 -0.11077 -0.25336 -0.05528 216 3PZ 0.39411 0.02962 -0.03337 -0.18630 -0.00756 217 4XX 0.00337 -0.00250 0.00731 -0.00324 -0.00633 218 4YY 0.00409 0.00341 -0.00486 0.00013 -0.00028 219 4ZZ -0.00736 0.00256 -0.00222 -0.00156 -0.00029 220 4XY -0.00586 -0.00496 0.00185 0.00327 -0.00290 221 4XZ 0.00972 -0.00374 0.00194 0.00001 -0.00038 222 4YZ -0.00600 0.00197 -0.00286 0.00227 -0.00082 223 20 C 1S -0.00429 -0.01868 -0.02521 -0.02870 0.05138 224 2S 0.00286 0.03737 0.03691 0.05329 -0.09063 225 2PX 0.02835 -0.06455 0.13218 0.10083 -0.10464 226 2PY 0.13695 0.00374 0.06266 0.06456 -0.03286 227 2PZ -0.21621 0.02377 0.02011 0.05749 -0.03144 228 3S 0.11626 0.31424 0.49089 0.43845 -0.82383 229 3PX 0.06390 -0.11772 0.40064 0.31159 -0.50619 230 3PY 0.21692 0.00966 0.11764 0.40738 -0.02511 231 3PZ -0.41175 0.04492 0.03032 0.26173 -0.03640 232 4XX -0.00393 -0.00065 -0.00746 -0.00841 0.00254 233 4YY 0.00598 -0.00204 0.00414 0.00313 0.00419 234 4ZZ -0.00255 -0.00024 0.00073 0.00164 0.00035 235 4XY 0.00568 0.00544 -0.00241 -0.00086 0.00011 236 4XZ -0.01112 0.00399 -0.00139 0.00082 -0.00088 237 4YZ -0.00081 -0.00116 0.00240 0.00238 0.00325 238 21 C 1S -0.00895 0.01351 -0.01048 0.07167 0.01632 239 2S 0.01101 -0.02865 0.00470 -0.13391 -0.00761 240 2PX 0.02502 -0.00853 0.01891 0.07028 0.05435 241 2PY -0.06440 0.03096 0.06705 -0.07423 -0.06144 242 2PZ 0.25416 -0.00332 0.04605 -0.06568 -0.01536 243 3S 0.19295 -0.09362 0.34547 -0.95515 -0.57596 244 3PX 0.05343 -0.20875 -0.05278 -0.06212 0.36548 245 3PY -0.08605 0.12646 0.06676 -0.34636 0.00915 246 3PZ 0.49351 0.03566 0.06812 -0.24113 0.04080 247 4XX 0.00233 0.00803 0.00757 0.01613 -0.00590 248 4YY -0.01586 -0.00159 -0.00706 -0.00082 0.00427 249 4ZZ 0.01239 -0.00227 -0.00145 -0.00381 0.00282 250 4XY -0.00126 -0.01436 0.00148 0.00919 0.01130 251 4XZ 0.00333 -0.00824 0.00051 0.00405 0.00703 252 4YZ 0.00875 -0.00103 -0.00291 -0.00095 0.00326 253 22 H 1S -0.01608 -0.02387 -0.02672 0.03812 0.03279 254 2S -0.30439 -0.08658 -0.34126 0.91026 0.26265 255 23 H 1S -0.01123 0.00272 -0.03498 -0.04077 0.02839 256 2S -0.15767 0.03606 -0.75176 -0.75564 0.89658 257 24 H 1S 0.00479 0.03049 -0.00351 -0.03884 -0.02832 258 2S 0.08808 0.54090 -0.12184 -0.97764 -0.60094 259 25 H 1S 0.01710 0.01900 0.02277 0.01024 -0.00512 260 2S 0.26442 0.24872 0.56055 0.35461 -0.34437 261 26 H 1S 0.01608 -0.02778 0.03063 0.06498 -0.00315 262 2S 0.22387 -0.58323 0.72793 0.85079 -0.08838 263 27 H 1S -0.00221 0.00430 0.02364 -0.00983 -0.03920 264 2S -0.13173 0.03168 0.43526 0.06759 -0.78473 81 82 83 84 85 V V V V V Eigenvalues -- 0.15352 0.16830 0.17604 0.18029 0.18940 1 1 C 1S 0.02536 -0.01366 0.03069 0.02973 -0.02198 2 2S -0.05080 0.01879 -0.02357 -0.04926 0.05031 3 2PX 0.00239 0.08114 0.01033 -0.06335 0.02446 4 2PY -0.04344 0.01988 -0.01063 -0.06697 0.03351 5 2PZ -0.05411 0.02014 0.01409 -0.07598 0.05003 6 3S -0.24625 0.38725 -0.52043 -0.33433 0.20063 7 3PX 0.38231 0.44550 0.11780 -0.23614 0.00984 8 3PY -0.20499 0.09324 -0.00093 -0.15157 0.17179 9 3PZ -0.20773 0.12599 0.00692 -0.12575 0.17632 10 4XX 0.01573 0.01401 0.01040 -0.00437 0.00259 11 4YY -0.00488 -0.01966 -0.00355 0.01325 -0.01130 12 4ZZ -0.00480 0.00289 0.00148 -0.00008 0.00340 13 4XY 0.00984 0.00611 -0.00380 -0.00073 -0.00239 14 4XZ 0.00165 0.00974 -0.00697 0.00142 -0.00011 15 4YZ -0.00411 -0.00862 -0.00036 0.00880 -0.00492 16 2 C 1S -0.05798 -0.00883 -0.00667 -0.00546 0.03625 17 2S 0.09242 -0.00678 0.01284 0.02027 -0.05833 18 2PX 0.00048 0.09819 0.08171 -0.03679 0.08078 19 2PY -0.08517 -0.06355 -0.03561 -0.00116 -0.03900 20 2PZ 0.03283 -0.15234 0.04353 -0.01277 -0.05380 21 3S 1.01091 0.40396 -0.00708 0.12023 -0.42389 22 3PX 0.02347 0.12170 0.37442 -0.13967 0.14481 23 3PY -0.21683 -0.55098 0.11354 0.01675 -0.09578 24 3PZ 0.16247 -0.46696 0.06991 0.03509 -0.32460 25 4XX 0.00248 -0.00125 -0.00446 -0.00020 0.00286 26 4YY -0.01203 -0.01071 -0.00439 0.00685 -0.00209 27 4ZZ 0.00090 0.01084 0.00640 -0.00725 0.00664 28 4XY -0.00594 0.00444 0.00467 -0.00162 0.00633 29 4XZ -0.00297 -0.00636 0.00752 -0.00406 0.00395 30 4YZ -0.01215 -0.01234 0.00875 -0.00471 0.01083 31 3 H 1S -0.03204 0.04070 0.01081 -0.02373 0.06042 32 2S -0.43986 0.70949 0.00850 -0.13030 0.68216 33 4 Br 1S -0.00106 -0.00314 0.00319 -0.00392 -0.00045 34 2S 0.00876 0.02558 -0.02587 0.03089 0.00259 35 3S -0.01390 -0.03994 0.04029 -0.04663 -0.00226 36 4S -0.01356 -0.04098 0.04144 -0.05207 -0.00734 37 5S 0.08070 0.26650 -0.29327 0.32938 -0.01092 38 6S -0.12528 -0.46324 0.53728 -0.59338 0.03998 39 7PX -0.00297 0.00051 -0.00157 -0.00285 0.00266 40 7PY 0.00026 0.00181 0.00123 -0.00699 -0.00089 41 7PZ 0.00572 -0.00066 0.00590 -0.01068 -0.00193 42 8PX 0.00946 -0.00165 0.00501 0.00893 -0.00846 43 8PY -0.00072 -0.00551 -0.00396 0.02204 0.00268 44 8PZ -0.01800 0.00211 -0.01844 0.03357 0.00631 45 9PX -0.02870 0.00457 -0.01534 -0.01981 0.02419 46 9PY -0.00336 0.00351 0.01424 -0.05567 -0.00087 47 9PZ 0.04335 -0.00783 0.03804 -0.07805 -0.02607 48 10PX 0.03584 0.00815 -0.00576 -0.00826 -0.02425 49 10PY 0.00771 0.04262 -0.01873 0.01171 -0.00938 50 10PZ 0.02112 0.05771 0.02525 -0.03049 0.04703 51 11XX 0.00817 0.02335 -0.01469 0.01764 -0.00177 52 11YY -0.00033 -0.00117 -0.01946 0.03051 0.00174 53 11ZZ 0.01238 0.03591 -0.02420 0.01894 0.00286 54 11XY 0.00026 0.01140 -0.00004 -0.00113 0.00487 55 11XZ 0.00239 0.00811 -0.00498 -0.00448 0.00425 56 11YZ -0.00031 0.00523 -0.02022 0.01778 -0.01056 57 12XX 0.03450 0.10109 -0.14506 0.15344 -0.00140 58 12YY 0.06251 0.18324 -0.12271 0.10224 -0.01870 59 12ZZ 0.01584 0.06367 -0.10716 0.14547 -0.01430 60 12XY -0.00553 -0.04821 0.00521 0.00616 -0.01580 61 12XZ -0.00581 -0.02765 0.01387 0.01946 -0.01996 62 12YZ -0.00134 -0.02782 0.07929 -0.06617 0.04019 63 5 C 1S 0.00792 0.04578 -0.00879 -0.00744 -0.01741 64 2S 0.01513 -0.01587 0.06901 -0.01159 0.00156 65 2PX -0.20634 -0.07258 -0.02245 -0.01212 0.04581 66 2PY -0.08185 0.00045 0.05345 -0.02687 0.08563 67 2PZ -0.02567 0.01542 -0.05193 0.03853 -0.02716 68 3S -0.25743 -1.09659 -0.16168 0.61449 0.87208 69 3PX -0.36160 -0.32669 0.07396 -0.17225 -0.25623 70 3PY -0.15767 -0.15324 0.35552 -0.32193 -0.31292 71 3PZ -0.08996 -0.26280 0.12680 -0.11373 -0.13654 72 4XX -0.00124 -0.00647 -0.00366 -0.00224 -0.00532 73 4YY 0.00980 -0.00338 0.00513 -0.00203 0.00004 74 4ZZ -0.00810 0.01806 0.00264 0.00704 0.01047 75 4XY 0.00963 0.00229 0.00944 0.00390 0.00469 76 4XZ 0.00696 0.00069 -0.00397 0.00498 -0.00617 77 4YZ 0.01141 -0.00251 -0.00764 0.00722 -0.01150 78 6 C 1S 0.00591 -0.04520 0.03673 -0.04591 0.01126 79 2S 0.01014 0.11514 -0.04648 0.12243 0.04351 80 2PX 0.06776 0.08800 0.09796 0.01735 0.02364 81 2PY -0.12770 -0.02468 -0.07566 0.00904 -0.02283 82 2PZ 0.03486 -0.00082 0.07429 -0.08454 -0.01255 83 3S -0.25558 0.47471 -0.38393 0.21546 -0.92618 84 3PX 0.11391 0.27110 0.13952 0.06402 0.24520 85 3PY -0.29236 0.09372 -0.18811 0.15816 0.34728 86 3PZ 0.09415 -0.20732 0.58681 -0.72160 -0.39562 87 4XX -0.00373 -0.00220 -0.00488 -0.00194 0.00152 88 4YY -0.01148 0.00329 0.00779 -0.00883 0.00047 89 4ZZ 0.01522 -0.00384 0.00630 0.00327 -0.00300 90 4XY -0.00101 0.01103 0.01613 -0.00692 -0.00032 91 4XZ -0.00981 -0.00810 0.00186 -0.00488 0.00299 92 4YZ -0.00409 -0.00431 0.01017 -0.00712 0.00761 93 7 C 1S 0.00438 0.02316 -0.06180 0.07297 0.03440 94 2S 0.00055 0.00029 0.14855 -0.13044 -0.08013 95 2PX -0.09465 -0.01577 -0.01451 0.02204 0.05803 96 2PY 0.00693 0.01768 0.02893 0.01343 0.09235 97 2PZ -0.08033 0.12755 -0.07443 0.08579 0.07972 98 3S 0.00830 -0.49407 0.82575 -0.91875 0.08290 99 3PX -0.17731 -0.14507 -0.15524 0.11261 0.31206 100 3PY 0.11706 -0.00192 0.05672 0.12734 0.52784 101 3PZ -0.21339 0.42118 -0.52970 0.68743 0.73262 102 4XX 0.00363 0.00299 -0.00008 0.00195 -0.00152 103 4YY 0.00505 0.00570 -0.00748 0.01106 0.00398 104 4ZZ -0.00256 0.00211 0.00703 0.00188 0.01058 105 4XY 0.00673 0.00504 -0.00138 0.00966 0.00605 106 4XZ 0.00507 0.00608 0.00323 -0.00316 -0.00489 107 4YZ -0.00058 0.00522 -0.00072 -0.00548 -0.01123 108 8 C 1S -0.04138 0.04001 0.01761 -0.04741 -0.07691 109 2S 0.05721 -0.04395 -0.02260 0.10693 0.17703 110 2PX -0.00352 0.09492 0.06667 -0.01564 -0.01509 111 2PY -0.19592 0.01836 -0.01867 -0.02830 -0.06523 112 2PZ -0.05178 -0.03275 0.05084 -0.05526 0.00399 113 3S 0.89178 -0.73282 -0.11402 0.39576 0.62926 114 3PX -0.08149 0.19766 0.17813 -0.25236 -0.45542 115 3PY -0.45909 0.12834 0.10517 -0.38035 -0.78745 116 3PZ -0.08655 -0.22563 0.28664 -0.32567 -0.14830 117 4XX -0.00718 -0.00075 -0.00142 0.00127 0.00474 118 4YY -0.00095 0.00358 0.00655 -0.00241 0.00513 119 4ZZ 0.00579 0.00660 0.00312 -0.00648 -0.02296 120 4XY -0.00346 -0.00115 0.00277 -0.00254 -0.00040 121 4XZ -0.00018 -0.00142 -0.00386 0.00444 -0.00148 122 4YZ 0.00074 0.00111 -0.00614 0.00796 0.00192 123 9 C 1S 0.00281 -0.06549 0.02774 0.00016 0.07364 124 2S 0.00218 0.10685 -0.01216 -0.02101 -0.15788 125 2PX -0.08282 -0.08777 -0.00993 0.01693 0.04033 126 2PY 0.01776 -0.05115 0.04052 0.01382 0.09946 127 2PZ 0.01683 0.09757 -0.05566 0.02215 -0.03349 128 3S -0.04010 1.35263 -0.77411 0.42349 -0.52554 129 3PX -0.10489 -0.28843 -0.11583 0.17114 0.36544 130 3PY 0.15570 -0.24390 -0.00402 0.28673 0.70400 131 3PZ 0.19661 0.30594 -0.14887 -0.05323 -0.59803 132 4XX 0.00343 0.00143 0.00441 -0.00289 0.00030 133 4YY 0.00157 -0.00295 0.00325 -0.00262 0.00075 134 4ZZ -0.00278 -0.00246 -0.00196 0.00995 0.01553 135 4XY 0.00449 0.00325 0.00323 0.00033 0.00669 136 4XZ -0.00225 -0.00447 0.00008 0.00033 0.00665 137 4YZ 0.00334 -0.00425 0.00373 -0.00046 0.00980 138 10 C 1S 0.03616 -0.00869 -0.03359 0.02469 -0.04614 139 2S -0.03904 0.02799 0.07879 -0.00971 0.13559 140 2PX 0.03898 0.13182 0.06288 -0.00115 0.04485 141 2PY -0.11173 0.02425 -0.03597 -0.00553 -0.02783 142 2PZ -0.12264 -0.01112 0.02608 -0.03120 0.08610 143 3S -0.67481 0.23702 0.63097 -0.77866 -0.01048 144 3PX 0.08295 0.41622 -0.00828 0.03736 0.09595 145 3PY -0.20449 0.43701 -0.18779 0.06901 0.05937 146 3PZ -0.34777 -0.11525 0.05319 0.16713 0.89860 147 4XX -0.00080 0.00290 -0.00126 0.00129 0.00198 148 4YY -0.00438 0.01044 -0.00091 0.00143 -0.00365 149 4ZZ 0.01469 -0.00759 0.00628 -0.00014 -0.00766 150 4XY -0.00142 0.00873 0.00180 -0.00081 -0.00833 151 4XZ 0.00495 0.00623 0.00583 -0.00154 -0.00109 152 4YZ -0.00933 0.00096 -0.00045 -0.00361 -0.00203 153 11 H 1S 0.04969 -0.02137 -0.00240 0.00214 -0.06801 154 2S 0.79662 -0.17929 -0.33407 0.18645 -1.02215 155 12 H 1S -0.00661 -0.01653 0.00186 0.01545 0.04512 156 2S -0.10173 -1.06626 0.39993 0.11509 1.27912 157 13 H 1S -0.03776 0.01410 0.01453 -0.02678 -0.03180 158 2S -0.97974 0.50437 0.31993 -0.72782 -1.18677 159 14 H 1S -0.00716 0.02268 -0.01394 0.03208 0.03906 160 2S -0.30436 0.65674 -0.89630 1.11953 0.93811 161 15 H 1S 0.04026 0.00555 0.03022 -0.02011 -0.03559 162 2S 0.40525 -0.51121 0.70041 -0.79562 -0.22341 163 16 C 1S 0.02945 0.02011 -0.01577 -0.00003 -0.00510 164 2S -0.02405 -0.03235 -0.01208 -0.01885 0.00907 165 2PX -0.00372 0.08387 -0.01921 -0.10709 0.07378 166 2PY 0.03665 0.04823 0.06905 -0.00258 0.02757 167 2PZ 0.03724 -0.00786 0.04571 -0.00094 0.00591 168 3S -0.82981 -0.25719 0.72360 0.45748 0.10974 169 3PX -0.04813 0.28496 0.19119 0.01658 0.06962 170 3PY -0.13823 -0.10214 -0.08949 -0.27023 0.20335 171 3PZ -0.03745 -0.12624 -0.08358 -0.09711 0.06204 172 4XX -0.00893 -0.01112 -0.00598 0.01525 -0.00756 173 4YY 0.01059 0.01425 0.00769 -0.00252 0.00379 174 4ZZ 0.00153 0.00316 -0.00226 -0.00368 0.00249 175 4XY 0.00768 -0.00274 0.00650 0.01153 -0.00657 176 4XZ 0.00555 -0.00065 0.00415 0.00637 -0.00368 177 4YZ 0.00316 0.00969 0.00530 0.00013 0.00306 178 17 C 1S -0.03873 -0.05891 -0.04630 0.00218 -0.02631 179 2S 0.06380 0.11556 0.10756 0.04350 0.03251 180 2PX -0.02761 -0.05545 -0.07594 -0.02796 -0.03121 181 2PY 0.01743 -0.02214 -0.07715 -0.01010 -0.03171 182 2PZ 0.02314 0.02356 0.00894 -0.03446 0.00340 183 3S 0.62389 0.77843 0.25296 -0.60123 0.65352 184 3PX -0.09494 -0.26584 -0.59881 -0.44921 0.07176 185 3PY -0.04753 -0.24171 -0.41411 -0.20276 -0.08664 186 3PZ -0.04225 -0.07773 -0.19520 -0.10949 -0.03060 187 4XX 0.00295 -0.00240 -0.01137 -0.00466 0.00036 188 4YY -0.00857 -0.00560 -0.00423 0.00238 -0.00118 189 4ZZ -0.00088 -0.00062 0.00328 0.00346 -0.00103 190 4XY -0.00383 0.00814 0.00156 -0.00714 0.00670 191 4XZ -0.00040 0.00495 0.00261 -0.00377 0.00338 192 4YZ -0.00426 -0.00680 -0.00514 -0.00061 -0.00140 193 18 C 1S 0.00983 0.03718 0.07496 0.03619 0.01009 194 2S -0.00370 -0.07376 -0.15384 -0.08498 -0.00878 195 2PX 0.04280 0.03125 -0.03681 -0.05372 0.02870 196 2PY 0.04281 -0.00638 0.09560 0.09850 -0.03298 197 2PZ 0.02011 -0.02449 0.03256 0.06552 -0.02686 198 3S -0.30971 -0.46456 -0.82222 -0.18135 -0.34120 199 3PX 0.25616 0.24451 -0.01832 -0.18478 0.16345 200 3PY 0.04601 0.11367 0.68913 0.68360 -0.20849 201 3PZ 0.02381 0.01984 0.34860 0.38603 -0.12953 202 4XX -0.00338 0.00616 0.01845 0.01199 0.00052 203 4YY 0.00198 -0.00036 -0.00381 -0.00097 -0.00139 204 4ZZ 0.00266 0.00059 -0.00197 -0.00411 0.00103 205 4XY -0.00576 -0.00606 0.00360 0.00706 -0.00413 206 4XZ -0.00358 -0.00457 -0.00034 0.00441 -0.00296 207 4YZ 0.00098 0.00212 0.00195 0.00058 -0.00074 208 19 C 1S 0.04196 -0.00294 -0.06450 -0.05596 0.01486 209 2S -0.06911 0.01272 0.14265 0.13053 -0.03624 210 2PX -0.06098 -0.00916 -0.00706 0.01780 -0.02722 211 2PY 0.00686 -0.03765 -0.04170 -0.01899 -0.00283 212 2PZ 0.00239 -0.00531 -0.01049 -0.01935 0.00533 213 3S -0.66188 -0.07410 0.60170 0.44251 -0.12240 214 3PX -0.26723 0.02684 0.30650 0.43020 -0.23935 215 3PY 0.00762 -0.16842 -0.42487 -0.35463 0.06477 216 3PZ 0.00489 -0.06576 -0.21730 -0.21339 0.05019 217 4XX -0.00061 -0.01051 -0.01299 -0.00238 -0.00493 218 4YY 0.00584 0.00692 -0.00260 -0.01013 0.00686 219 4ZZ 0.00203 0.00262 0.00317 0.00112 0.00073 220 4XY 0.00167 -0.00239 -0.01305 -0.00932 0.00240 221 4XZ 0.00112 0.00024 -0.00513 -0.00565 0.00202 222 4YZ 0.00376 0.00383 -0.00444 -0.00946 0.00543 223 20 C 1S -0.05830 -0.02612 0.01953 0.04559 -0.02683 224 2S 0.10265 0.03849 -0.06169 -0.11536 0.05818 225 2PX 0.05605 -0.01785 -0.07247 -0.05114 0.02210 226 2PY 0.02550 0.01116 0.04445 0.02283 -0.00826 227 2PZ 0.01430 -0.00416 0.01861 0.01992 -0.00785 228 3S 1.00670 0.56771 0.16149 -0.15459 0.21737 229 3PX 0.30707 -0.13359 -0.60517 -0.60482 0.22523 230 3PY 0.07999 0.11852 0.09722 -0.10008 0.07620 231 3PZ 0.04786 0.04071 0.05188 -0.02680 0.02417 232 4XX -0.00021 0.00027 -0.00296 0.00109 -0.00153 233 4YY -0.00591 -0.00171 0.00899 0.00867 -0.00321 234 4ZZ -0.00137 -0.00153 -0.00058 -0.00058 -0.00003 235 4XY 0.00201 0.00481 0.00819 -0.00038 0.00402 236 4XZ 0.00122 0.00231 0.00444 -0.00011 0.00238 237 4YZ -0.00454 -0.00108 0.00711 0.00844 -0.00333 238 21 C 1S 0.00884 0.03963 0.01407 -0.04798 0.03766 239 2S -0.02767 -0.05873 0.00795 0.11479 -0.07194 240 2PX -0.05067 -0.01165 -0.00687 -0.01498 -0.00417 241 2PY 0.01345 -0.04697 0.01076 0.06571 -0.03851 242 2PZ 0.00412 -0.01712 0.00959 0.02699 -0.01883 243 3S 0.08126 -0.74697 -0.69504 0.30298 -0.49738 244 3PX -0.46599 -0.15621 0.03302 -0.02481 0.07625 245 3PY 0.00697 -0.02517 0.31817 0.54053 -0.26354 246 3PZ -0.00590 0.02914 0.19094 0.27254 -0.12226 247 4XX 0.00797 0.00556 0.00450 -0.00769 0.00499 248 4YY -0.00222 0.00008 -0.00567 -0.00529 0.00215 249 4ZZ -0.00181 0.00088 0.00098 0.00227 -0.00080 250 4XY -0.01439 -0.00521 -0.00293 -0.00195 0.00179 251 4XZ -0.00865 -0.00212 -0.00226 -0.00065 0.00095 252 4YZ -0.00129 0.00205 -0.00537 -0.00742 0.00379 253 22 H 1S -0.01873 0.01742 -0.02990 -0.06551 0.04162 254 2S 0.01377 0.42383 -0.13139 -0.84543 0.55813 255 23 H 1S -0.02338 -0.00224 0.03291 0.04540 -0.01845 256 2S -0.75802 -0.13361 0.53866 0.75239 -0.36934 257 24 H 1S 0.02235 -0.00854 -0.02850 -0.02718 0.00549 258 2S 0.53377 -0.12611 -0.79057 -0.77805 0.27875 259 25 H 1S 0.00612 0.01610 0.04456 0.03384 -0.00752 260 2S 0.24341 0.32483 1.17632 0.90886 -0.11577 261 26 H 1S -0.01848 -0.02066 -0.06968 -0.03975 0.00145 262 2S -0.40662 -0.72760 -0.96995 -0.34703 -0.25575 263 27 H 1S 0.02290 -0.03753 -0.01320 0.06837 -0.06140 264 2S 0.35506 -0.43278 0.14079 0.62737 -0.45322 86 87 88 89 90 V V V V V Eigenvalues -- 0.19541 0.21359 0.23943 0.26399 0.27087 1 1 C 1S 0.04842 -0.09728 -0.00595 0.01176 0.01233 2 2S -0.03088 0.13834 -0.01183 -0.06660 -0.02316 3 2PX -0.05523 -0.18823 -0.12607 0.01069 0.00556 4 2PY 0.05264 -0.06748 0.03388 0.02684 -0.03326 5 2PZ 0.01936 0.00632 0.03388 0.08185 0.04839 6 3S -1.40267 1.87910 0.35049 -0.19744 -0.23521 7 3PX -0.61282 -0.58257 -0.52792 -0.41089 0.24292 8 3PY 0.37388 -0.28893 0.29873 -0.15250 0.04670 9 3PZ 0.29718 -0.15791 0.13013 -0.05964 0.06592 10 4XX 0.00585 -0.03048 -0.01938 0.00189 0.00958 11 4YY 0.00371 0.01289 0.00986 -0.00494 -0.00725 12 4ZZ -0.00179 0.00450 0.00760 -0.00563 -0.00319 13 4XY -0.03297 0.00124 0.00137 -0.00673 -0.00711 14 4XZ -0.01654 0.00052 0.00060 -0.00894 -0.00683 15 4YZ 0.00134 -0.00095 0.00241 -0.00961 -0.01230 16 2 C 1S 0.04654 0.06754 -0.01715 -0.00001 0.00145 17 2S -0.01716 -0.09520 0.03644 0.00010 0.00297 18 2PX 0.14464 -0.26611 -0.17651 0.01348 0.06845 19 2PY 0.11122 0.10916 -0.11316 0.08857 0.05258 20 2PZ 0.00801 0.03627 -0.04784 0.08350 0.03890 21 3S -1.29682 -1.17833 0.24135 -0.35422 -0.07392 22 3PX 0.64668 -1.04728 -0.79859 -0.11000 0.24640 23 3PY 0.71938 0.30870 -0.62937 0.08370 0.14593 24 3PZ 0.17484 0.17251 -0.16843 0.29176 0.20820 25 4XX -0.00145 0.02481 0.00572 -0.00529 0.00008 26 4YY 0.02564 0.00762 -0.00951 0.00146 0.00663 27 4ZZ -0.01275 -0.02207 0.00430 0.00491 0.00111 28 4XY 0.03035 -0.01178 -0.00770 0.00091 0.00512 29 4XZ 0.01774 -0.00106 -0.00261 0.00985 0.00935 30 4YZ 0.00927 0.00486 -0.00892 -0.00312 -0.00217 31 3 H 1S -0.05892 -0.03124 -0.01410 -0.05893 -0.05130 32 2S 0.12799 -0.25709 -0.07379 -0.45716 -0.23734 33 4 Br 1S -0.00020 0.00323 0.00332 0.01426 0.01273 34 2S 0.00151 -0.02641 -0.02669 -0.11580 -0.10379 35 3S -0.00210 0.04147 0.04113 0.18075 0.16283 36 4S -0.00287 0.04219 0.04405 0.18692 0.16608 37 5S 0.03186 -0.29889 -0.32135 -1.43287 -1.30146 38 6S -0.09300 0.54390 0.63364 2.69832 2.44578 39 7PX -0.00097 0.00330 -0.00158 0.00063 0.00307 40 7PY -0.00615 -0.00052 0.00012 -0.00692 -0.00932 41 7PZ -0.00681 -0.00230 0.00109 0.00582 0.00528 42 8PX 0.00285 -0.01035 0.00514 -0.00189 -0.00974 43 8PY 0.01923 0.00147 -0.00027 0.02192 0.02948 44 8PZ 0.02135 0.00718 -0.00339 -0.01840 -0.01669 45 9PX 0.00457 0.02167 -0.02056 0.00046 0.02609 46 9PY -0.03885 0.00475 -0.00507 -0.05560 -0.07441 47 9PZ -0.04582 -0.01369 0.00470 0.04619 0.04217 48 10PX -0.10428 0.06131 0.07228 0.02592 -0.01066 49 10PY -0.03519 -0.04472 -0.00607 -0.06504 -0.04024 50 10PZ -0.07451 -0.03183 0.07443 0.03047 0.01136 51 11XX 0.00251 -0.03619 -0.02802 -0.09576 -0.08642 52 11YY 0.02821 0.00354 -0.03103 -0.08515 -0.07001 53 11ZZ -0.02773 -0.02770 -0.00051 -0.08059 -0.07923 54 11XY 0.00569 -0.01585 -0.01086 -0.01172 -0.00738 55 11XZ -0.02662 0.01789 0.01159 -0.00022 -0.00335 56 11YZ 0.00182 0.00883 -0.00253 -0.01327 -0.01245 57 12XX -0.00082 -0.06252 -0.10136 -0.56275 -0.50986 58 12YY -0.08311 -0.21515 -0.08783 -0.58252 -0.56390 59 12ZZ 0.11429 -0.10137 -0.19661 -0.62120 -0.54203 60 12XY -0.00570 0.04843 0.03148 0.04594 0.03163 61 12XZ 0.09103 -0.06133 -0.03675 0.00278 0.01321 62 12YZ -0.00451 -0.03594 -0.00021 0.04280 0.04404 63 5 C 1S -0.09568 -0.04467 0.06879 0.03749 0.02217 64 2S 0.19967 0.04879 -0.06198 -0.10860 -0.03326 65 2PX 0.08543 0.17537 0.07464 0.03262 0.09731 66 2PY 0.15662 -0.10923 -0.13794 0.05421 0.05211 67 2PZ 0.06232 0.00142 -0.02200 0.08965 0.06982 68 3S 1.28575 0.72435 -1.31428 -0.84593 -0.51880 69 3PX 0.49238 0.42213 -0.14328 0.28616 0.20005 70 3PY 0.87411 -0.23975 -0.51059 0.34458 0.37099 71 3PZ 0.36310 0.09031 -0.20956 0.34382 0.32675 72 4XX -0.00152 -0.01356 -0.00964 -0.00235 -0.00269 73 4YY -0.00246 0.00139 0.01674 -0.00499 0.00303 74 4ZZ -0.00280 -0.00634 0.01084 -0.00033 0.00800 75 4XY -0.00282 -0.01071 0.01008 -0.00564 -0.00551 76 4XZ -0.00062 -0.00284 0.00343 -0.00600 -0.00436 77 4YZ -0.00046 0.00405 0.00590 -0.00955 -0.00707 78 6 C 1S 0.02121 -0.00069 -0.03338 -0.03410 -0.02010 79 2S -0.04288 0.02151 0.10239 0.01907 -0.00220 80 2PX 0.04729 -0.02188 0.00803 0.03038 0.03870 81 2PY -0.03080 0.00894 -0.02275 -0.02119 0.01333 82 2PZ -0.07189 -0.03782 0.06060 -0.01971 0.00007 83 3S 0.11683 0.10621 0.28143 0.67121 0.49405 84 3PX -0.20582 -0.25951 0.04462 0.32217 0.13785 85 3PY -0.43010 -0.07691 0.20279 0.49580 0.32502 86 3PZ 0.01959 -0.13602 0.03493 0.44861 0.32126 87 4XX -0.00219 -0.00994 -0.00297 -0.00053 0.00596 88 4YY 0.00167 0.00440 0.00695 0.01123 0.00955 89 4ZZ 0.01008 0.00999 -0.00337 -0.02401 -0.02015 90 4XY 0.00458 0.00301 0.00333 0.00544 -0.00167 91 4XZ 0.00595 0.01303 -0.00019 0.00143 0.00616 92 4YZ 0.01093 -0.00428 -0.01550 0.00469 0.00384 93 7 C 1S 0.01587 0.00656 -0.00447 -0.00229 -0.00078 94 2S 0.02244 0.05330 -0.00265 0.01095 -0.04805 95 2PX 0.01605 0.07414 -0.01234 0.06493 -0.01630 96 2PY 0.06579 -0.02996 -0.05052 0.05499 0.06611 97 2PZ 0.02957 -0.01272 0.01040 0.05450 0.02091 98 3S -0.92363 -0.42863 0.42540 0.38079 0.26899 99 3PX -0.00520 0.01156 -0.09286 0.07289 0.11065 100 3PY 0.09835 -0.14131 -0.24657 0.12412 0.09333 101 3PZ -0.28824 -0.22705 0.34432 0.43244 0.25055 102 4XX 0.00386 0.00086 0.00032 0.00392 0.00281 103 4YY -0.00343 0.00474 0.00499 0.00675 -0.00414 104 4ZZ -0.00133 0.00716 -0.00101 -0.00125 -0.00944 105 4XY -0.00344 0.00087 0.00736 0.00768 0.00029 106 4XZ -0.00492 -0.00259 0.00742 0.00417 0.00202 107 4YZ -0.01079 -0.00356 0.01169 0.00589 0.00253 108 8 C 1S -0.01145 -0.00313 0.02342 0.00877 0.00405 109 2S -0.00601 0.01692 -0.01195 0.01003 -0.01984 110 2PX 0.05760 -0.00208 -0.05437 -0.03669 -0.04516 111 2PY 0.05478 0.07174 -0.07061 -0.07096 -0.04208 112 2PZ -0.01710 0.00836 -0.01707 -0.02480 -0.01680 113 3S 0.65237 0.16264 -0.77067 -0.30255 -0.11862 114 3PX 0.31769 0.07829 -0.29785 -0.28530 -0.16411 115 3PY 0.46933 0.32586 -0.43178 -0.44600 -0.27185 116 3PZ -0.03031 0.04978 -0.09339 -0.19277 -0.15596 117 4XX -0.00255 0.00328 0.00068 0.00360 -0.00055 118 4YY 0.00223 -0.00179 -0.00199 0.00330 0.00112 119 4ZZ 0.00189 0.00468 0.00446 -0.00247 -0.00561 120 4XY 0.00240 0.00410 -0.00159 0.00232 -0.00212 121 4XZ 0.00333 0.00171 0.00021 0.00410 0.00518 122 4YZ 0.00429 0.00162 -0.00169 0.00580 0.00465 123 9 C 1S -0.02874 -0.00578 -0.00312 -0.01900 -0.01693 124 2S 0.08200 0.04473 -0.00739 0.03013 0.00671 125 2PX 0.00424 0.05836 0.00717 0.04298 0.01626 126 2PY 0.02803 -0.01972 -0.02765 0.03391 0.04191 127 2PZ 0.05510 -0.00134 -0.04448 -0.01417 -0.00209 128 3S -0.04772 -0.16873 0.38724 0.48062 0.39527 129 3PX -0.10302 0.07106 0.03728 0.08889 0.11028 130 3PY -0.14647 -0.13100 0.00316 0.15322 0.15238 131 3PZ 0.55979 0.15161 -0.42216 -0.15345 -0.08914 132 4XX -0.00112 -0.00120 0.00076 -0.00095 -0.00276 133 4YY -0.01135 -0.00111 0.01092 0.00519 -0.00021 134 4ZZ 0.00579 0.00653 -0.00893 -0.00318 -0.00377 135 4XY -0.00973 -0.00432 0.00820 0.00091 -0.00342 136 4XZ -0.00265 -0.00027 -0.00121 -0.00331 -0.00307 137 4YZ -0.00290 -0.00018 -0.00060 -0.00449 -0.00385 138 10 C 1S 0.05956 0.02757 -0.02553 0.00498 0.00810 139 2S -0.10820 -0.02871 0.07592 -0.00261 -0.01800 140 2PX 0.01745 -0.05469 -0.01157 -0.00853 -0.00920 141 2PY -0.01306 0.00751 0.00527 0.05190 0.06639 142 2PZ -0.04673 0.00916 -0.04148 -0.10945 -0.06385 143 3S -0.62773 -0.42368 0.28212 -0.20108 -0.21082 144 3PX -0.14851 -0.34543 0.04339 0.09168 0.07619 145 3PY -0.26903 -0.10511 0.25864 0.19185 0.14685 146 3PZ -0.58622 0.05039 0.07641 -0.42988 -0.30741 147 4XX 0.00238 0.00110 0.00187 0.00352 0.00620 148 4YY 0.01113 0.00284 -0.00438 0.00518 0.00228 149 4ZZ -0.00177 0.00396 0.00586 -0.01064 -0.01055 150 4XY 0.00932 0.00402 0.00078 0.00471 0.00504 151 4XZ -0.00380 -0.01361 -0.00074 0.00518 0.00065 152 4YZ -0.00869 0.00256 0.01370 0.00756 0.00873 153 11 H 1S 0.01936 0.01402 0.01510 -0.00069 -0.00279 154 2S 0.90789 0.21263 -0.19041 0.46740 0.32956 155 12 H 1S -0.02252 -0.01226 0.01250 0.01323 0.00949 156 2S -0.52816 -0.12868 0.17739 0.08697 0.07291 157 13 H 1S 0.02587 0.00843 -0.02039 0.00749 0.00827 158 2S 0.35852 0.27488 -0.32429 -0.45286 -0.29243 159 14 H 1S -0.02055 -0.00185 0.01871 0.02838 0.00499 160 2S 0.11319 -0.11156 0.08801 0.41785 0.24799 161 15 H 1S -0.00654 0.02310 0.03125 -0.05571 -0.05684 162 2S 0.20805 -0.02906 -0.17052 -0.41867 -0.28767 163 16 C 1S -0.09081 0.05308 -0.08661 0.00111 0.00600 164 2S 0.15831 -0.11411 0.10587 -0.04164 -0.02219 165 2PX -0.05246 0.02760 0.06435 0.10408 -0.10355 166 2PY 0.08272 -0.05815 -0.15880 0.15450 -0.05126 167 2PZ 0.02606 -0.04820 -0.06827 0.09298 -0.02179 168 3S 1.67975 -0.66531 1.91503 -0.06824 -0.21855 169 3PX -0.37669 0.20692 0.03085 0.51861 -0.48491 170 3PY 0.61086 -0.25193 -0.43206 1.01681 -0.24753 171 3PZ 0.34317 -0.16081 -0.21619 0.49160 -0.18053 172 4XX -0.00823 0.02663 0.00125 -0.00718 -0.02107 173 4YY -0.00472 -0.01896 -0.01790 -0.00699 0.00744 174 4ZZ 0.00230 -0.00498 -0.00055 -0.00066 0.00518 175 4XY 0.00102 -0.00195 0.00208 0.00684 -0.00060 176 4XZ 0.00056 -0.00450 0.00144 0.00145 -0.00262 177 4YZ -0.00585 -0.00857 -0.01604 -0.00258 0.00716 178 17 C 1S 0.01198 -0.03710 0.04464 -0.00919 -0.02374 179 2S -0.04352 0.07146 -0.07218 -0.02953 0.05460 180 2PX -0.07150 -0.05601 -0.14202 -0.07819 0.17866 181 2PY -0.08107 -0.10918 -0.14803 0.05686 -0.01431 182 2PZ -0.04310 -0.07750 -0.07606 0.04363 -0.00950 183 3S 0.29413 0.49808 -0.74886 0.56020 0.32559 184 3PX 0.22656 -0.50341 -0.12701 -0.67792 1.09382 185 3PY -0.23429 -0.23823 -0.75999 0.83429 -0.33836 186 3PZ -0.12946 -0.09742 -0.41490 0.48559 -0.19018 187 4XX -0.00739 0.00300 -0.01975 0.01743 -0.01929 188 4YY 0.01228 -0.00345 0.02553 -0.01829 0.01209 189 4ZZ 0.00112 -0.00163 0.00595 -0.00549 0.00513 190 4XY 0.00013 0.00119 0.00845 -0.00757 0.00401 191 4XZ -0.00085 -0.00237 0.00582 -0.00451 0.00214 192 4YZ 0.00837 -0.00327 0.01844 -0.01052 0.00472 193 18 C 1S 0.01495 0.03295 0.03007 -0.04576 0.05378 194 2S 0.00967 -0.06206 -0.01401 0.04223 -0.05538 195 2PX -0.03311 0.03038 -0.08005 0.04030 -0.06251 196 2PY 0.00332 0.07248 -0.04468 0.09746 -0.12391 197 2PZ 0.00375 0.04430 -0.02239 0.04700 -0.06699 198 3S -0.79520 -0.43811 -1.07533 1.51507 -1.65571 199 3PX -0.15441 0.23159 -0.65294 0.15402 -0.03693 200 3PY -0.28571 0.47990 -0.39072 0.48989 -0.69799 201 3PZ -0.15310 0.24907 -0.19101 0.25207 -0.38382 202 4XX 0.00550 0.01203 0.01906 -0.02026 0.01604 203 4YY -0.00721 -0.00381 -0.01306 0.01101 -0.00652 204 4ZZ 0.00012 -0.00348 -0.00311 0.00407 -0.00242 205 4XY 0.00927 -0.01226 0.02546 0.00252 -0.01620 206 4XZ 0.00499 -0.00597 0.01336 0.00172 -0.00945 207 4YZ -0.00695 -0.00143 -0.00983 0.00636 -0.00305 208 19 C 1S -0.00799 0.01848 -0.04520 -0.00195 0.01254 209 2S -0.00566 -0.01662 0.05311 0.00163 -0.01300 210 2PX -0.11526 -0.00294 -0.23362 0.12636 -0.06822 211 2PY 0.05498 -0.10325 0.09646 0.10561 -0.13452 212 2PZ 0.03322 -0.05505 0.05716 0.06071 -0.06606 213 3S 0.43594 -0.60869 1.17908 0.09649 -0.33811 214 3PX -0.62612 0.00335 -1.09526 0.74541 -0.63743 215 3PY 0.27928 -0.52079 0.46320 0.63975 -0.99350 216 3PZ 0.16748 -0.28138 0.27603 0.33657 -0.52273 217 4XX -0.00313 -0.00615 -0.00539 0.02218 -0.03332 218 4YY 0.00299 0.00609 -0.00201 -0.01716 0.02814 219 4ZZ -0.00038 0.00162 -0.00019 -0.00519 0.00788 220 4XY -0.00134 0.00383 -0.00316 0.00018 -0.00518 221 4XZ -0.00083 0.00164 -0.00155 -0.00007 -0.00167 222 4YZ 0.00298 0.00276 -0.00162 -0.01133 0.01772 223 20 C 1S -0.01806 -0.02984 0.01179 0.03340 -0.06214 224 2S 0.06175 0.01756 -0.00591 -0.03034 0.07389 225 2PX 0.01969 0.11843 0.10358 0.03708 -0.16352 226 2PY 0.03520 -0.05703 0.04606 0.09948 -0.11820 227 2PZ 0.01815 -0.03777 0.02212 0.04875 -0.06321 228 3S -0.22663 0.88110 -0.45598 -1.16654 1.81987 229 3PX 0.40896 0.28033 0.55882 0.24299 -0.85367 230 3PY 0.24502 -0.32055 0.44061 0.41575 -0.50894 231 3PZ 0.12098 -0.18778 0.23150 0.21272 -0.26370 232 4XX -0.01173 0.01723 -0.01203 -0.01072 0.00672 233 4YY 0.00357 -0.01399 0.00963 0.01141 -0.01180 234 4ZZ 0.00358 -0.00477 0.00372 0.00359 -0.00202 235 4XY 0.01193 -0.00174 0.01825 -0.00686 0.01099 236 4XZ 0.00683 -0.00233 0.01020 -0.00418 0.00551 237 4YZ -0.00030 -0.00684 0.00465 0.00817 -0.00855 238 21 C 1S 0.04964 -0.01986 0.01749 0.01504 0.01346 239 2S -0.09815 0.04387 -0.04288 -0.00697 -0.03689 240 2PX 0.01715 -0.13197 0.01740 0.04014 -0.05003 241 2PY 0.01577 -0.11136 0.10155 -0.07720 0.09883 242 2PZ 0.00979 -0.04214 0.05852 -0.02551 0.06912 243 3S -0.56630 0.14752 -0.09029 -0.67832 -0.07876 244 3PX 0.37277 -0.23043 0.39209 0.59738 -0.70416 245 3PY -0.33934 -0.26081 0.14588 -0.45088 0.64553 246 3PZ -0.18826 -0.12982 0.06159 -0.24638 0.37822 247 4XX 0.01531 -0.02179 0.00906 0.01834 -0.01508 248 4YY -0.00473 0.00918 -0.00333 -0.01498 0.01362 249 4ZZ -0.00282 0.00549 -0.00239 -0.00417 0.00455 250 4XY 0.00352 0.00523 0.02161 0.00421 -0.01858 251 4XZ 0.00222 0.00470 0.01083 0.00188 -0.00964 252 4YZ -0.00047 0.00399 -0.00302 -0.00911 0.01035 253 22 H 1S 0.02513 0.06362 0.00264 -0.04540 0.03840 254 2S 0.51979 0.47047 -0.23119 0.53689 -0.51921 255 23 H 1S -0.02671 0.02197 -0.00334 -0.05749 0.06044 256 2S -0.45199 -0.50663 -0.55098 -0.14432 0.56126 257 24 H 1S 0.02456 -0.02399 0.02446 0.01180 -0.00876 258 2S 0.60627 -0.23497 0.89883 -0.11982 -0.13842 259 25 H 1S -0.02308 -0.00129 -0.04118 0.07070 -0.06335 260 2S -0.05378 0.75112 -0.21672 0.25990 -0.40367 261 26 H 1S -0.01202 -0.03120 -0.03276 0.02349 -0.03093 262 2S -0.09688 -0.88281 -0.33266 -0.40800 0.73951 263 27 H 1S -0.05860 -0.02665 0.05769 -0.04901 -0.07097 264 2S 0.08398 -0.21831 -0.02615 0.13610 -0.09624 91 92 93 94 95 V V V V V Eigenvalues -- 0.27940 0.28619 0.29193 0.30161 0.31824 1 1 C 1S -0.01308 0.01238 0.00113 0.00338 0.00425 2 2S -0.08484 0.02016 -0.02801 -0.01213 0.01074 3 2PX -0.08018 0.04586 0.00193 0.05524 -0.03244 4 2PY 0.13249 0.09923 0.04142 -0.08045 0.00908 5 2PZ 0.08399 -0.00518 0.01123 -0.03258 0.00044 6 3S 0.93353 -0.84774 0.03099 0.04445 -0.12299 7 3PX 0.49390 0.12513 0.04225 0.31837 -0.33768 8 3PY -0.04145 0.73356 0.09467 -0.09693 0.11914 9 3PZ -0.05701 0.40061 0.04888 -0.11555 -0.14962 10 4XX -0.00084 -0.03083 -0.00655 -0.00432 0.00693 11 4YY -0.00001 0.01641 0.00340 -0.00631 -0.00039 12 4ZZ -0.00443 0.01018 -0.00047 0.00472 -0.00140 13 4XY 0.00695 -0.01450 -0.00623 0.00610 0.00327 14 4XZ 0.00351 -0.00406 0.00284 0.00384 -0.01391 15 4YZ 0.00576 0.01414 0.00089 -0.00663 0.00185 16 2 C 1S 0.01405 -0.00030 0.00805 -0.02945 -0.00315 17 2S -0.10608 -0.09013 -0.03961 -0.04575 0.02656 18 2PX -0.00071 -0.08686 -0.00827 0.01866 0.01072 19 2PY 0.12772 0.11832 0.06746 0.05878 -0.01210 20 2PZ 0.07193 0.05758 -0.05820 0.05147 0.10757 21 3S 0.34926 0.43211 -0.00278 1.28344 0.07517 22 3PX -0.11407 0.47451 0.05455 -0.24155 -0.37438 23 3PY -0.12152 -0.00255 0.01232 -0.56783 -0.26072 24 3PZ 0.03020 0.04477 0.13374 -0.01629 0.74513 25 4XX 0.00183 -0.01469 -0.00326 -0.00995 0.00081 26 4YY -0.01203 -0.00736 0.00968 -0.01436 -0.01957 27 4ZZ 0.00340 0.01316 -0.00504 0.01987 0.02203 28 4XY -0.00360 0.02119 0.00937 -0.00535 -0.01235 29 4XZ -0.00174 0.00351 -0.00429 -0.00499 0.02196 30 4YZ 0.00460 0.00282 -0.01338 -0.01076 0.03175 31 3 H 1S 0.03431 0.01828 -0.03868 0.03063 0.04579 32 2S -0.09389 -0.17631 -0.04659 -0.30138 -0.58176 33 4 Br 1S -0.00169 -0.00652 -0.00021 0.00362 -0.00062 34 2S 0.01480 0.05766 0.00279 -0.02766 0.00526 35 3S -0.02476 -0.09755 -0.00637 0.04040 -0.00851 36 4S -0.02126 -0.08087 -0.00069 0.04945 -0.00826 37 5S 0.18195 0.84122 0.09587 -0.30065 -0.07369 38 6S -0.33679 -1.66415 -0.19723 0.55660 0.30015 39 7PX 0.00043 -0.00437 -0.00102 -0.00621 -0.00595 40 7PY 0.00894 0.01687 0.00096 -0.00385 0.00478 41 7PZ 0.00430 0.00600 0.00628 0.00432 -0.00790 42 8PX -0.00126 0.01386 0.00317 0.01991 0.01924 43 8PY -0.02833 -0.05330 -0.00286 0.01264 -0.01530 44 8PZ -0.01357 -0.01917 -0.02021 -0.01362 0.02545 45 9PX -0.00273 -0.03591 -0.00538 -0.06493 -0.07079 46 9PY 0.07476 0.13264 -0.00187 -0.05567 0.05182 47 9PZ 0.03382 0.06041 0.06758 0.03267 -0.08869 48 10PX 0.04297 -0.02908 -0.00551 0.09153 0.13347 49 10PY -0.02535 0.01727 0.01782 0.08406 -0.21587 50 10PZ 0.01404 -0.06313 -0.05378 0.04896 0.20102 51 11XX 0.01249 0.07632 0.01217 -0.01578 -0.01796 52 11YY -0.00602 0.01212 0.00686 -0.05526 0.00283 53 11ZZ 0.03001 0.05547 -0.00949 0.01363 0.02766 54 11XY -0.00006 0.00887 0.01205 -0.00219 -0.04132 55 11XZ 0.01574 -0.03045 -0.00812 0.00779 0.01233 56 11YZ -0.00067 -0.00721 0.00735 -0.00641 -0.01741 57 12XX 0.08378 0.25080 0.00916 -0.12341 0.06160 58 12YY 0.15654 0.52307 0.03275 0.03298 0.01365 59 12ZZ 0.00844 0.34157 0.10280 -0.24441 -0.12092 60 12XY -0.00709 -0.02857 -0.05496 -0.00001 0.16379 61 12XZ -0.06251 0.11897 0.03521 -0.02514 -0.04563 62 12YZ 0.00102 0.03824 -0.03534 0.02400 0.04506 63 5 C 1S -0.00815 0.04386 0.01771 0.01485 -0.01170 64 2S -0.04359 0.00242 -0.01627 0.04676 -0.01104 65 2PX -0.04157 0.06770 0.03115 -0.03919 0.05049 66 2PY 0.00299 0.15000 0.10608 -0.13789 0.04111 67 2PZ -0.01215 0.03890 -0.12920 -0.05965 -0.32122 68 3S -0.06209 -1.59918 -0.59083 -0.90779 0.36491 69 3PX -0.12171 0.31154 0.21985 -0.49582 0.15315 70 3PY -0.16960 0.62125 0.40784 -0.71866 0.36390 71 3PZ -0.20199 0.04164 -0.70677 -0.60385 -2.28802 72 4XX 0.00390 -0.00446 -0.00101 -0.01075 0.00216 73 4YY -0.01565 -0.00002 -0.01063 -0.01066 0.01343 74 4ZZ -0.00679 0.01555 0.01324 0.02751 -0.02390 75 4XY -0.01936 0.00010 -0.00735 -0.00546 0.00404 76 4XZ -0.01020 -0.00594 0.00636 -0.00459 -0.01427 77 4YZ -0.01042 -0.01069 0.01099 -0.01343 -0.02117 78 6 C 1S 0.03356 0.01556 -0.02109 0.03845 0.07418 79 2S -0.07264 -0.01325 0.04813 -0.01342 -0.08058 80 2PX -0.00323 0.00284 -0.09418 0.08775 0.01779 81 2PY 0.06413 0.06057 -0.14129 0.13378 -0.00174 82 2PZ -0.01614 0.10828 0.09233 0.06474 -0.17659 83 3S -0.81326 -0.45701 0.15428 -1.49170 -2.44075 84 3PX 0.28385 0.45511 -0.62867 0.50647 -0.14806 85 3PY 0.49590 0.63876 -1.08321 0.81420 -0.03460 86 3PZ -0.00729 0.74085 0.21727 0.09439 -1.32064 87 4XX 0.00587 0.00702 -0.00005 -0.00279 -0.00334 88 4YY -0.00018 0.01508 -0.00999 0.00084 -0.00578 89 4ZZ -0.00503 -0.02236 0.00786 0.00579 0.00988 90 4XY -0.00047 0.01503 -0.00683 0.00409 -0.00394 91 4XZ 0.00374 -0.00067 0.00943 0.00959 0.01503 92 4YZ 0.00868 0.00385 0.01678 0.01251 0.01965 93 7 C 1S -0.01192 -0.04830 0.06091 0.00386 0.00158 94 2S 0.00377 0.04326 -0.06270 -0.00884 0.00354 95 2PX 0.05140 0.05861 0.01733 0.09118 0.03056 96 2PY 0.06810 0.07964 0.03896 0.15566 0.06801 97 2PZ 0.00804 0.11181 -0.19128 -0.11987 0.06314 98 3S 0.44143 1.41168 -1.85152 0.16576 -0.47356 99 3PX 0.34848 0.29567 -0.10175 0.75016 0.47977 100 3PY 0.56361 0.43367 -0.08553 1.31572 0.73442 101 3PZ -0.02585 0.63746 -0.91069 -0.74401 0.33891 102 4XX -0.00369 -0.00413 0.00458 -0.00755 0.00276 103 4YY -0.00512 -0.00499 0.01613 -0.01499 0.00798 104 4ZZ 0.00813 0.00155 -0.01343 0.02571 -0.01162 105 4XY -0.00617 -0.00410 0.01054 -0.00991 0.00589 106 4XZ -0.00502 0.00408 -0.00092 -0.01045 -0.01770 107 4YZ -0.00755 0.00951 0.00036 -0.01932 -0.02956 108 8 C 1S -0.02334 0.01727 0.00644 -0.07164 0.00971 109 2S 0.02018 -0.02919 -0.00873 0.07239 -0.01169 110 2PX 0.01759 -0.07065 -0.00832 0.08248 0.01295 111 2PY 0.04538 -0.10692 0.00238 0.13683 0.05059 112 2PZ 0.01549 -0.00539 -0.18321 0.00538 -0.24283 113 3S 0.74704 -0.24663 -0.10974 2.30175 -0.37378 114 3PX 0.10132 -0.38662 0.00228 0.44756 0.06010 115 3PY 0.16786 -0.64977 0.11384 0.76285 0.17906 116 3PZ 0.14885 0.14289 -1.54212 0.02243 -0.98634 117 4XX 0.00340 0.00386 -0.00191 0.00543 -0.00157 118 4YY 0.00625 0.01073 -0.01168 0.01219 -0.00210 119 4ZZ -0.01241 -0.01255 0.01489 -0.02447 0.00343 120 4XY 0.00490 0.00756 -0.00624 0.00910 -0.00229 121 4XZ -0.00100 -0.00351 0.02217 0.00859 -0.00268 122 4YZ 0.00062 -0.00521 0.03599 0.01498 -0.00670 123 9 C 1S 0.00671 -0.00671 -0.08137 -0.00676 0.00640 124 2S -0.01313 0.00126 0.08487 0.00761 -0.02337 125 2PX 0.01374 0.04169 0.06809 0.06328 -0.08496 126 2PY 0.01902 0.04814 0.12348 0.07143 -0.14414 127 2PZ 0.08008 0.04848 -0.18964 0.15634 -0.03236 128 3S -0.07770 0.30478 2.48316 0.47423 0.24376 129 3PX 0.09176 0.08046 0.41748 0.47517 -0.69515 130 3PY 0.12193 0.13619 0.77003 0.70975 -1.13961 131 3PZ 0.50039 0.06709 -0.86729 1.24157 -0.52511 132 4XX -0.00184 0.00105 -0.00244 -0.00897 0.00499 133 4YY -0.00434 0.01033 -0.00558 -0.01896 0.02135 134 4ZZ 0.00756 -0.01280 -0.00114 0.02877 -0.02588 135 4XY -0.00445 0.00549 -0.00519 -0.01527 0.01200 136 4XZ -0.00086 -0.00190 -0.01134 -0.00845 -0.01322 137 4YZ -0.00275 -0.00338 -0.01896 -0.01595 -0.01953 138 10 C 1S 0.00937 -0.01976 0.01782 0.03375 -0.07463 139 2S -0.04695 0.03131 -0.04760 -0.01800 0.05921 140 2PX -0.00694 -0.00738 0.07544 0.09590 -0.04619 141 2PY 0.03429 0.04348 0.13954 0.18563 -0.01454 142 2PZ -0.01088 -0.14047 0.09072 0.00171 -0.14204 143 3S -0.19448 0.39142 -0.12501 -0.97995 2.60051 144 3PX 0.13850 0.28779 0.85255 0.57178 0.05867 145 3PY 0.19160 0.47572 1.36966 0.95975 0.12808 146 3PZ -0.09166 -0.81194 0.34201 0.15670 -0.86922 147 4XX 0.00019 0.00425 0.00161 0.00417 -0.00241 148 4YY 0.00257 0.00880 0.00530 0.00962 -0.02013 149 4ZZ -0.00968 -0.01429 -0.00596 -0.00169 0.01830 150 4XY -0.00017 0.00861 0.00509 0.01159 -0.01301 151 4XZ -0.00243 0.00635 0.01858 -0.00331 0.00859 152 4YZ -0.00603 0.00762 0.02854 -0.00349 0.01654 153 11 H 1S -0.02915 -0.01857 0.02992 -0.02766 0.10313 154 2S 0.08448 0.50912 -0.63191 -0.18064 0.18908 155 12 H 1S 0.00701 0.01140 0.08593 0.05888 0.07249 156 2S -0.20668 -0.00120 0.64781 -0.35457 -0.47621 157 13 H 1S 0.03567 0.03143 0.01277 0.10730 -0.02445 158 2S 0.07565 -0.55576 -0.21801 0.33726 0.02222 159 14 H 1S 0.01042 0.03225 -0.06683 0.03689 -0.10112 160 2S 0.05651 0.38445 -0.47971 -0.31086 0.51156 161 15 H 1S -0.03650 -0.00484 -0.05023 -0.05432 -0.07961 162 2S -0.12891 0.20615 0.87569 -0.21396 -0.24074 163 16 C 1S 0.04214 -0.01781 0.00556 -0.01869 -0.00809 164 2S -0.04625 0.01253 -0.01019 -0.00167 0.01096 165 2PX -0.04068 -0.18984 -0.04871 0.08094 0.00390 166 2PY -0.04844 -0.07295 0.00191 -0.07818 0.01015 167 2PZ -0.01602 -0.02964 -0.01658 -0.02231 0.05685 168 3S -1.77663 0.65130 -0.19696 0.61232 0.22233 169 3PX -0.21775 -1.30075 -0.21241 0.23568 -0.04141 170 3PY -0.48333 -0.40873 -0.07701 -0.42948 0.28394 171 3PZ -0.26917 -0.15782 -0.02234 -0.24439 0.23095 172 4XX -0.00238 0.02080 0.00328 -0.00454 -0.00267 173 4YY -0.00193 -0.01229 -0.00276 -0.00325 0.00154 174 4ZZ -0.00187 -0.00700 -0.00136 0.00021 -0.00182 175 4XY 0.03331 -0.00646 0.00575 -0.01501 -0.00154 176 4XZ 0.01892 -0.00060 0.00274 -0.00774 0.00312 177 4YZ -0.00239 -0.01132 -0.00226 -0.00294 -0.00224 178 17 C 1S 0.04309 0.03625 0.01110 -0.00091 -0.00815 179 2S -0.05987 -0.05677 -0.02105 0.00256 0.00865 180 2PX -0.06109 -0.01636 -0.01648 -0.00500 0.01848 181 2PY 0.13641 -0.10813 0.01019 -0.08291 -0.00027 182 2PZ 0.07432 -0.03403 0.01176 -0.02915 -0.02618 183 3S -1.47862 -0.93547 -0.33372 0.02884 0.35298 184 3PX -0.63960 -0.03652 -0.15977 0.08196 0.22838 185 3PY 0.86380 -0.51591 0.10107 -0.62795 0.06608 186 3PZ 0.48917 -0.29951 0.05313 -0.35005 0.01127 187 4XX -0.00585 -0.00580 -0.00149 -0.00209 0.00192 188 4YY 0.00559 0.00410 0.00031 0.00162 -0.00154 189 4ZZ 0.00084 -0.00002 -0.00109 0.00148 0.00237 190 4XY -0.02710 -0.00932 -0.00687 0.01672 -0.00108 191 4XZ -0.01385 -0.00127 -0.00411 0.01057 0.00114 192 4YZ 0.00622 0.00517 0.00040 0.00044 0.00155 193 18 C 1S -0.01222 -0.00952 -0.00785 0.00959 0.00304 194 2S 0.01112 0.02765 0.01127 -0.01579 0.00263 195 2PX -0.26303 0.02309 -0.02831 0.10111 0.01272 196 2PY 0.02512 0.10290 0.03147 -0.02973 -0.00290 197 2PZ 0.01914 0.04681 0.01836 -0.02174 0.00134 198 3S 0.55935 -0.15283 0.19401 -0.27968 -0.15997 199 3PX -1.64652 0.05153 -0.20405 0.46234 0.15327 200 3PY 0.18835 0.47165 0.17014 -0.11224 -0.11557 201 3PZ 0.14118 0.25827 0.09547 -0.07038 -0.05383 202 4XX -0.00260 0.01394 0.00025 0.00590 -0.00051 203 4YY 0.00278 -0.01422 -0.00131 -0.00298 0.00005 204 4ZZ 0.00027 -0.00230 0.00024 -0.00103 -0.00019 205 4XY 0.02393 -0.00111 0.00308 -0.00091 -0.00492 206 4XZ 0.01301 -0.00223 0.00141 -0.00131 -0.00110 207 4YZ 0.00106 -0.00786 -0.00087 -0.00065 -0.00097 208 19 C 1S -0.04961 0.02606 -0.00006 0.00365 0.00447 209 2S 0.03908 -0.03255 -0.00298 0.00640 -0.00402 210 2PX -0.08363 -0.02315 -0.00381 -0.01951 0.01500 211 2PY -0.01555 -0.12355 -0.02440 0.03060 0.00966 212 2PZ -0.00644 -0.06786 -0.01257 0.01859 -0.00207 213 3S 1.78841 -0.72369 0.06830 -0.32614 -0.11908 214 3PX -0.46737 -0.01085 0.01270 0.02121 0.01843 215 3PY -0.06999 -0.43643 -0.07568 0.22557 -0.02860 216 3PZ -0.02446 -0.23713 -0.04037 0.12170 -0.02136 217 4XX -0.00245 0.00675 0.00294 0.00290 -0.00207 218 4YY -0.00329 -0.00134 -0.00177 -0.00277 0.00296 219 4ZZ 0.00068 -0.00145 -0.00062 -0.00074 0.00014 220 4XY -0.03218 0.01053 -0.00272 0.01213 0.00265 221 4XZ -0.01727 0.00608 -0.00162 0.00694 0.00078 222 4YZ -0.00227 0.00053 -0.00103 -0.00227 0.00160 223 20 C 1S -0.02951 0.00187 -0.00311 0.02543 -0.00306 224 2S 0.02997 0.00100 0.00372 -0.03498 0.00816 225 2PX -0.05338 0.07803 0.00515 0.05725 -0.01771 226 2PY 0.16167 -0.08507 0.01341 -0.03479 -0.01620 227 2PZ 0.08834 -0.04817 0.00566 -0.02031 -0.01348 228 3S 1.09767 -0.15549 0.10524 -0.62691 -0.01087 229 3PX -0.33146 0.67568 0.06768 0.28916 -0.06642 230 3PY 1.06634 -0.76063 0.01484 -0.23719 -0.07209 231 3PZ 0.59046 -0.42697 0.00617 -0.13509 -0.01960 232 4XX 0.00531 0.01823 0.00480 -0.00313 -0.00338 233 4YY -0.00677 -0.01628 -0.00437 0.00614 0.00163 234 4ZZ -0.00140 -0.00400 -0.00081 0.00056 0.00133 235 4XY 0.02916 -0.01390 0.00080 -0.01026 -0.00082 236 4XZ 0.01569 -0.00772 -0.00003 -0.00544 -0.00177 237 4YZ -0.00602 -0.01160 -0.00296 0.00527 0.00133 238 21 C 1S 0.02383 -0.04881 -0.00584 -0.01347 0.00415 239 2S -0.04487 0.04021 0.00576 0.01036 -0.00542 240 2PX -0.25418 -0.01313 -0.04195 0.14016 0.01429 241 2PY 0.00455 -0.11534 -0.03252 0.01676 0.00171 242 2PZ 0.01163 -0.07328 -0.01317 0.00735 0.02133 243 3S -0.61878 1.71001 0.16763 0.47703 -0.11979 244 3PX -1.51749 -0.07305 -0.21336 0.51974 0.12767 245 3PY 0.17310 -0.75584 -0.13261 0.06411 0.01846 246 3PZ 0.12738 -0.42049 -0.07089 0.02110 -0.04124 247 4XX 0.00692 -0.01951 -0.00276 0.00079 0.00157 248 4YY -0.00140 0.01075 0.00088 -0.00072 0.00115 249 4ZZ -0.00177 0.00386 0.00118 -0.00043 -0.00341 250 4XY -0.02097 0.00306 -0.00433 0.01460 0.00157 251 4XZ -0.01199 0.00159 -0.00131 0.00709 -0.00124 252 4YZ 0.00002 0.00430 0.00051 -0.00156 -0.00274 253 22 H 1S -0.02219 0.06504 0.00685 -0.00974 -0.00435 254 2S 0.25142 0.44555 0.15702 -0.32292 0.00699 255 23 H 1S 0.07501 0.01599 0.01185 -0.02743 -0.01093 256 2S -0.31673 -0.24326 -0.08564 -0.00648 0.08587 257 24 H 1S 0.11475 -0.03246 0.01224 -0.04505 -0.00994 258 2S -0.05100 -0.15440 -0.06891 0.19111 -0.01219 259 25 H 1S 0.03198 -0.05605 -0.00120 -0.01643 -0.00520 260 2S -0.13773 0.50788 0.10271 -0.01830 -0.03000 261 26 H 1S -0.08087 -0.03024 -0.01963 0.02155 -0.00190 262 2S 0.13939 0.01131 -0.00427 -0.15342 0.13308 263 27 H 1S -0.00164 0.03657 -0.00213 0.04033 -0.01351 264 2S -0.53506 -0.48079 -0.15218 0.26187 0.09523 96 97 98 99 100 V V V V V Eigenvalues -- 0.33106 0.36934 0.39680 0.39945 0.41951 1 1 C 1S -0.02897 -0.05389 -0.01932 -0.00491 -0.02326 2 2S 0.07436 0.11417 -0.21400 0.14783 0.15926 3 2PX -0.18982 0.14769 0.14335 0.02136 0.01130 4 2PY -0.06412 -0.26035 -0.12695 0.04494 -0.30047 5 2PZ -0.16344 -0.15814 0.11177 -0.01690 -0.04046 6 3S 0.38690 1.64078 0.33071 -0.28279 -0.01243 7 3PX -1.51239 2.32647 -0.38491 0.45467 -0.12581 8 3PY -0.53265 -1.44088 -0.17609 -0.48639 0.59970 9 3PZ -0.28505 -0.82000 -0.23079 -0.09381 0.20489 10 4XX 0.00702 0.00223 -0.07649 0.00184 0.01202 11 4YY -0.00427 -0.00496 0.00281 0.00527 -0.00666 12 4ZZ -0.00040 0.00434 0.01174 0.01212 0.00426 13 4XY -0.00516 0.01861 -0.01034 0.01398 -0.01382 14 4XZ -0.00126 0.01359 0.02129 -0.00410 0.00325 15 4YZ -0.00277 -0.01249 -0.02321 0.02704 -0.01949 16 2 C 1S 0.04702 0.01638 0.00776 -0.00233 0.01201 17 2S -0.01112 -0.07011 -0.10228 -0.01898 0.03224 18 2PX -0.08910 0.05199 -0.33711 0.00280 -0.04473 19 2PY 0.14181 0.09421 0.13505 0.03893 0.05753 20 2PZ -0.01243 0.06018 0.08470 0.24047 0.00045 21 3S -1.34828 0.28815 -0.12844 -0.08115 -0.10094 22 3PX -1.05921 1.17713 0.19478 0.60844 -0.09675 23 3PY 0.20629 1.26687 -0.11485 0.67394 -0.27086 24 3PZ 0.21409 0.61956 0.02349 -0.40246 -0.16110 25 4XX 0.01948 0.00169 -0.03486 0.00303 0.01314 26 4YY 0.00000 0.01673 -0.00522 -0.03942 -0.01566 27 4ZZ -0.01254 -0.01830 0.02881 0.02016 0.01963 28 4XY 0.00160 -0.01408 0.01730 -0.01389 0.02127 29 4XZ -0.00199 -0.01293 -0.02382 0.00149 0.00025 30 4YZ -0.00338 0.01401 -0.00855 0.04428 0.00416 31 3 H 1S -0.05741 0.00766 0.10756 0.15044 0.08295 32 2S -0.23736 -0.33754 -0.14806 0.01228 0.09044 33 4 Br 1S -0.00883 -0.00050 0.00167 -0.00333 0.00012 34 2S 0.07665 0.00308 -0.01144 0.02574 0.00350 35 3S -0.12797 -0.00293 0.01417 -0.03734 -0.01279 36 4S -0.11012 -0.00891 0.02567 -0.04891 0.00655 37 5S 1.09009 0.02427 -0.05824 0.30296 0.12736 38 6S -2.11037 -0.10237 0.08051 -0.67158 -0.29944 39 7PX -0.00676 -0.00526 0.00308 -0.00472 0.02752 40 7PY 0.02437 0.00334 -0.00610 0.01696 0.00308 41 7PZ -0.00747 0.01287 0.00710 -0.01272 -0.01536 42 8PX 0.02175 0.01690 -0.01045 0.01548 -0.08862 43 8PY -0.07741 -0.01102 0.01985 -0.05471 -0.00964 44 8PZ 0.02356 -0.04124 -0.02287 0.04143 0.04933 45 9PX -0.07483 -0.05651 0.06297 -0.06242 0.29882 46 9PY 0.21533 0.04899 -0.07647 0.18453 0.01968 47 9PZ -0.05872 0.13201 0.07736 -0.15760 -0.15987 48 10PX 0.12699 0.03134 -0.17411 0.03761 -0.30971 49 10PY -0.11672 -0.03234 0.07122 -0.01184 -0.00222 50 10PZ 0.00682 -0.23391 -0.04648 0.07001 0.17509 51 11XX 0.07872 0.02594 -0.03940 0.08344 -0.04337 52 11YY 0.05509 0.04865 -0.02448 -0.05330 -0.03112 53 11ZZ 0.05353 -0.07041 0.04415 0.02426 0.09559 54 11XY -0.03516 0.02407 0.12391 -0.02213 -0.03275 55 11XZ -0.00665 0.00704 -0.06056 0.02700 -0.11674 56 11YZ 0.01451 0.00228 0.00138 -0.08719 -0.01712 57 12XX 0.40264 -0.09318 0.13306 -0.18425 0.30537 58 12YY 0.52018 -0.20706 0.08039 0.40118 0.25851 59 12ZZ 0.51709 0.28828 -0.23040 0.05916 -0.31734 60 12XY 0.13691 -0.10015 -0.55037 0.12001 0.15562 61 12XZ 0.04251 -0.03836 0.26421 -0.13628 0.53544 62 12YZ -0.06770 0.01335 -0.01229 0.43229 0.07057 63 5 C 1S 0.02254 -0.02240 -0.01420 -0.03060 -0.01026 64 2S -0.06431 0.12550 0.01612 0.01585 0.05587 65 2PX 0.11295 0.05212 -0.13318 -0.04807 0.19323 66 2PY 0.05625 0.18546 0.07756 -0.05972 -0.10328 67 2PZ 0.02320 -0.03714 -0.04859 0.19665 0.06372 68 3S -0.93428 0.47492 0.28731 0.70893 0.11421 69 3PX 0.51839 0.70160 -0.06478 0.11824 -0.23564 70 3PY 0.33670 1.17022 -0.11185 0.13280 -0.20356 71 3PZ -0.13839 0.32448 0.02467 1.59502 0.06147 72 4XX -0.01360 0.00692 0.01169 0.00582 -0.02301 73 4YY -0.00583 -0.00448 -0.00341 0.00818 0.02464 74 4ZZ 0.00770 0.01930 -0.00969 -0.02702 0.00372 75 4XY -0.01825 0.00824 -0.00109 0.00147 -0.00681 76 4XZ -0.00136 -0.00476 -0.00133 -0.01626 -0.00815 77 4YZ 0.00388 -0.01499 0.00288 -0.02502 -0.00005 78 6 C 1S 0.01285 0.00732 0.00648 -0.02619 0.00386 79 2S -0.02567 0.05896 -0.01069 -0.04120 -0.05026 80 2PX -0.01041 0.03773 -0.09882 -0.14618 0.08740 81 2PY 0.05418 0.05531 0.02262 -0.17739 -0.14388 82 2PZ 0.12853 0.01010 -0.04983 -0.16830 0.00845 83 3S -0.36123 0.04307 -0.16537 1.22832 -0.02985 84 3PX 0.01391 -0.01218 0.17206 0.40660 -0.05665 85 3PY 0.18711 -0.20389 0.05794 0.48476 0.24637 86 3PZ 0.52398 0.32723 -0.13016 0.98510 -0.02585 87 4XX 0.00350 0.00132 -0.00143 -0.00328 -0.00539 88 4YY 0.01011 0.01691 -0.01007 -0.00374 0.00035 89 4ZZ -0.01781 0.00345 0.01068 -0.00837 -0.01180 90 4XY 0.00464 0.01951 -0.00158 0.00304 -0.00343 91 4XZ 0.00473 0.00585 -0.00374 0.00604 0.01131 92 4YZ -0.00607 0.02099 0.01037 0.01585 -0.00908 93 7 C 1S -0.03014 -0.01877 0.00415 0.02663 -0.00182 94 2S 0.03408 0.10796 0.01445 -0.01895 -0.03520 95 2PX 0.03652 0.07326 0.03352 0.09683 -0.01680 96 2PY 0.03971 0.04957 -0.03059 0.11697 0.03420 97 2PZ 0.03255 0.09312 0.01678 -0.05768 -0.01741 98 3S 0.76734 -0.04397 -0.06546 -0.54195 0.18743 99 3PX 0.14609 0.01229 0.02991 0.08014 0.04797 100 3PY 0.13707 0.10558 0.17860 0.22760 -0.06896 101 3PZ 0.21001 0.18269 0.01633 -0.36566 0.10667 102 4XX -0.00264 0.00271 -0.00208 0.00505 0.00593 103 4YY -0.00673 0.00336 0.01185 0.02857 -0.00330 104 4ZZ 0.00690 -0.00256 -0.00165 -0.02445 -0.00860 105 4XY -0.00859 -0.00122 0.00474 0.02147 0.00420 106 4XZ 0.00588 -0.00552 -0.00506 0.00485 0.00534 107 4YZ 0.00824 -0.00816 -0.00612 0.01157 0.00750 108 8 C 1S 0.00962 0.01447 0.00197 0.00223 0.00693 109 2S -0.03006 0.01075 0.02053 0.02789 -0.02188 110 2PX -0.06259 0.00840 0.02013 0.02490 -0.01330 111 2PY -0.05820 -0.03012 0.02933 0.00946 -0.02542 112 2PZ 0.00741 -0.05911 -0.04133 0.06022 0.03403 113 3S 0.01352 -0.34239 -0.16285 -0.21400 -0.26538 114 3PX -0.23100 -0.12780 0.01291 0.10174 -0.07893 115 3PY -0.36347 -0.19235 0.02164 0.26929 -0.08980 116 3PZ 0.19990 -0.18353 -0.20863 -1.16094 -0.19142 117 4XX 0.00425 0.00122 0.00204 -0.00361 -0.00491 118 4YY 0.00852 0.00347 -0.00503 -0.01777 -0.00227 119 4ZZ -0.01109 0.00398 0.00604 0.02421 0.00281 120 4XY 0.00843 0.00420 -0.00043 -0.01123 -0.00565 121 4XZ -0.00001 -0.00271 -0.00319 0.01240 0.00456 122 4YZ 0.00206 -0.00458 -0.00426 0.02003 0.00494 123 9 C 1S -0.01567 -0.01092 0.00594 -0.01574 -0.00928 124 2S 0.01737 0.05991 -0.00908 0.04505 0.00354 125 2PX 0.05555 0.04011 -0.00882 -0.06203 -0.00695 126 2PY 0.09354 0.02904 -0.03655 -0.11349 -0.01527 127 2PZ 0.03910 -0.02466 -0.02528 -0.19063 -0.04190 128 3S 0.43689 -0.04007 -0.01980 0.05426 0.26518 129 3PX 0.28353 -0.18136 -0.17929 -0.23393 0.08671 130 3PY 0.38443 -0.24395 -0.23068 -0.34340 0.09842 131 3PZ 0.16312 -0.25698 -0.21200 -0.66093 -0.18983 132 4XX 0.00168 0.00476 -0.00012 -0.00303 -0.00145 133 4YY 0.00104 0.00767 0.00935 -0.01693 -0.00604 134 4ZZ -0.00534 -0.01017 -0.00431 0.02016 0.00389 135 4XY -0.00039 0.00357 0.00580 -0.01249 -0.00444 136 4XZ -0.00303 -0.00102 0.00192 0.00297 0.00117 137 4YZ -0.00300 -0.00070 0.00377 0.00380 0.00076 138 10 C 1S 0.00512 -0.01313 -0.00837 0.01720 0.01155 139 2S -0.04649 0.06501 -0.00797 0.02542 0.02064 140 2PX 0.00303 0.02037 -0.09824 0.07907 0.07920 141 2PY 0.04407 0.00089 -0.05220 0.08202 0.01048 142 2PZ -0.02860 -0.09498 0.00539 -0.00388 0.01191 143 3S 0.01851 0.47988 0.19508 -0.69527 -0.39450 144 3PX 0.29959 -0.09157 -0.03103 -0.75973 -0.13660 145 3PY 0.70154 -0.12991 -0.19261 -1.25392 -0.08915 146 3PZ -0.42726 -0.60193 0.06182 0.46744 0.27737 147 4XX 0.00296 0.00380 -0.00430 -0.00331 0.00612 148 4YY 0.01047 0.01073 -0.00753 -0.00919 -0.00247 149 4ZZ -0.01886 -0.00609 0.00076 0.01888 0.00657 150 4XY 0.00850 0.00656 -0.00778 -0.00877 0.00494 151 4XZ -0.00268 0.00970 0.00614 -0.00880 -0.01257 152 4YZ 0.01293 0.00563 -0.00761 -0.01824 0.00262 153 11 H 1S -0.02963 0.01319 -0.00050 0.03617 0.01610 154 2S 0.19257 0.47380 -0.01430 0.12933 -0.08135 155 12 H 1S 0.01099 -0.00396 -0.00625 -0.02521 -0.01072 156 2S 0.11236 0.02821 -0.02277 0.12005 0.10032 157 13 H 1S 0.04693 0.00003 -0.02665 -0.04608 -0.00460 158 2S -0.32080 -0.16854 0.04360 0.07094 -0.05410 159 14 H 1S 0.03188 -0.02237 -0.02376 -0.04166 -0.01734 160 2S 0.02779 0.25300 0.07898 -0.00124 0.00520 161 15 H 1S 0.02843 -0.00674 -0.02526 -0.09189 0.00038 162 2S 0.42959 0.23609 -0.09514 -0.03396 -0.00453 163 16 C 1S 0.00559 0.07148 0.00818 -0.00245 0.05257 164 2S -0.01312 -0.08722 -0.14382 0.00087 0.00020 165 2PX 0.17619 0.16581 0.18308 0.08124 -0.09848 166 2PY 0.15994 -0.17783 0.01602 -0.04186 0.03365 167 2PZ 0.06496 -0.10772 -0.01366 0.05851 -0.05186 168 3S 0.16552 -2.22226 0.19094 -0.12463 -0.66620 169 3PX 0.96398 1.32490 0.60848 0.43910 -0.75577 170 3PY 1.28953 -2.14350 0.45478 -0.10149 -0.20077 171 3PZ 0.74795 -1.26835 0.23608 -0.19625 0.00641 172 4XX 0.00476 -0.00344 0.01952 0.00681 0.01668 173 4YY 0.00246 0.01318 -0.03370 -0.00526 0.02659 174 4ZZ -0.00471 -0.00300 -0.00308 -0.00599 -0.00058 175 4XY -0.00538 -0.02778 -0.00899 -0.01148 -0.01312 176 4XZ 0.00094 -0.01714 -0.01613 -0.00183 -0.01529 177 4YZ -0.00162 0.01680 -0.01087 -0.00686 0.03521 178 17 C 1S -0.05718 0.00073 -0.01278 0.00158 -0.02343 179 2S 0.02030 0.04430 -0.07989 -0.03964 0.10938 180 2PX 0.12446 -0.05114 0.10582 0.06836 -0.09686 181 2PY -0.00310 0.05069 -0.15105 -0.11474 0.17470 182 2PZ -0.03299 0.05094 -0.05584 0.03224 0.11840 183 3S 2.11175 -0.96398 0.74658 0.03951 0.15274 184 3PX 0.57703 -0.56551 -0.21352 -0.28339 0.73767 185 3PY 0.64592 -0.71136 0.47997 0.10309 -0.26688 186 3PZ 0.32414 -0.36190 0.25742 -0.00175 -0.19902 187 4XX 0.00774 0.00656 -0.00012 -0.00243 0.01344 188 4YY -0.01277 -0.00661 -0.00950 -0.00725 -0.00049 189 4ZZ -0.00322 -0.00134 -0.00964 -0.00241 0.00150 190 4XY 0.00460 0.03771 -0.00269 0.00333 0.01995 191 4XZ 0.00242 0.01970 -0.00190 0.00674 0.01003 192 4YZ -0.00721 -0.00809 -0.00522 0.00188 -0.01096 193 18 C 1S 0.02511 0.01827 0.01899 0.01052 0.00606 194 2S -0.03919 -0.09380 -0.05103 -0.03351 -0.03457 195 2PX -0.02393 0.07889 -0.12796 -0.05464 0.11881 196 2PY -0.09034 -0.14331 -0.04138 -0.02912 -0.07596 197 2PZ -0.04455 -0.07722 -0.01830 -0.01402 -0.05455 198 3S -0.45812 0.15600 -0.23233 -0.04977 -0.41084 199 3PX 0.50938 -0.18786 -0.06588 -0.09569 0.05010 200 3PY -0.68495 -0.07467 -0.17333 0.00011 -0.36531 201 3PZ -0.37519 -0.04343 -0.09995 0.01389 -0.18752 202 4XX -0.01418 -0.00624 -0.00007 0.00479 -0.01980 203 4YY 0.01257 0.01268 0.00245 -0.00092 0.00716 204 4ZZ 0.00291 -0.00235 -0.00064 -0.00089 0.00303 205 4XY -0.01925 0.01768 -0.01729 -0.00634 0.01855 206 4XZ -0.00873 0.00848 -0.01082 -0.00732 0.00934 207 4YZ 0.00806 0.01310 0.00615 0.00472 0.00574 208 19 C 1S -0.00898 -0.03001 -0.00898 -0.00397 -0.01764 209 2S 0.01151 0.01302 0.00485 0.00725 -0.02654 210 2PX 0.08887 -0.05425 0.03946 -0.00281 -0.00432 211 2PY 0.13436 0.01512 0.06514 0.01243 -0.02412 212 2PZ 0.06233 0.01598 0.04483 0.01858 -0.01160 213 3S 0.21095 0.75701 0.09668 -0.04349 0.86488 214 3PX -0.00503 -0.11103 -0.42108 -0.22015 0.01331 215 3PY 0.17421 0.60336 -0.27552 -0.19373 0.72411 216 3PZ 0.09250 0.33133 -0.13985 -0.10612 0.39115 217 4XX -0.02024 0.00784 -0.02502 -0.01249 0.01682 218 4YY 0.01266 -0.01436 0.01311 0.00523 -0.01396 219 4ZZ 0.00477 -0.00225 0.00550 0.00335 -0.00540 220 4XY -0.00434 -0.00918 -0.00417 -0.00143 -0.00747 221 4XZ -0.00259 -0.00450 -0.00132 0.00147 -0.00432 222 4YZ 0.00756 -0.01023 0.00665 0.00292 -0.00734 223 20 C 1S -0.01713 0.03671 -0.00181 0.00123 0.01495 224 2S 0.01190 -0.09263 -0.03085 -0.01850 -0.02778 225 2PX -0.06505 0.11322 0.07621 0.04195 0.01536 226 2PY -0.01458 0.10330 -0.10382 -0.06043 0.13830 227 2PZ -0.00633 0.05899 -0.05815 -0.01758 0.06769 228 3S 0.31734 -0.25674 0.05862 0.07909 -0.54210 229 3PX -0.81402 0.22230 -0.11094 -0.01231 0.27158 230 3PY 0.49033 0.53044 -0.06935 -0.13459 0.60286 231 3PZ 0.29312 0.27605 -0.04712 -0.09427 0.32957 232 4XX -0.02552 0.01468 -0.01237 -0.00325 0.01026 233 4YY 0.01920 -0.00291 0.00827 0.00488 -0.01334 234 4ZZ 0.00422 -0.00699 0.00158 -0.00170 -0.00405 235 4XY 0.01428 0.00429 0.01645 0.00321 0.00458 236 4XZ 0.00886 0.00316 0.00787 0.00572 0.00029 237 4YZ 0.01219 0.00274 0.00673 0.00255 -0.00758 238 21 C 1S 0.04333 -0.01418 0.00560 0.00230 -0.01749 239 2S -0.01145 -0.00158 -0.00260 -0.00300 0.01913 240 2PX -0.05807 0.08786 -0.08316 0.00737 -0.05759 241 2PY 0.14982 0.02615 0.06170 0.04893 -0.02076 242 2PZ 0.06555 0.00041 0.05413 -0.01546 0.00402 243 3S -1.87203 0.40251 -0.52034 -0.11209 0.62817 244 3PX 0.43804 -0.51631 0.73259 0.34528 -0.82698 245 3PY 0.62074 0.50738 0.09907 0.08161 -0.29764 246 3PZ 0.32331 0.31595 0.04554 0.10428 -0.16984 247 4XX 0.01325 -0.00763 -0.00588 -0.00235 -0.00610 248 4YY -0.00794 0.00863 0.00095 0.00119 0.00828 249 4ZZ -0.00341 0.00228 0.00379 0.00089 0.00128 250 4XY 0.00729 0.00859 0.02118 0.01577 -0.01646 251 4XZ 0.00358 0.00500 0.01574 0.00420 -0.00422 252 4YZ -0.00535 0.00962 -0.00116 0.00186 0.00872 253 22 H 1S -0.04892 0.01213 0.00472 0.01631 0.01129 254 2S -0.33626 -0.65332 -0.15847 -0.16018 0.16152 255 23 H 1S -0.02904 0.05795 0.00854 0.00654 0.04641 256 2S 0.37334 -0.32532 0.03756 0.01421 -0.26387 257 24 H 1S 0.00177 0.02617 -0.00989 -0.01195 0.04669 258 2S 0.07083 0.25117 0.08480 0.04604 0.13610 259 25 H 1S 0.04204 0.06911 0.00810 -0.00106 0.06811 260 2S -0.42749 -0.29058 -0.10709 -0.01760 -0.27514 261 26 H 1S 0.02838 0.06044 -0.01224 0.01343 0.03962 262 2S 0.17430 -0.52222 -0.19704 -0.21678 0.33023 263 27 H 1S 0.00632 -0.01660 0.00822 0.09697 -0.12879 264 2S 0.84747 0.36729 0.23292 0.17460 -0.17295 101 102 103 104 105 V V V V V Eigenvalues -- 0.42702 0.43965 0.45216 0.46519 0.47204 1 1 C 1S 0.01890 0.00524 -0.01076 0.00373 -0.01281 2 2S -0.18397 -0.20448 0.18410 -0.06935 -0.14316 3 2PX -0.27185 0.14709 -0.19809 0.00946 -0.20765 4 2PY -0.12141 0.11233 -0.02119 0.13931 0.10453 5 2PZ 0.28959 -0.14683 -0.09376 -0.16875 -0.09384 6 3S 0.56297 0.77705 -0.28224 0.18229 0.11771 7 3PX 0.61535 0.50788 -0.18862 0.05278 0.51529 8 3PY -0.02742 -0.64340 0.28191 -0.38815 0.19211 9 3PZ -0.26713 -0.28769 0.23828 0.00453 0.38361 10 4XX 0.02034 0.00420 0.00467 0.01376 -0.04619 11 4YY -0.02186 -0.01881 0.00235 -0.01934 -0.01107 12 4ZZ -0.00312 -0.01028 0.00903 -0.00387 0.02229 13 4XY -0.03284 0.00436 -0.01051 -0.00245 -0.01599 14 4XZ 0.00614 -0.00288 -0.01833 0.00283 0.00160 15 4YZ -0.02018 -0.01422 0.01317 0.00054 -0.05285 16 2 C 1S 0.01495 0.02556 0.02741 -0.00827 0.00678 17 2S 0.03211 -0.15175 -0.22137 0.11463 0.00076 18 2PX 0.10424 0.28502 0.00418 0.02784 -0.32796 19 2PY 0.20829 0.34650 0.03322 0.13086 0.08946 20 2PZ 0.02789 0.03597 0.22488 -0.00181 -0.18898 21 3S 0.13421 -0.07723 0.58951 -0.21823 0.07811 22 3PX -0.16145 0.16927 -0.33256 -0.00959 0.31528 23 3PY -0.17049 -0.14932 -0.07371 -0.04999 -0.40718 24 3PZ 0.04005 0.50308 -0.54741 0.09216 0.32331 25 4XX 0.02850 -0.02992 0.01068 0.01328 0.02259 26 4YY -0.01275 0.00532 -0.00088 -0.00498 -0.01250 27 4ZZ 0.00252 0.01339 -0.00668 -0.00316 0.00148 28 4XY 0.02234 -0.00770 0.02765 0.00661 0.01814 29 4XZ -0.00197 0.00993 0.00833 -0.01508 0.00145 30 4YZ 0.02871 -0.02497 -0.03515 0.01298 -0.00074 31 3 H 1S 0.04952 0.00547 -0.02587 -0.03657 -0.02544 32 2S -0.01886 -0.13889 0.14060 -0.17909 -0.02323 33 4 Br 1S -0.00203 0.00096 -0.00079 0.00099 0.00247 34 2S 0.01856 -0.00651 0.00114 -0.00536 -0.01623 35 3S -0.03213 0.00774 0.00629 0.00462 0.01982 36 4S -0.02585 0.01571 -0.01426 0.01359 0.03442 37 5S 0.17626 -0.16603 0.16495 -0.22809 -0.45514 38 6S -0.29532 0.43929 -0.39713 0.48814 1.01278 39 7PX -0.01599 -0.01311 0.00184 0.05301 -0.05812 40 7PY 0.03471 -0.00825 -0.06915 0.02549 0.00727 41 7PZ -0.00946 0.00965 0.00051 -0.04191 -0.02165 42 8PX 0.05121 0.04220 -0.00588 -0.17046 0.18703 43 8PY -0.11149 0.02689 0.22233 -0.08213 -0.02351 44 8PZ 0.03045 -0.03117 -0.00156 0.13494 0.06966 45 9PX -0.16167 -0.14397 0.01766 0.55532 -0.62256 46 9PY 0.36451 -0.09784 -0.73949 0.28371 0.09422 47 9PZ -0.10480 0.10396 0.00763 -0.45526 -0.23744 48 10PX 0.16135 0.19190 -0.01858 -0.47280 0.63381 49 10PY -0.38362 -0.06218 0.90151 -0.38742 -0.34506 50 10PZ 0.15773 0.02143 -0.12107 0.51965 0.39995 51 11XX -0.06755 -0.02269 0.06300 -0.00770 0.03880 52 11YY 0.03538 -0.06235 -0.10186 0.00814 -0.02804 53 11ZZ 0.08013 0.07402 0.02578 -0.00433 -0.03578 54 11XY 0.06139 -0.06069 0.04462 0.05533 -0.00503 55 11XZ 0.06007 0.00694 0.04591 0.04098 -0.05714 56 11YZ 0.00097 0.05757 -0.01940 -0.04020 -0.05255 57 12XX 0.46777 0.03738 -0.27060 -0.04661 -0.38192 58 12YY 0.00288 0.25488 0.43402 -0.10079 -0.02152 59 12ZZ -0.20490 -0.40071 -0.11470 -0.05357 -0.01189 60 12XY -0.29479 0.26816 -0.20670 -0.26797 0.01042 61 12XZ -0.26879 -0.02030 -0.21301 -0.18283 0.27596 62 12YZ -0.01883 -0.30134 0.13063 0.16398 0.19761 63 5 C 1S -0.02713 -0.07663 -0.03336 -0.00533 0.00990 64 2S 0.13997 -0.02329 0.21470 -0.12979 0.11076 65 2PX 0.14898 -0.03336 0.12165 0.04260 -0.09565 66 2PY 0.02166 -0.02364 0.05277 0.01054 -0.00501 67 2PZ 0.06451 -0.00074 -0.02132 -0.06761 -0.02528 68 3S 0.33294 1.46228 0.14043 0.43729 -0.47400 69 3PX -0.18793 -0.06123 -0.32891 -0.13185 0.10608 70 3PY -0.27780 0.24608 -0.59166 -0.18351 0.19256 71 3PZ -0.09531 -0.90729 -0.00395 0.15717 -0.45782 72 4XX -0.00814 0.01514 -0.01147 -0.00203 -0.00694 73 4YY 0.00399 -0.05400 -0.00816 0.00117 0.01901 74 4ZZ 0.01810 -0.02200 0.03354 -0.01877 0.00889 75 4XY -0.01374 -0.04648 -0.02603 -0.01223 0.00913 76 4XZ -0.00794 0.00087 0.00979 -0.00805 0.00396 77 4YZ -0.01629 -0.00031 0.01562 0.00148 0.01396 78 6 C 1S 0.01297 0.01818 0.01807 0.01505 -0.02252 79 2S 0.01120 -0.04302 0.06505 -0.05406 0.15806 80 2PX -0.13200 -0.00977 -0.04160 0.16118 -0.04772 81 2PY 0.01697 -0.22109 0.08589 -0.05181 -0.02283 82 2PZ 0.01947 -0.08662 0.07364 -0.02271 -0.01708 83 3S -0.30486 -0.43291 -0.83215 -0.22851 0.20717 84 3PX 0.14566 -0.34389 0.15774 -0.06792 -0.20473 85 3PY 0.02247 -0.44185 0.26419 0.20279 -0.37465 86 3PZ -0.19028 -1.00696 -0.34018 -0.06251 -0.20930 87 4XX 0.00386 -0.00519 0.00502 -0.00596 -0.00224 88 4YY 0.01034 -0.00710 -0.00825 0.01113 -0.00490 89 4ZZ -0.01000 0.00147 0.01371 0.00085 0.02656 90 4XY 0.01318 -0.00631 -0.00217 -0.00255 -0.00609 91 4XZ 0.00813 0.00092 0.01068 0.00271 -0.00167 92 4YZ 0.00289 0.00968 0.00362 -0.00619 -0.00351 93 7 C 1S -0.01564 -0.01030 -0.02033 -0.00928 0.02309 94 2S 0.05381 0.07628 0.00978 -0.01724 -0.00277 95 2PX 0.03244 0.01362 -0.07721 0.00590 -0.06780 96 2PY 0.03744 -0.07733 -0.04556 0.00565 -0.05419 97 2PZ 0.04985 0.09818 0.09057 -0.00514 -0.01758 98 3S 0.41074 0.29527 0.77169 0.31949 -0.51043 99 3PX -0.11582 -0.54432 0.22131 0.07560 -0.17508 100 3PY -0.19274 -0.86884 0.22168 0.07940 -0.30748 101 3PZ 0.36690 0.66685 0.42816 0.18840 -0.23701 102 4XX -0.00247 0.01190 -0.00311 0.00616 -0.00221 103 4YY 0.00950 0.01776 0.00564 -0.01546 0.01068 104 4ZZ -0.00403 -0.00911 -0.00662 0.00452 0.00254 105 4XY -0.00182 0.01637 -0.00167 -0.00228 0.01434 106 4XZ 0.00183 0.00115 -0.00742 0.00433 -0.00352 107 4YZ 0.00952 -0.00136 -0.00589 -0.00048 -0.00625 108 8 C 1S 0.02026 0.02218 0.02555 0.00810 -0.02057 109 2S 0.00063 0.04664 -0.01590 -0.04567 0.06828 110 2PX -0.02786 0.04278 -0.03832 -0.02969 0.01197 111 2PY -0.03653 -0.01275 0.01559 -0.03079 0.08969 112 2PZ 0.03872 0.07092 -0.08858 -0.02567 0.01927 113 3S -0.67652 -1.03262 -0.82577 -0.23452 0.46526 114 3PX -0.23514 -0.35510 -0.29294 -0.09349 0.19256 115 3PY -0.38722 -0.62235 -0.50472 -0.17092 0.23657 116 3PZ -0.05921 0.62378 -0.12947 -0.05684 0.45197 117 4XX -0.00046 -0.00055 -0.00291 0.00010 0.00053 118 4YY -0.00012 -0.00790 0.00198 0.00496 -0.00603 119 4ZZ 0.00625 0.01711 0.00268 -0.01093 0.00729 120 4XY 0.00185 -0.00575 0.00040 0.00273 -0.00709 121 4XZ 0.00126 -0.00389 -0.00756 0.00171 -0.00260 122 4YZ 0.00345 -0.01027 -0.01190 0.00161 -0.00749 123 9 C 1S -0.01893 -0.00877 -0.01868 -0.00870 0.02163 124 2S 0.06460 0.05969 0.04755 -0.04466 0.00369 125 2PX 0.03088 0.09231 0.03936 -0.01074 -0.01436 126 2PY 0.04777 0.08607 0.11280 0.00495 0.02286 127 2PZ -0.05087 -0.04541 -0.00303 0.02292 0.03433 128 3S 0.45855 0.25724 0.67251 0.37466 -0.62880 129 3PX 0.16493 0.20154 0.04304 0.07142 -0.05203 130 3PY 0.24328 0.47688 0.03139 0.13997 -0.10725 131 3PZ -0.27803 -0.01726 -0.56537 -0.19412 0.49398 132 4XX 0.00464 -0.00089 0.00889 -0.00524 -0.00916 133 4YY -0.00430 0.00932 0.01003 0.00613 0.00826 134 4ZZ 0.00409 0.00143 -0.01527 -0.00708 0.00500 135 4XY -0.00114 -0.00143 0.00807 -0.00453 -0.00080 136 4XZ 0.00208 0.01741 0.00374 -0.00366 0.00664 137 4YZ 0.00324 0.03059 0.00614 -0.00548 0.01136 138 10 C 1S 0.02249 0.02582 0.01995 0.00601 -0.01320 139 2S 0.04593 -0.10983 0.00759 -0.09849 0.02610 140 2PX 0.09668 -0.16857 -0.02461 -0.10948 -0.19143 141 2PY -0.00164 -0.08880 -0.12734 0.04197 0.03885 142 2PZ -0.01987 0.08672 0.02416 0.04101 0.00585 143 3S -0.66062 -0.18383 -0.53268 -0.30538 0.61303 144 3PX -0.07633 0.46330 0.05817 0.14597 0.24958 145 3PY 0.07582 0.42290 0.22756 0.00925 0.10155 146 3PZ 0.34821 0.22964 0.39310 0.18364 -0.33304 147 4XX 0.00649 0.00538 0.00250 0.00170 0.00334 148 4YY 0.01462 0.01685 0.01658 -0.01831 0.00198 149 4ZZ -0.00363 -0.02930 -0.00878 -0.01330 -0.00016 150 4XY 0.01296 0.01407 0.01670 -0.00890 0.00962 151 4XZ -0.00896 -0.00581 -0.00584 0.00720 -0.00182 152 4YZ 0.00574 -0.02585 0.00909 0.00972 -0.01353 153 11 H 1S 0.01605 -0.10499 0.01960 0.00156 -0.04977 154 2S -0.03317 -0.13850 -0.08688 -0.08146 0.02820 155 12 H 1S -0.02917 -0.11000 -0.04575 0.01090 -0.01469 156 2S 0.20580 0.33464 0.21350 0.05730 -0.12834 157 13 H 1S 0.00353 -0.07463 -0.01389 0.03028 -0.05600 158 2S -0.19412 -0.11961 -0.21864 -0.12488 0.24183 159 14 H 1S -0.01837 -0.06171 -0.05280 0.01235 0.01334 160 2S 0.12662 0.22163 0.20771 0.05052 -0.10558 161 15 H 1S 0.03319 0.00108 0.00249 0.05067 -0.01344 162 2S 0.03090 -0.00143 0.01584 -0.07539 -0.03870 163 16 C 1S -0.04606 -0.01076 0.00691 -0.00061 -0.02534 164 2S 0.03750 -0.06539 0.10638 0.05121 -0.21141 165 2PX -0.01232 0.12859 -0.12292 0.03525 0.08497 166 2PY -0.12040 -0.02743 0.01954 0.12650 -0.04849 167 2PZ 0.07071 -0.08346 -0.02053 -0.24596 -0.10623 168 3S 0.47212 -0.18388 0.01278 -0.39973 0.71168 169 3PX 0.00606 1.10402 -0.66498 0.22582 -0.52267 170 3PY -0.93440 -0.27055 -0.18628 0.07339 -0.58110 171 3PZ -0.62182 -0.14401 -0.05147 0.18119 -0.38446 172 4XX -0.05278 -0.02414 0.02099 -0.01319 -0.05359 173 4YY -0.00736 -0.01116 0.01655 0.00315 -0.01440 174 4ZZ 0.02265 0.00155 -0.00352 0.00829 0.00844 175 4XY 0.02358 -0.01489 0.01001 0.00777 0.00250 176 4XZ 0.00356 -0.00318 0.00933 0.00242 0.00087 177 4YZ -0.01191 -0.01856 0.01084 0.00056 -0.01640 178 17 C 1S 0.02106 0.00858 -0.00918 -0.01084 0.00707 179 2S -0.00035 -0.07846 0.08656 0.04417 -0.07308 180 2PX 0.02148 0.03002 -0.00547 -0.01601 -0.02806 181 2PY -0.10391 -0.04234 0.07640 0.16600 0.04835 182 2PZ 0.12584 -0.16292 0.00823 -0.31389 -0.16163 183 3S -0.74602 -0.40327 0.27779 0.17328 -0.39482 184 3PX -0.21667 -0.78417 0.60725 0.07816 0.02872 185 3PY -0.89121 0.25468 -0.58429 0.01412 -0.85881 186 3PZ -0.60869 0.28450 -0.31577 0.36539 -0.24194 187 4XX -0.00816 -0.01862 0.00940 -0.01311 -0.01393 188 4YY 0.00736 0.00044 0.00467 0.01412 -0.00668 189 4ZZ 0.00381 -0.00034 0.00347 0.00574 0.00227 190 4XY 0.00318 0.01178 0.00032 0.00613 0.01500 191 4XZ 0.00758 0.00144 -0.00010 -0.01230 -0.00109 192 4YZ 0.00291 0.00173 0.00196 0.00108 -0.01064 193 18 C 1S -0.01925 0.01128 -0.00525 0.01149 -0.01457 194 2S 0.04796 -0.06350 0.04622 0.00967 -0.01162 195 2PX 0.14668 -0.03882 0.10681 0.03681 0.13981 196 2PY 0.03716 -0.02351 0.02019 0.08457 0.02142 197 2PZ 0.04664 -0.02556 -0.01052 -0.14857 -0.04706 198 3S 0.66643 0.29702 -0.18436 -0.22113 0.48305 199 3PX 0.84547 -0.62818 0.78776 -0.24964 0.69799 200 3PY 0.38212 0.26529 -0.23438 -0.18203 0.28333 201 3PZ 0.17893 0.14902 -0.13312 -0.00089 0.13577 202 4XX 0.01029 0.01965 -0.00981 0.01765 0.00180 203 4YY -0.00557 -0.00232 0.00459 0.00210 0.00307 204 4ZZ 0.00497 -0.01082 0.00375 -0.01295 -0.00360 205 4XY 0.00384 -0.00498 0.00155 -0.00048 0.00094 206 4XZ -0.00399 0.00121 0.00176 0.00648 0.00495 207 4YZ 0.00029 -0.00059 -0.00083 -0.00887 -0.00671 208 19 C 1S 0.02176 -0.00198 0.00124 -0.00626 0.01643 209 2S 0.02394 0.01592 0.00839 0.04423 -0.02739 210 2PX 0.01015 -0.08372 0.05484 -0.08832 0.02246 211 2PY -0.01614 -0.02854 0.06653 0.07235 -0.00245 212 2PZ 0.04580 -0.04727 0.00834 -0.17000 -0.06036 213 3S -0.90591 -0.28542 0.12614 0.12381 -0.55279 214 3PX 1.00169 -0.33895 0.51711 -0.15252 0.83611 215 3PY 0.26395 -0.55493 0.64130 -0.08657 0.30387 216 3PZ 0.08680 -0.26936 0.35419 0.11556 0.19546 217 4XX 0.01503 -0.00969 0.01269 0.00447 0.01094 218 4YY -0.00663 0.00033 -0.00351 -0.00008 -0.00854 219 4ZZ -0.00240 0.00311 -0.00280 0.00023 -0.00379 220 4XY 0.00781 0.00311 0.00349 0.00801 -0.00114 221 4XZ 0.00571 0.00063 0.00151 0.00537 -0.00084 222 4YZ -0.00510 -0.00294 -0.00050 -0.00295 -0.00532 223 20 C 1S -0.01280 0.00612 -0.00092 0.00759 -0.02091 224 2S 0.05995 -0.04006 0.03401 0.02701 0.04217 225 2PX -0.15088 0.04801 -0.06072 -0.03146 -0.13334 226 2PY 0.08678 -0.03989 0.08749 0.09753 0.15415 227 2PZ 0.08588 -0.04695 0.02999 -0.13464 0.03361 228 3S 0.56890 0.25398 -0.15432 -0.22798 0.43658 229 3PX -0.58873 0.12126 -0.22009 0.25898 -0.50045 230 3PY 0.21823 -0.69034 0.71562 -0.24150 0.28241 231 3PZ 0.10630 -0.36121 0.40802 -0.03384 0.19433 232 4XX -0.00540 0.00594 -0.00535 0.00243 -0.00812 233 4YY 0.00869 0.00186 0.00390 0.00478 -0.00116 234 4ZZ 0.00603 -0.00284 0.00144 -0.00077 0.00603 235 4XY -0.01626 -0.00678 -0.00153 -0.01345 -0.00431 236 4XZ -0.01137 -0.00296 0.00164 0.00293 0.00077 237 4YZ 0.00593 0.00429 0.00046 0.00270 -0.00565 238 21 C 1S 0.02842 0.00328 -0.00041 -0.00082 0.03256 239 2S -0.05799 -0.04267 0.05309 0.02675 -0.13840 240 2PX 0.16547 0.19189 -0.11139 0.08364 0.06757 241 2PY -0.02974 0.02414 0.01440 0.09792 0.07778 242 2PZ 0.07346 -0.02830 -0.04542 -0.26229 -0.02656 243 3S -0.47472 -0.04476 -0.13223 0.16403 -0.28605 244 3PX -0.74057 0.66407 -0.76066 0.15965 -0.76134 245 3PY 0.62363 0.26693 -0.00255 -0.15232 0.28057 246 3PZ 0.31933 0.14631 0.05266 0.17324 0.24659 247 4XX 0.02491 -0.00594 0.00906 0.01315 0.01237 248 4YY -0.01292 0.00012 -0.00351 -0.00927 -0.00856 249 4ZZ -0.00763 -0.00019 0.00085 0.00439 -0.00450 250 4XY -0.02340 0.01426 -0.01491 -0.00310 -0.02288 251 4XZ -0.01266 0.00737 -0.00982 -0.00111 -0.01354 252 4YZ -0.00601 0.00089 -0.00195 0.00450 0.00425 253 22 H 1S -0.05207 0.01422 -0.03672 -0.01654 -0.00045 254 2S -0.25240 -0.33215 0.12445 0.00020 -0.06661 255 23 H 1S -0.06493 0.00378 -0.01759 -0.01834 -0.04680 256 2S 0.30495 0.03972 0.00639 -0.03210 0.20267 257 24 H 1S -0.02495 -0.03691 0.01002 -0.04005 0.01289 258 2S -0.20229 0.01438 0.01323 0.08610 -0.19083 259 25 H 1S -0.03396 -0.01912 0.00925 -0.01433 -0.01215 260 2S 0.25338 0.08012 -0.06466 -0.04127 0.17661 261 26 H 1S 0.02345 -0.04679 0.02821 -0.06885 -0.01152 262 2S -0.20367 -0.36040 0.21737 0.08209 -0.13622 263 27 H 1S -0.06890 -0.01722 0.03110 0.01425 -0.22749 264 2S 0.04434 0.25314 -0.06416 0.19076 -0.39224 106 107 108 109 110 V V V V V Eigenvalues -- 0.47875 0.48807 0.49595 0.51095 0.51709 1 1 C 1S -0.00793 0.00881 -0.01476 0.02108 0.00221 2 2S -0.11540 0.00384 -0.06695 -0.07915 0.09296 3 2PX -0.18497 0.08173 -0.09298 0.05887 0.11313 4 2PY 0.07210 -0.00462 0.09034 0.10997 -0.15038 5 2PZ -0.05984 0.01982 -0.05146 -0.13734 0.25793 6 3S 1.18559 1.18862 0.44785 -0.45212 0.26054 7 3PX 0.69124 0.00268 0.36957 0.42049 0.61692 8 3PY -0.28060 -0.50934 -0.36400 0.42104 -0.05118 9 3PZ -0.10284 -0.40547 -0.16832 0.36825 -0.51745 10 4XX -0.01303 0.02839 -0.00055 -0.02237 0.01873 11 4YY -0.00418 0.01457 -0.00683 0.01237 0.01893 12 4ZZ 0.00135 -0.01190 -0.01027 0.00301 -0.00700 13 4XY 0.01705 -0.01586 0.01935 -0.00125 0.01437 14 4XZ 0.00321 -0.00680 0.01574 -0.00519 0.01253 15 4YZ 0.01422 0.01176 -0.01007 0.02053 0.01709 16 2 C 1S 0.01294 -0.01000 0.01212 -0.00959 -0.01247 17 2S -0.13784 0.14327 -0.06330 0.04305 0.08338 18 2PX -0.02016 0.06358 -0.00854 0.01047 0.12981 19 2PY -0.15862 0.04169 0.10897 0.07360 0.12331 20 2PZ 0.10140 -0.03500 0.00299 -0.09188 -0.08233 21 3S 0.26376 -0.41062 -0.15426 -0.01013 0.00278 22 3PX 0.06866 -0.26849 0.07345 0.59374 0.20877 23 3PY 0.46259 -0.02259 0.01699 -0.12514 0.00523 24 3PZ -0.33633 0.24187 0.15839 0.43586 0.45362 25 4XX 0.00035 -0.00042 0.01138 -0.01465 -0.00165 26 4YY -0.00723 0.00885 -0.00198 -0.00538 0.00305 27 4ZZ -0.00322 -0.00416 -0.01434 0.01890 0.00202 28 4XY -0.01259 0.00455 -0.01189 0.00008 -0.00854 29 4XZ -0.00852 -0.00458 -0.01866 0.01151 -0.01024 30 4YZ -0.01102 -0.00511 -0.01860 -0.00095 0.00527 31 3 H 1S 0.06832 -0.07994 -0.04532 -0.00619 0.01812 32 2S 0.17245 -0.16461 -0.05279 -0.12539 -0.18937 33 4 Br 1S -0.00168 0.00081 0.00052 0.00166 0.00194 34 2S 0.01048 -0.00499 -0.00260 -0.01211 -0.01160 35 3S -0.01150 0.00511 0.00141 0.01699 0.01133 36 4S -0.02482 0.01314 0.00881 0.02280 0.03094 37 5S 0.28861 -0.09701 -0.08868 -0.31696 -0.13367 38 6S -0.67654 0.22033 0.20241 0.72718 0.25573 39 7PX 0.03080 0.01909 0.03952 0.02307 -0.00977 40 7PY -0.00283 -0.00595 0.01560 0.02061 0.01081 41 7PZ 0.05579 -0.04447 0.00521 0.00383 -0.01222 42 8PX -0.09907 -0.06147 -0.12718 -0.07424 0.03137 43 8PY 0.00907 0.01927 -0.05012 -0.06640 -0.03457 44 8PZ -0.17940 0.14307 -0.01679 -0.01236 0.03930 45 9PX 0.32652 0.20449 0.41790 0.24484 -0.09981 46 9PY -0.03615 -0.06537 0.16649 0.22926 0.10657 47 9PZ 0.59400 -0.47437 0.05255 0.03753 -0.12976 48 10PX -0.32613 -0.16915 -0.36230 -0.22763 0.08787 49 10PY 0.24353 -0.01540 -0.22875 -0.40914 -0.18076 50 10PZ -0.70811 0.50633 0.00592 0.08006 0.18348 51 11XX 0.00284 0.01634 0.05393 -0.01242 -0.00081 52 11YY 0.01053 -0.00871 -0.01740 -0.01570 0.00494 53 11ZZ 0.00070 -0.01429 -0.03764 0.00491 -0.01809 54 11XY -0.01667 0.00555 0.00532 -0.00315 -0.01951 55 11XZ -0.03994 -0.00610 -0.03761 0.04037 -0.02080 56 11YZ 0.03195 -0.02672 -0.01397 -0.00171 -0.02847 57 12XX 0.11445 -0.11892 -0.27623 -0.09873 -0.04795 58 12YY 0.02636 0.02344 0.07186 -0.04039 -0.04612 59 12ZZ 0.09105 0.03934 0.15712 -0.16788 0.04698 60 12XY 0.08640 -0.03409 -0.03278 0.01366 0.09130 61 12XZ 0.18417 0.03731 0.18476 -0.19504 0.09959 62 12YZ -0.10671 0.10775 0.05036 -0.02616 0.11678 63 5 C 1S 0.00044 0.00078 -0.00623 0.00869 0.00821 64 2S -0.02115 -0.03974 -0.15055 0.04197 0.03349 65 2PX -0.01898 0.01471 0.03688 0.01732 0.01419 66 2PY -0.03009 -0.06819 -0.09875 -0.02016 -0.06710 67 2PZ -0.02753 -0.01880 -0.01967 -0.03901 0.06779 68 3S -0.02987 0.00005 0.09248 -0.29561 -0.42607 69 3PX 0.14001 0.10193 0.08319 0.30743 0.38711 70 3PY -0.05508 0.10941 0.24187 0.80971 0.76365 71 3PZ 0.86279 -0.29606 0.36220 -0.67925 -0.55355 72 4XX -0.00399 -0.00521 -0.00185 -0.00836 -0.00519 73 4YY 0.00189 -0.01107 -0.01700 0.00375 -0.01898 74 4ZZ -0.01155 0.00101 -0.02175 0.01313 0.02319 75 4XY 0.00541 -0.00251 -0.03295 0.00769 -0.00993 76 4XZ -0.01035 0.01405 0.00071 -0.00238 0.01024 77 4YZ -0.01466 0.01281 0.01112 -0.00993 0.00246 78 6 C 1S 0.00171 -0.01026 -0.02175 -0.01887 -0.04178 79 2S -0.01674 0.03019 -0.09210 0.03959 0.02614 80 2PX 0.05749 0.02819 0.10738 0.07322 -0.07392 81 2PY -0.04748 -0.03249 -0.08555 -0.13265 -0.05588 82 2PZ -0.03698 0.04734 -0.01790 -0.00060 0.07895 83 3S 0.38469 -0.05146 0.61864 0.62086 0.73453 84 3PX 0.20977 -0.10638 -0.14072 -0.59599 -0.39722 85 3PY 0.39901 -0.23347 0.01485 -0.75839 -0.78241 86 3PZ 0.64047 -0.15951 0.12467 -0.30859 -0.20338 87 4XX -0.00973 -0.01041 -0.00126 -0.00560 0.00699 88 4YY 0.01183 -0.01174 -0.02019 0.00628 -0.02800 89 4ZZ 0.00166 0.00635 -0.00576 -0.00077 -0.01177 90 4XY 0.01626 -0.00811 -0.03015 -0.00624 -0.02887 91 4XZ 0.00981 -0.00626 0.00999 0.00810 0.00032 92 4YZ 0.01547 -0.00544 0.00939 0.00919 0.01217 93 7 C 1S 0.00548 0.00598 0.01960 0.01616 0.02531 94 2S 0.08324 0.08638 -0.07558 -0.00952 -0.01344 95 2PX 0.12800 0.09509 -0.03382 -0.08377 -0.06463 96 2PY 0.09151 -0.18391 -0.10282 -0.00532 -0.20576 97 2PZ -0.00822 0.02233 -0.00546 0.01568 0.04081 98 3S -0.36039 -0.13182 -0.33948 -0.74201 -0.67719 99 3PX 0.20501 -0.17987 0.07231 -0.41909 -0.36209 100 3PY 0.45178 0.00939 0.12922 -0.81821 -0.49638 101 3PZ -0.34086 -0.01732 -0.31188 -0.25415 -0.35635 102 4XX 0.00289 -0.00421 0.00347 0.01023 -0.00294 103 4YY 0.00641 0.01181 0.00188 -0.00297 0.01920 104 4ZZ 0.00409 0.02101 -0.00821 -0.01373 -0.00863 105 4XY 0.00569 0.00847 0.00784 0.00727 0.01111 106 4XZ -0.00043 0.00151 -0.00855 -0.00254 -0.00864 107 4YZ -0.00702 -0.00869 -0.01813 -0.00387 -0.01257 108 8 C 1S -0.00714 -0.00001 -0.01320 -0.02047 -0.01614 109 2S 0.06108 0.07923 0.01258 0.03566 0.07602 110 2PX 0.07532 0.14805 0.07050 -0.01377 0.13515 111 2PY 0.00413 -0.03866 0.05655 0.06464 0.03668 112 2PZ -0.01543 -0.08332 -0.09958 0.10343 -0.04977 113 3S 0.16576 -0.00572 0.27824 0.57351 0.50870 114 3PX 0.09974 -0.11657 0.09325 0.20630 0.05831 115 3PY 0.31466 -0.02091 0.21020 0.20690 0.19164 116 3PZ -0.67997 0.37823 0.03406 0.76305 0.85308 117 4XX 0.00201 0.00820 0.00107 -0.00388 0.00242 118 4YY -0.00126 0.00558 -0.00481 -0.00603 -0.00587 119 4ZZ 0.00929 0.00448 -0.00091 0.00782 0.01361 120 4XY 0.00134 0.01359 -0.00909 -0.01366 -0.00496 121 4XZ 0.00298 -0.00436 -0.00575 -0.00290 -0.00768 122 4YZ 0.00446 -0.00860 -0.01126 -0.00908 -0.01857 123 9 C 1S 0.00869 -0.00385 0.01081 0.02042 0.00605 124 2S 0.01130 0.08780 -0.02304 0.00534 0.11042 125 2PX -0.01457 0.18754 0.05919 -0.02336 0.20360 126 2PY -0.11735 0.03270 0.02489 0.04876 0.11384 127 2PZ -0.07244 0.05694 0.04664 0.03300 0.07595 128 3S -0.15882 -0.05649 -0.39616 -0.74881 -0.78131 129 3PX -0.27164 -0.03130 -0.26292 0.08171 -0.08824 130 3PY -0.39838 0.12813 -0.38728 0.06967 -0.05812 131 3PZ -0.29949 0.11213 -0.05487 0.82694 0.62582 132 4XX 0.00193 0.00750 0.00191 -0.01004 0.01089 133 4YY 0.00243 0.00652 0.00721 0.00397 -0.00468 134 4ZZ 0.00720 -0.00058 -0.01123 0.00698 -0.00177 135 4XY 0.00956 0.00913 0.00262 -0.00532 0.00125 136 4XZ -0.00131 -0.00523 0.00415 0.01088 0.00379 137 4YZ 0.00052 0.00083 0.00873 0.01338 0.01340 138 10 C 1S -0.01719 0.01079 -0.00207 -0.01825 0.00633 139 2S 0.07699 0.02634 -0.08343 0.06392 0.07262 140 2PX 0.07044 0.09456 -0.07139 -0.11976 0.15964 141 2PY -0.06392 -0.12637 -0.15063 0.11439 -0.10357 142 2PZ -0.05010 0.00883 0.04315 -0.06719 -0.04956 143 3S 0.01959 -0.01225 0.40460 0.70762 0.58374 144 3PX -0.46113 0.09900 -0.10756 0.36589 0.04622 145 3PY -0.56080 0.43515 -0.17291 0.26990 0.46642 146 3PZ 0.11096 -0.12112 -0.15157 -0.60550 -0.59673 147 4XX -0.00399 -0.00303 0.00422 0.01448 0.00454 148 4YY -0.00849 0.01896 0.00154 0.00548 0.04404 149 4ZZ 0.00973 0.00212 -0.01672 -0.00902 -0.00743 150 4XY -0.01613 0.01541 0.00299 0.01045 0.03398 151 4XZ -0.00315 0.00317 -0.00348 -0.00124 -0.00574 152 4YZ -0.00298 0.00837 -0.00151 -0.01312 -0.00183 153 11 H 1S -0.00674 0.03052 -0.05408 -0.08510 -0.02474 154 2S 0.05445 0.02125 0.08152 0.20782 0.27465 155 12 H 1S 0.02743 0.00543 -0.03605 -0.03006 -0.06487 156 2S -0.06707 0.02052 -0.07416 -0.14620 -0.09621 157 13 H 1S -0.00568 0.02245 -0.06868 -0.08137 -0.08028 158 2S 0.07998 0.01077 0.14727 0.24662 0.22719 159 14 H 1S -0.00137 0.04681 -0.02906 -0.03529 -0.02165 160 2S -0.01121 -0.02403 -0.05750 -0.14074 -0.15025 161 15 H 1S -0.01300 0.00118 -0.14352 -0.05631 -0.16462 162 2S 0.00560 0.08969 -0.07608 0.14274 0.22174 163 16 C 1S -0.05830 -0.04656 -0.00231 0.00734 0.02083 164 2S 0.09877 0.03844 0.12287 -0.16453 0.19533 165 2PX 0.06125 -0.02071 0.20166 -0.37614 -0.03489 166 2PY -0.09139 0.01007 -0.15185 -0.14786 -0.15765 167 2PZ -0.19920 0.02950 0.01552 -0.03610 -0.10743 168 3S 0.94608 1.22009 -0.59923 -0.13000 -0.68760 169 3PX 0.64995 2.00265 0.02677 -1.42249 0.08106 170 3PY -1.70860 -0.91734 -0.17027 -0.85432 -0.63627 171 3PZ -0.83948 -0.48140 -0.11703 -0.48235 -0.18542 172 4XX -0.00898 -0.00359 -0.00990 0.01728 0.04988 173 4YY -0.00736 -0.00852 0.01277 -0.03530 0.01180 174 4ZZ 0.01031 0.00626 0.00750 -0.01180 -0.01242 175 4XY 0.00199 -0.02414 0.01884 -0.00248 0.01745 176 4XZ 0.00568 -0.01519 0.01280 0.00405 0.00403 177 4YZ -0.02364 -0.01318 0.00049 -0.02672 0.01622 178 17 C 1S 0.06223 0.07214 -0.01038 0.00471 0.02576 179 2S -0.05010 -0.18208 0.15217 -0.12589 0.18274 180 2PX -0.00496 -0.16504 0.13145 -0.05702 0.11047 181 2PY -0.12345 -0.10898 -0.10932 -0.18031 -0.03818 182 2PZ -0.18318 0.07021 0.11346 -0.14259 0.08771 183 3S -1.82454 -2.17848 0.01663 0.70020 -0.47252 184 3PX -1.11072 -1.82855 -0.05663 1.12832 -0.22815 185 3PY -1.07706 0.13583 -0.05388 -1.23959 -0.18858 186 3PZ -0.48820 -0.01070 -0.15727 -0.61263 -0.33213 187 4XX 0.01346 0.03370 -0.02251 0.00878 0.03111 188 4YY 0.00407 -0.02169 0.03103 -0.00005 0.02295 189 4ZZ -0.01020 -0.02389 0.00885 -0.00583 -0.00392 190 4XY 0.00977 0.01644 -0.00654 -0.00239 -0.02061 191 4XZ 0.00207 0.01044 0.00119 -0.00520 -0.00550 192 4YZ 0.01360 -0.00236 0.01247 0.00348 0.03740 193 18 C 1S -0.05207 -0.06043 0.01424 -0.00614 -0.01052 194 2S 0.08089 -0.06772 0.12877 -0.09110 0.21214 195 2PX 0.06536 -0.09280 0.09642 0.03705 -0.09913 196 2PY 0.16033 -0.03205 -0.06615 -0.06330 0.23150 197 2PZ -0.05987 0.10268 0.26557 0.08663 -0.14535 198 3S 1.90456 2.39734 -0.17457 -0.48813 -0.12852 199 3PX 1.15459 -0.33855 0.07345 1.90241 0.34586 200 3PY 1.05583 1.59996 -0.05757 -0.51361 -0.18288 201 3PZ 0.65533 0.80040 -0.26959 -0.44532 0.17795 202 4XX 0.00320 -0.03737 0.05473 -0.05180 0.01074 203 4YY 0.00555 0.01038 -0.01813 0.00264 0.00672 204 4ZZ 0.00176 0.01151 -0.00314 0.01154 0.00272 205 4XY -0.00976 0.00560 -0.00926 -0.01524 -0.00444 206 4XZ -0.00645 0.00464 -0.00068 0.00104 -0.01895 207 4YZ -0.00287 0.00814 0.00313 -0.00754 0.00063 208 19 C 1S 0.04905 0.05735 -0.00812 -0.00782 -0.00229 209 2S -0.00883 -0.18175 0.19444 -0.15026 0.17423 210 2PX 0.14137 0.17041 -0.14679 0.29206 0.05599 211 2PY 0.11276 -0.18971 -0.08176 0.15986 0.32810 212 2PZ -0.09813 0.01385 0.28614 0.22752 -0.17949 213 3S -1.82056 -1.87572 -0.07849 0.60031 -0.00316 214 3PX 1.64428 0.77082 0.18855 0.64330 -0.00650 215 3PY -0.17593 -1.13814 0.27235 1.29723 -0.04517 216 3PZ -0.02267 -0.73412 -0.10892 0.57483 0.25635 217 4XX 0.00875 -0.00310 0.00935 -0.00468 0.00900 218 4YY 0.00028 -0.01032 0.00308 -0.01676 0.03067 219 4ZZ -0.00665 -0.00779 0.01103 0.00196 -0.00881 220 4XY -0.00330 -0.03521 0.03535 -0.00639 0.01092 221 4XZ 0.00146 -0.02297 0.00752 -0.00974 0.02177 222 4YZ 0.00237 0.00339 0.00693 -0.00649 0.00943 223 20 C 1S -0.04760 -0.05895 0.00513 0.02991 0.02053 224 2S 0.07023 -0.08097 0.16991 -0.22448 0.10361 225 2PX -0.14924 0.02586 -0.13995 0.16894 0.04572 226 2PY 0.11260 -0.08539 -0.08899 -0.04721 -0.00457 227 2PZ -0.08134 0.06338 0.26701 0.12015 -0.32759 228 3S 1.94116 2.49946 -0.23134 -0.44986 -0.18411 229 3PX -1.67606 -1.59846 0.12958 -0.24327 -0.02254 230 3PY 0.37161 -0.73926 0.19276 1.71419 0.37722 231 3PZ 0.33685 -0.43644 -0.12800 0.82123 0.50749 232 4XX -0.00994 0.01350 -0.00772 -0.00803 0.00928 233 4YY 0.01474 -0.02032 0.03170 -0.00074 0.01994 234 4ZZ 0.00562 -0.00476 0.00359 -0.00969 0.00649 235 4XY -0.00795 0.01617 -0.01522 0.01757 -0.00909 236 4XZ 0.00579 0.00268 -0.02156 0.00370 0.00282 237 4YZ 0.00681 -0.01629 0.01629 -0.00007 0.03507 238 21 C 1S 0.05882 0.05607 0.01031 -0.04297 -0.02726 239 2S -0.06966 -0.13904 0.12780 -0.15123 0.20607 240 2PX 0.02902 0.09204 0.09089 -0.24208 -0.13456 241 2PY 0.18080 0.13479 -0.20188 -0.05897 -0.11377 242 2PZ -0.12950 0.19572 0.14636 0.05890 -0.11688 243 3S -1.83905 -2.12113 -0.06787 0.67932 -0.04705 244 3PX -0.94746 0.36432 -0.22674 -1.47920 -0.20958 245 3PY 1.34416 1.46133 0.24946 -0.22537 0.11862 246 3PZ 0.94223 0.66796 -0.08069 -0.15952 0.03642 247 4XX 0.01334 -0.03949 0.05372 -0.06454 0.00120 248 4YY -0.00671 0.02516 -0.00672 -0.01071 -0.00359 249 4ZZ -0.00455 -0.00336 -0.01427 0.01425 0.00804 250 4XY -0.00427 0.01217 -0.01283 0.00524 0.01536 251 4XZ -0.00587 0.01179 -0.00184 0.00628 0.00362 252 4YZ 0.00966 0.02067 -0.00442 -0.03051 -0.00984 253 22 H 1S 0.03545 0.19156 -0.06879 -0.11255 -0.07616 254 2S -0.61631 -0.85408 0.02450 0.21004 0.01885 255 23 H 1S -0.06581 0.04548 -0.08309 0.05389 0.02726 256 2S 0.62100 0.59015 0.07672 -0.28002 -0.05136 257 24 H 1S 0.04929 0.17644 -0.10654 0.00370 -0.01470 258 2S -0.54309 -0.73082 0.14869 0.08206 0.12748 259 25 H 1S -0.05043 0.02708 -0.05653 -0.01341 -0.04465 260 2S 0.57773 0.55056 0.05631 -0.18277 0.06243 261 26 H 1S 0.12852 0.22398 -0.11956 0.05323 0.08071 262 2S -0.60685 -0.80364 0.04594 0.24749 -0.05139 263 27 H 1S 0.06137 0.03658 0.02116 0.07672 0.07831 264 2S -0.18313 0.25742 0.04544 -0.49694 -0.09846 111 112 113 114 115 V V V V V Eigenvalues -- 0.52041 0.52472 0.53374 0.54212 0.54907 1 1 C 1S 0.01260 0.00561 -0.01554 -0.00590 0.00047 2 2S -0.05686 -0.10395 0.07552 -0.08805 -0.00465 3 2PX -0.10338 -0.04226 0.08739 0.00196 0.05813 4 2PY 0.03735 0.04781 -0.04312 0.18901 -0.05602 5 2PZ 0.02366 0.14217 -0.22603 -0.22312 -0.01421 6 3S -0.69923 -0.13585 -0.16519 -0.13786 -0.12682 7 3PX -0.89595 0.31845 0.01608 0.55628 -0.15075 8 3PY 0.20982 0.15206 -0.05026 -0.08653 0.09544 9 3PZ 0.14370 0.03082 0.18624 0.45252 0.05962 10 4XX 0.00580 -0.00761 -0.03715 -0.02417 -0.00288 11 4YY -0.01894 0.00375 -0.00197 -0.01693 -0.00286 12 4ZZ 0.00873 -0.00413 0.01820 0.01470 0.00194 13 4XY -0.02362 -0.00031 -0.00913 -0.00228 0.01373 14 4XZ -0.01067 0.00394 -0.01209 0.01570 0.01259 15 4YZ -0.00316 -0.01029 -0.00907 -0.00812 -0.00722 16 2 C 1S 0.01213 0.00233 0.00950 -0.01371 -0.00700 17 2S 0.01080 -0.04247 -0.04072 0.00544 -0.01495 18 2PX -0.02219 0.07552 -0.20344 -0.10108 0.01640 19 2PY 0.01542 0.01163 0.03172 -0.01898 0.04027 20 2PZ 0.04388 0.00330 -0.00993 0.05505 -0.03195 21 3S -0.95865 0.78895 -0.34606 0.39794 0.37771 22 3PX -0.18051 -0.07908 0.57371 0.54448 -0.16074 23 3PY 0.07532 -0.28175 0.20524 0.03179 -0.40884 24 3PZ -0.02092 -0.18681 0.43118 -0.41384 -0.12921 25 4XX 0.00281 0.00219 -0.01639 0.00081 -0.00640 26 4YY -0.00304 0.01844 -0.00523 0.00948 0.00109 27 4ZZ 0.00130 -0.00720 0.02187 -0.01547 -0.00155 28 4XY 0.00922 0.00988 0.00438 0.00234 -0.00849 29 4XZ 0.00096 0.00027 0.01936 -0.01091 -0.01073 30 4YZ -0.02177 0.01218 0.00469 0.00738 -0.00244 31 3 H 1S -0.07677 0.01851 0.01030 -0.00862 0.00842 32 2S 0.08903 0.10559 -0.20738 0.19271 0.06092 33 4 Br 1S -0.00017 -0.00027 0.00020 0.00037 0.00110 34 2S 0.00313 0.00042 -0.00135 -0.00384 -0.00744 35 3S -0.00819 0.00231 0.00177 0.00787 0.00939 36 4S 0.00148 -0.00590 0.00243 0.00198 0.01587 37 5S 0.12138 -0.04996 -0.09435 -0.13242 -0.13140 38 6S -0.26568 0.12604 0.25242 0.23537 0.26838 39 7PX -0.00209 -0.02160 -0.01820 0.00037 -0.00380 40 7PY 0.02073 -0.00426 -0.00514 -0.01384 0.01636 41 7PZ 0.03156 -0.00160 0.00464 -0.02874 0.00934 42 8PX 0.00674 0.06961 0.05867 -0.00106 0.01226 43 8PY -0.06658 0.01359 0.01656 0.04435 -0.05275 44 8PZ -0.10181 0.00519 -0.01500 0.09288 -0.03015 45 9PX -0.02195 -0.23394 -0.19639 -0.00400 -0.04139 46 9PY 0.21418 -0.03892 -0.05100 -0.13811 0.17925 47 9PZ 0.34576 -0.01913 0.05132 -0.32457 0.10099 48 10PX 0.01624 0.23617 0.17101 0.00953 0.05082 49 10PY -0.20432 0.03934 -0.05967 0.17273 -0.21547 50 10PZ -0.33754 0.02157 -0.01030 0.32777 -0.05150 51 11XX 0.02463 0.02436 -0.01222 -0.04656 0.00972 52 11YY -0.02407 -0.00255 -0.01478 0.02966 0.00072 53 11ZZ 0.01148 -0.02609 0.02494 0.00596 -0.02279 54 11XY 0.02788 -0.00095 0.02025 -0.02820 0.00481 55 11XZ 0.02604 -0.02516 0.04405 -0.00457 -0.00621 56 11YZ 0.00677 -0.00859 0.00794 0.01890 -0.00244 57 12XX -0.03899 -0.15158 0.01548 0.15384 -0.11038 58 12YY 0.20359 -0.03463 0.05790 -0.24113 -0.06309 59 12ZZ 0.02939 0.08787 -0.16023 -0.10729 0.05865 60 12XY -0.13464 0.00482 -0.09044 0.14040 -0.02445 61 12XZ -0.12656 0.12375 -0.21946 0.01880 0.03278 62 12YZ -0.03866 0.04546 -0.05476 -0.08434 0.00241 63 5 C 1S 0.03077 -0.04684 0.02293 0.00921 -0.02793 64 2S -0.10501 -0.13342 -0.05752 0.03531 0.08622 65 2PX 0.18881 0.08546 0.16348 -0.00694 -0.03497 66 2PY -0.08472 0.02484 0.13990 -0.02433 -0.16941 67 2PZ 0.10173 0.02818 -0.09058 0.08394 0.01071 68 3S -1.22770 1.43744 -0.68442 0.21930 0.91406 69 3PX 0.40831 -0.82458 0.49751 -0.31464 -0.66000 70 3PY 0.85377 -1.29686 1.17207 -0.19304 -0.92276 71 3PZ 0.78407 -0.18810 -0.80984 0.68067 0.12764 72 4XX -0.00980 0.01428 0.00289 0.00658 0.00496 73 4YY -0.00660 -0.00277 0.00784 -0.00611 0.00307 74 4ZZ 0.00011 -0.05183 -0.00722 0.02444 0.00458 75 4XY -0.02325 -0.01253 0.01368 0.01927 -0.00556 76 4XZ 0.00944 0.00520 -0.00671 0.01561 -0.00048 77 4YZ 0.01226 0.01463 -0.01525 -0.00393 0.00204 78 6 C 1S -0.05966 0.04034 -0.01228 -0.00050 0.02980 79 2S -0.06036 -0.22301 -0.06726 -0.03365 0.01265 80 2PX 0.04438 0.20901 0.12485 -0.14839 0.10352 81 2PY -0.07144 0.01680 -0.10146 0.16148 0.00939 82 2PZ 0.08209 -0.19436 -0.06958 0.16759 -0.03088 83 3S 1.70444 -1.37257 0.93372 -0.07664 -1.16880 84 3PX -0.21827 0.33501 -0.74415 0.54108 0.42045 85 3PY -0.35355 0.91504 -1.09217 0.24534 0.89654 86 3PZ 0.94643 -0.61996 -0.02734 0.19667 -0.45811 87 4XX 0.01008 -0.01214 -0.00273 0.00857 -0.00339 88 4YY -0.02360 -0.00998 0.01289 -0.01273 0.00291 89 4ZZ -0.02264 -0.00697 -0.01192 -0.01482 0.01019 90 4XY -0.03898 -0.01260 0.00488 0.00483 0.00242 91 4XZ 0.01101 -0.02167 -0.00302 -0.01451 0.00325 92 4YZ 0.01136 -0.02900 0.00432 0.00335 -0.00024 93 7 C 1S 0.05226 -0.03663 0.01119 -0.01342 -0.03064 94 2S -0.15812 -0.19896 -0.08201 0.02197 0.02819 95 2PX 0.03699 0.17210 0.25657 0.02597 0.00550 96 2PY -0.15252 -0.12683 -0.11944 -0.04228 0.03064 97 2PZ -0.07968 -0.07354 -0.05664 0.03352 0.05102 98 3S -1.39330 1.75833 -1.01238 0.26475 1.23664 99 3PX 0.00815 0.17281 -0.83152 0.25145 0.39050 100 3PY 0.27856 0.50928 -0.89925 0.58583 0.51607 101 3PZ -1.23168 1.10983 -0.40320 0.00684 0.77225 102 4XX -0.00514 -0.00372 -0.00075 -0.00952 0.00592 103 4YY 0.00443 -0.02763 -0.01737 0.00536 0.00296 104 4ZZ -0.01330 -0.00022 -0.01519 -0.00149 -0.00758 105 4XY 0.00519 -0.02065 -0.01943 -0.01383 0.00293 106 4XZ -0.00772 0.01565 0.01957 -0.00133 -0.00616 107 4YZ -0.01706 0.00834 0.01018 0.00341 -0.00974 108 8 C 1S -0.04529 0.03938 -0.02522 0.01621 0.03167 109 2S 0.00471 -0.23653 -0.07409 0.00870 -0.00719 110 2PX 0.18229 0.10967 0.27018 0.12294 0.00563 111 2PY 0.05433 -0.27178 -0.22999 -0.10120 -0.02122 112 2PZ -0.12038 -0.07375 0.21422 -0.06177 -0.07127 113 3S 1.46552 -1.29222 1.09138 -0.29204 -1.21190 114 3PX 0.48739 -0.65348 0.11132 -0.16541 -0.45216 115 3PY 1.01363 -0.71984 0.63202 -0.00107 -0.67955 116 3PZ -0.07896 -0.38004 0.82629 -0.53617 -0.53513 117 4XX 0.00649 0.00889 0.01502 0.00302 -0.00509 118 4YY -0.01670 -0.00118 -0.01758 -0.00255 -0.00109 119 4ZZ -0.00070 -0.04411 -0.00960 0.01339 0.00508 120 4XY -0.01697 0.01252 0.00149 0.01333 0.00078 121 4XZ -0.00433 0.00953 0.00587 0.00564 0.00178 122 4YZ -0.01078 0.01373 -0.00036 -0.00572 -0.00046 123 9 C 1S 0.03807 -0.03864 0.03861 -0.01520 -0.03580 124 2S -0.06143 -0.17572 -0.14602 0.07622 0.05791 125 2PX 0.13887 0.18144 0.19212 0.15619 0.04331 126 2PY -0.07952 -0.15259 -0.28287 -0.09965 0.03304 127 2PZ 0.05276 0.03664 0.01682 -0.07302 -0.06021 128 3S -1.46388 1.69071 -0.97483 0.30048 1.15791 129 3PX -0.72364 0.18476 -0.12748 -0.24959 0.12230 130 3PY -1.03190 0.71087 0.26668 -0.00615 0.30804 131 3PZ 0.36860 -0.97972 1.28621 -0.50677 -0.92033 132 4XX 0.00595 0.00645 -0.01137 0.00674 0.00461 133 4YY -0.00369 -0.01753 -0.00948 0.00283 0.00086 134 4ZZ -0.01331 -0.01864 0.00899 -0.00195 -0.00407 135 4XY 0.00477 -0.00789 -0.00175 0.00454 -0.00556 136 4XZ -0.00024 -0.02272 -0.01161 -0.00971 0.00366 137 4YZ 0.00831 -0.02023 0.00455 0.00173 0.00755 138 10 C 1S -0.03153 0.04479 -0.05084 0.00888 0.03989 139 2S -0.03941 -0.26742 -0.04833 0.10330 -0.02117 140 2PX 0.09892 0.19949 0.10027 0.06349 -0.01247 141 2PY -0.23408 -0.13471 0.07450 -0.00682 -0.03234 142 2PZ -0.01847 0.21248 -0.09267 -0.01238 0.07581 143 3S 1.49957 -1.31814 1.35696 -0.59199 -1.20075 144 3PX -0.55618 -0.03048 0.28477 -0.20529 -0.00708 145 3PY -0.53798 0.27369 0.41339 -0.41405 -0.10466 146 3PZ -0.85860 1.10536 -1.10164 0.40411 1.02144 147 4XX 0.00457 -0.02301 0.00412 -0.00341 -0.00599 148 4YY 0.01054 -0.02585 -0.02023 0.00861 0.00271 149 4ZZ -0.01845 0.01155 -0.01814 0.01411 0.01027 150 4XY 0.00205 -0.02156 -0.03137 0.00397 0.01272 151 4XZ -0.01599 0.00808 0.00298 0.00309 -0.00237 152 4YZ -0.00122 0.01619 -0.00541 0.00245 -0.00408 153 11 H 1S -0.09254 0.13531 -0.10907 0.04167 0.05469 154 2S 0.44149 -0.62870 0.35338 -0.06315 -0.42119 155 12 H 1S -0.01563 0.02000 0.06039 -0.00573 -0.07508 156 2S -0.42036 0.34175 -0.37574 0.12523 0.39619 157 13 H 1S -0.13086 0.11845 -0.03270 0.04916 0.02792 158 2S 0.48824 -0.54315 0.27146 -0.09388 -0.35034 159 14 H 1S -0.00703 0.02127 -0.00262 -0.02412 -0.06277 160 2S -0.42407 0.33709 -0.30918 0.05903 0.40456 161 15 H 1S -0.22299 0.12451 0.02147 -0.02429 0.01690 162 2S 0.30015 -0.62227 0.38832 -0.00534 -0.50698 163 16 C 1S -0.00094 -0.00505 0.02056 0.00868 0.02188 164 2S -0.24266 -0.15301 0.16520 -0.15487 -0.23776 165 2PX -0.10580 -0.12426 0.06529 -0.00386 -0.00045 166 2PY 0.20256 -0.14603 -0.01587 0.01050 0.03488 167 2PZ 0.16479 -0.04434 -0.00401 -0.17522 0.04626 168 3S 0.23378 -0.55622 0.20316 -0.06525 1.21619 169 3PX -0.38954 -0.79239 0.17273 -0.35025 0.23309 170 3PY 1.14674 -0.03748 -0.09098 -0.26468 0.01636 171 3PZ 0.58606 -0.05627 -0.15074 -0.09250 -0.04413 172 4XX -0.04830 -0.02722 0.04743 -0.01111 0.01469 173 4YY -0.00529 -0.04258 0.03516 0.00269 0.01414 174 4ZZ -0.00190 0.01090 -0.01365 -0.01293 -0.01472 175 4XY -0.00629 -0.00048 0.00016 0.01311 0.02836 176 4XZ 0.00054 -0.00011 0.00068 -0.00553 0.01440 177 4YZ -0.02116 -0.03231 0.04081 -0.01368 0.03052 178 17 C 1S -0.04539 -0.00087 0.00699 -0.00313 -0.00742 179 2S -0.20953 -0.06291 0.19610 -0.08832 -0.14985 180 2PX -0.01980 0.00262 0.05656 0.11441 -0.08978 181 2PY -0.00122 -0.15469 0.20806 -0.17261 0.33761 182 2PZ 0.14585 -0.20056 0.01202 0.33484 0.11908 183 3S 1.37402 0.74038 -0.72768 0.22294 -0.62859 184 3PX 0.78421 0.73714 -0.21356 -0.04127 -0.31609 185 3PY 0.59572 -0.22944 -0.21285 -0.12061 -0.36667 186 3PZ 0.10632 0.00110 0.04234 -0.52018 -0.10536 187 4XX -0.03889 -0.00414 0.02348 -0.02013 -0.04024 188 4YY -0.03636 0.01596 0.00563 -0.00086 -0.02841 189 4ZZ 0.01635 0.00084 -0.00361 -0.00439 0.01354 190 4XY 0.00542 0.00012 0.01204 -0.02205 -0.00348 191 4XZ 0.01468 -0.00867 -0.00022 0.01968 -0.00529 192 4YZ -0.03348 0.01112 0.00548 -0.00720 -0.03660 193 18 C 1S 0.02982 0.01743 -0.01500 0.00199 -0.05028 194 2S -0.26027 -0.05983 0.18436 -0.03882 -0.06582 195 2PX 0.06507 -0.07719 0.13765 0.00854 0.37570 196 2PY -0.10463 0.01171 0.03039 -0.14458 0.09977 197 2PZ -0.14700 -0.04973 0.06819 0.28182 -0.00080 198 3S -0.70909 -0.60601 0.17844 -0.15218 0.58920 199 3PX -0.46653 0.73217 -0.24347 0.25099 -0.71296 200 3PY -0.56993 -0.56492 0.25927 -0.01391 0.36743 201 3PZ -0.18695 -0.29072 0.07338 -0.31112 0.25341 202 4XX -0.02387 -0.00279 0.00842 -0.00119 -0.04418 203 4YY -0.00765 0.00076 0.01406 -0.03208 -0.02913 204 4ZZ -0.00069 -0.00655 0.00076 0.02348 0.01608 205 4XY 0.01170 -0.00668 -0.00564 -0.00578 -0.01222 206 4XZ -0.00283 -0.00105 0.00335 -0.00820 -0.00301 207 4YZ -0.00151 -0.00478 0.00813 0.00760 -0.04693 208 19 C 1S -0.01908 -0.02665 0.02485 -0.00922 0.06622 209 2S -0.18933 -0.03365 0.14008 -0.00609 -0.18801 210 2PX -0.06646 0.04606 0.01280 0.02065 0.14089 211 2PY -0.06738 0.13444 -0.06509 -0.00282 -0.09007 212 2PZ -0.19041 0.05606 0.06606 0.17374 -0.05650 213 3S 0.83474 0.61721 -0.33628 0.24298 -0.13648 214 3PX -0.57124 -0.01271 0.13824 -0.02034 0.13919 215 3PY 0.09496 0.57902 -0.07557 0.26750 -0.43556 216 3PZ 0.19275 0.32869 -0.13004 -0.01400 -0.23721 217 4XX -0.01573 -0.01603 0.03426 -0.01011 0.03211 218 4YY -0.01461 -0.01283 0.02018 0.00206 0.02873 219 4ZZ -0.00291 0.00764 -0.00689 0.00359 -0.02132 220 4XY -0.01456 -0.00331 0.01305 0.02153 0.04276 221 4XZ -0.00057 0.00135 0.00061 -0.00624 0.02290 222 4YZ -0.02256 -0.01723 0.03216 -0.00446 0.04509 223 20 C 1S 0.00654 0.03373 -0.02073 0.01229 -0.04633 224 2S -0.17902 -0.14471 0.22214 -0.03990 -0.05876 225 2PX 0.03069 0.09054 -0.08253 0.01760 0.01717 226 2PY 0.15990 0.04633 -0.11623 0.02795 -0.39680 227 2PZ -0.07818 0.04046 0.02690 -0.11277 -0.18501 228 3S -0.64544 -0.61347 0.14878 -0.29434 0.66129 229 3PX 0.67745 0.34134 -0.29733 0.20094 -0.48494 230 3PY -0.42208 0.60052 0.09822 0.25722 0.15554 231 3PZ -0.12001 0.31438 -0.03078 0.19564 0.06519 232 4XX -0.01005 -0.00579 0.00959 -0.01080 -0.04488 233 4YY -0.03292 0.00468 0.01000 0.01679 -0.02320 234 4ZZ 0.00102 -0.00306 0.00149 -0.00939 0.01907 235 4XY -0.00111 0.00166 0.00321 -0.01823 -0.01434 236 4XZ 0.01173 -0.00456 -0.00023 0.02142 -0.00921 237 4YZ -0.02497 0.01104 -0.00024 -0.00321 -0.03566 238 21 C 1S -0.00959 -0.02928 0.01167 -0.01578 -0.01135 239 2S -0.18979 -0.14356 0.21936 -0.05323 -0.13421 240 2PX 0.08261 0.04947 -0.16806 -0.05103 -0.29738 241 2PY 0.14146 -0.08374 -0.00208 0.17399 -0.02153 242 2PZ -0.07538 0.04845 -0.00875 -0.47224 0.04658 243 3S 0.81254 0.93552 -0.68571 0.44688 -0.47513 244 3PX 0.39967 -0.66340 0.14676 -0.16532 0.65498 245 3PY -0.73279 -0.36780 0.20190 -0.41796 0.39509 246 3PZ -0.25541 -0.28458 0.15834 0.42411 0.15930 247 4XX -0.01800 -0.02754 0.02283 -0.00680 -0.03978 248 4YY -0.01279 -0.01564 0.01924 -0.04324 -0.02627 249 4ZZ 0.00604 0.00251 -0.00046 0.03068 0.01014 250 4XY -0.00978 0.00301 -0.00650 -0.00440 0.00026 251 4XZ -0.01155 0.00278 -0.00371 -0.00152 0.00239 252 4YZ -0.00616 -0.02619 0.01898 0.00122 -0.03889 253 22 H 1S -0.01866 -0.10931 0.06366 -0.10121 -0.19762 254 2S 0.27605 0.21970 -0.06662 0.12580 -0.18211 255 23 H 1S -0.01119 0.02783 -0.00119 -0.03651 -0.23504 256 2S -0.23608 -0.26037 0.16383 -0.10569 0.26582 257 24 H 1S -0.03760 -0.09091 0.11347 -0.07370 0.10234 258 2S 0.13466 0.17951 -0.05724 0.11971 -0.20253 259 25 H 1S 0.04022 0.00288 0.01178 -0.06963 -0.25292 260 2S -0.36004 -0.20009 0.10613 -0.01750 0.21740 261 26 H 1S -0.11336 0.00346 0.06900 -0.06575 -0.18956 262 2S 0.40186 0.28138 0.04910 -0.10082 -0.03708 263 27 H 1S -0.02392 -0.03568 -0.05325 -0.08895 0.03445 264 2S 0.24156 -0.23326 0.04785 -0.27349 0.05545 116 117 118 119 120 V V V V V Eigenvalues -- 0.55666 0.56351 0.56774 0.57529 0.57759 1 1 C 1S -0.00320 -0.00154 0.00596 -0.00339 -0.00716 2 2S -0.01833 -0.03629 0.02869 0.02979 0.13595 3 2PX -0.07710 -0.01378 0.13947 0.00175 -0.10910 4 2PY 0.01373 0.02078 0.01290 -0.04601 -0.04579 5 2PZ 0.15445 0.03794 -0.05617 0.04301 -0.00449 6 3S -0.03620 0.25866 -0.78050 0.35263 -0.44182 7 3PX 0.07354 0.39914 -0.10390 0.45456 0.27616 8 3PY 0.15455 -0.20922 0.45946 -0.37036 -0.05186 9 3PZ -0.27128 -0.07247 0.28054 -0.24422 0.00061 10 4XX -0.00389 0.01235 -0.05111 0.00762 -0.00416 11 4YY 0.01886 0.00489 0.01975 0.00939 -0.00243 12 4ZZ -0.01452 -0.01222 0.01390 -0.00605 0.01115 13 4XY 0.02989 0.00153 0.00552 0.00875 0.01353 14 4XZ -0.00890 -0.00023 -0.01105 0.01274 0.01489 15 4YZ 0.01010 -0.01277 0.02060 0.01607 0.01381 16 2 C 1S -0.00175 0.00461 -0.00736 0.00312 -0.00685 17 2S -0.08894 0.10337 -0.05778 0.01466 -0.01826 18 2PX -0.04529 0.05035 -0.23071 0.11615 -0.10193 19 2PY -0.00948 -0.00351 -0.05804 0.03264 -0.09993 20 2PZ 0.07640 -0.00859 -0.12128 0.06604 -0.02905 21 3S 0.23528 -0.76909 0.25638 -0.13530 0.49292 22 3PX -0.00512 0.36249 0.68606 0.18366 0.23365 23 3PY -0.15087 0.44039 -0.21235 0.53165 0.45109 24 3PZ 0.09876 -0.23989 0.16578 -0.09614 -0.09416 25 4XX -0.00067 0.01058 -0.02542 0.00526 0.01540 26 4YY -0.00247 0.01774 -0.00083 0.00702 -0.02807 27 4ZZ -0.01218 -0.02249 0.00430 -0.00349 0.01522 28 4XY -0.03150 0.00058 -0.01860 0.00587 -0.00522 29 4XZ 0.00565 -0.00347 0.01412 -0.00679 -0.01461 30 4YZ 0.00391 -0.01180 0.00145 0.01992 0.02316 31 3 H 1S -0.01385 -0.04026 -0.00411 0.07923 0.17080 32 2S -0.13189 0.34358 0.09415 -0.01537 -0.11296 33 4 Br 1S -0.00171 -0.00085 0.00171 -0.00152 -0.00105 34 2S 0.00994 0.00751 -0.01179 0.01006 0.00686 35 3S -0.00947 -0.01291 0.01509 -0.01205 -0.00772 36 4S -0.02595 -0.00999 0.02502 -0.02302 -0.01745 37 5S 0.13018 0.15924 -0.21203 0.20638 0.16475 38 6S -0.17093 -0.37464 0.44611 -0.46478 -0.41318 39 7PX 0.02729 -0.00834 0.00995 -0.00249 -0.00057 40 7PY -0.02874 -0.01328 0.01349 -0.01061 0.00172 41 7PZ -0.02840 -0.02783 -0.00121 -0.00429 0.02398 42 8PX -0.08808 0.02691 -0.03213 0.00804 0.00187 43 8PY 0.09276 0.04295 -0.04350 0.03421 -0.00568 44 8PZ 0.09165 0.08986 0.00388 0.01392 -0.07734 45 9PX 0.30195 -0.09172 0.11602 -0.02773 -0.00704 46 9PY -0.31967 -0.14907 0.15126 -0.11962 0.01923 47 9PZ -0.31160 -0.31036 -0.01396 -0.04775 0.26708 48 10PX -0.31896 0.07162 -0.18751 0.01337 -0.02227 49 10PY 0.33268 0.20600 -0.26148 0.24887 0.13013 50 10PZ 0.33230 0.28839 0.07577 -0.04948 -0.41398 51 11XX 0.02319 -0.02257 -0.00914 -0.02075 -0.02173 52 11YY 0.01962 0.00678 -0.00626 0.01069 0.01378 53 11ZZ -0.03221 0.03435 -0.00476 0.02596 0.01865 54 11XY -0.01214 -0.01363 -0.02138 -0.01347 -0.00696 55 11XZ -0.01747 0.00607 0.03352 -0.00270 0.00343 56 11YZ 0.01681 0.03436 0.02706 -0.01030 -0.04178 57 12XX -0.07228 0.20954 -0.06688 0.19719 0.17973 58 12YY -0.05607 0.06137 -0.04518 0.01524 -0.02889 59 12ZZ 0.20549 -0.07377 -0.07209 -0.05117 -0.04696 60 12XY 0.06147 0.07269 0.12302 0.06975 0.04297 61 12XZ 0.08148 -0.03386 -0.17998 0.01048 -0.02436 62 12YZ -0.08152 -0.16203 -0.14847 0.07544 0.23895 63 5 C 1S 0.01890 0.03632 -0.01823 0.00576 0.01817 64 2S -0.08214 -0.05416 0.06744 -0.02953 0.01396 65 2PX -0.02697 -0.01379 -0.19315 0.03804 -0.05778 66 2PY 0.03926 0.09280 -0.17144 0.20824 0.07038 67 2PZ -0.24564 0.24544 0.23614 0.06167 0.01091 68 3S -0.25475 -0.61969 1.21163 -0.75949 0.66702 69 3PX 0.15259 0.48894 -0.47991 0.56177 0.13911 70 3PY 0.37639 0.54531 -0.43174 0.64040 -0.06618 71 3PZ -0.80499 2.23098 -0.07918 0.36952 -0.56396 72 4XX 0.00377 -0.01154 0.01447 0.00592 -0.01696 73 4YY -0.01400 -0.02684 0.00022 -0.01205 0.00937 74 4ZZ 0.00225 0.04938 0.01264 -0.01548 0.05231 75 4XY 0.00539 0.00967 0.02893 -0.00572 0.02479 76 4XZ -0.01288 0.00815 0.01710 -0.00183 -0.01576 77 4YZ -0.03258 0.00750 0.01540 0.00637 -0.00864 78 6 C 1S 0.01713 -0.03051 0.00577 -0.03175 -0.02246 79 2S -0.03181 0.09799 -0.03243 0.04553 0.04075 80 2PX -0.15393 0.09950 0.00706 -0.07194 0.11474 81 2PY 0.06767 0.09957 0.01602 -0.09856 -0.05254 82 2PZ 0.01401 0.40200 0.05001 -0.03522 0.08697 83 3S 0.07437 0.93396 -1.10267 1.18176 -0.23522 84 3PX -0.18961 0.34137 0.53231 -0.31355 -0.40088 85 3PY -0.68245 0.40719 0.71021 -0.58306 -0.23248 86 3PZ -0.57215 1.81848 -0.39834 0.74878 -0.77187 87 4XX 0.00691 0.01242 -0.00779 0.00137 0.00290 88 4YY 0.00534 0.01813 -0.01566 -0.00071 -0.01446 89 4ZZ 0.00169 -0.02629 -0.01757 0.00244 -0.01916 90 4XY 0.02425 0.00487 -0.02126 -0.00381 -0.03639 91 4XZ 0.00393 -0.00578 -0.02233 -0.00675 0.00200 92 4YZ 0.02320 0.00428 -0.01363 -0.00832 0.00181 93 7 C 1S -0.02537 0.01863 -0.02069 0.04948 -0.01342 94 2S 0.08746 0.05185 0.01675 0.00264 -0.00391 95 2PX 0.05483 0.16225 0.05458 0.02055 -0.06068 96 2PY 0.02479 0.03359 -0.16194 -0.04764 -0.36128 97 2PZ 0.11115 -0.02672 0.02011 -0.11167 0.13878 98 3S -0.15562 -1.17279 1.08021 -1.13100 0.52047 99 3PX -0.54527 0.68742 0.33376 -0.28312 -0.23385 100 3PY -0.82840 1.48714 0.79739 -0.30028 -0.25457 101 3PZ 0.15120 -1.35633 0.69474 -0.72401 0.40812 102 4XX 0.00330 -0.00335 0.00103 -0.01366 0.01053 103 4YY 0.00255 -0.00516 0.01184 0.00568 0.00857 104 4ZZ -0.02586 0.00804 0.00036 0.04107 -0.02416 105 4XY -0.02357 -0.00728 0.00891 0.02179 0.00456 106 4XZ 0.00555 0.00547 0.00465 0.00885 0.00561 107 4YZ 0.01539 -0.00680 -0.01176 0.00391 -0.00757 108 8 C 1S 0.00603 -0.01379 0.03554 -0.03316 0.04056 109 2S 0.03415 0.03396 0.02875 0.02911 -0.07606 110 2PX 0.08085 0.14339 0.14668 -0.00303 0.02972 111 2PY -0.13242 -0.00877 -0.10131 0.06779 -0.08888 112 2PZ 0.31600 -0.20318 -0.17526 -0.12343 -0.13303 113 3S 0.18074 0.98152 -1.15291 0.92645 -0.33799 114 3PX -0.09747 0.44147 -0.52355 0.40747 -0.36373 115 3PY -0.00211 1.09797 -0.53983 0.59993 -0.52541 116 3PZ 0.63041 -1.65588 -0.49044 0.46136 0.92386 117 4XX 0.00086 0.00252 0.00316 0.00970 -0.01165 118 4YY -0.00563 -0.01135 -0.00567 0.00968 -0.00601 119 4ZZ 0.02476 0.02962 0.01600 -0.02216 0.04088 120 4XY 0.00841 0.00522 0.01788 0.00183 0.01695 121 4XZ -0.00055 0.00304 0.00445 0.00026 -0.00871 122 4YZ -0.01214 0.00246 0.00008 0.01281 -0.01312 123 9 C 1S 0.02112 0.01216 -0.04844 0.01954 -0.05367 124 2S 0.01194 0.04331 0.16456 -0.04468 0.03900 125 2PX 0.04357 -0.02294 0.11961 -0.04092 0.04258 126 2PY -0.17048 -0.13732 0.07081 0.09401 0.10953 127 2PZ -0.08804 -0.17909 -0.05893 0.13480 -0.09344 128 3S -0.24018 -1.05189 0.97745 -1.04514 0.44128 129 3PX 0.27352 -1.04124 -0.01160 -0.19006 0.50677 130 3PY 0.64609 -1.58708 0.29191 -0.54698 0.75412 131 3PZ 0.98071 -0.72883 -0.98004 0.44593 0.36572 132 4XX -0.00237 0.00377 -0.00189 -0.00259 0.01313 133 4YY 0.00023 0.00827 0.00786 -0.00348 -0.01833 134 4ZZ 0.02387 -0.02065 -0.00363 -0.00732 -0.04197 135 4XY 0.01346 -0.00252 -0.01754 -0.00387 -0.04199 136 4XZ 0.00333 -0.00382 -0.00899 -0.01068 -0.00786 137 4YZ 0.01704 0.00658 0.00224 -0.02350 -0.00364 138 10 C 1S -0.03707 -0.03321 0.05579 -0.01471 0.01811 139 2S 0.05639 0.05167 0.08496 -0.02880 0.01188 140 2PX 0.08920 -0.10686 -0.19365 0.00209 0.15587 141 2PY 0.07710 -0.03104 0.17417 0.01648 0.36247 142 2PZ -0.19284 -0.04385 0.12845 0.03173 -0.09946 143 3S 0.25553 0.98114 -1.12366 0.86773 -0.73719 144 3PX 0.36892 -1.03436 0.24143 -0.16975 0.25595 145 3PY 0.63783 -1.90347 -0.38286 -0.17082 0.38670 146 3PZ -0.38396 -0.29765 0.87973 -0.84184 0.26767 147 4XX 0.00547 0.00785 -0.00846 0.00071 0.00285 148 4YY -0.01147 0.01107 0.02034 0.00730 0.01301 149 4ZZ -0.02249 -0.02662 0.04648 -0.00365 -0.01224 150 4XY -0.03235 -0.00373 0.04199 0.00463 0.01046 151 4XZ -0.00080 0.00044 0.01507 0.01062 0.01378 152 4YZ -0.00070 -0.01033 -0.01768 0.00999 0.01203 153 11 H 1S -0.13547 -0.10964 0.16704 0.04498 0.00555 154 2S 0.13385 0.48067 -0.40127 0.39154 -0.07996 155 12 H 1S 0.02425 -0.02604 -0.07316 0.07957 -0.19552 156 2S -0.08305 -0.25261 0.43092 -0.34687 0.21596 157 13 H 1S -0.00290 -0.02079 0.08720 -0.00177 0.06552 158 2S 0.06355 0.29542 -0.32971 0.28198 -0.17980 159 14 H 1S -0.11273 0.01288 -0.01237 0.19790 -0.07741 160 2S 0.01014 -0.34806 0.36953 -0.40951 0.17515 161 15 H 1S -0.01180 -0.02740 -0.02993 0.03480 -0.15031 162 2S 0.18381 0.62336 -0.44025 0.46709 -0.09699 163 16 C 1S -0.00129 0.00474 0.00139 0.00777 0.00210 164 2S -0.14551 -0.04323 0.06108 -0.01878 0.10464 165 2PX 0.05464 -0.02683 0.01112 -0.10632 0.14563 166 2PY 0.03192 -0.00920 -0.00165 -0.14538 0.06551 167 2PZ 0.03628 -0.10646 0.13072 -0.13920 -0.02689 168 3S 0.06834 -0.34933 0.28651 -0.19297 -0.04024 169 3PX -0.26971 0.15132 -0.89016 0.75460 -0.02098 170 3PY -0.20329 -0.25009 -0.27591 -0.11722 0.17299 171 3PZ 0.14114 -0.04919 -0.19413 -0.05981 0.07517 172 4XX -0.02126 -0.01002 0.02323 0.01644 0.01715 173 4YY 0.00019 -0.01437 0.01560 -0.01281 0.00907 174 4ZZ -0.00198 0.01184 -0.01501 0.00161 0.00655 175 4XY 0.00141 0.00618 -0.02476 0.01053 0.00957 176 4XZ 0.01521 0.00499 0.00068 -0.00147 -0.00014 177 4YZ -0.01480 0.00254 0.00771 0.00312 0.02026 178 17 C 1S -0.02155 0.00777 -0.02386 0.00941 0.01662 179 2S -0.19984 -0.07729 0.08009 0.23098 -0.03580 180 2PX 0.15823 0.03011 0.23381 0.17737 -0.08961 181 2PY -0.06952 0.16257 -0.18704 -0.10923 0.22093 182 2PZ 0.06123 -0.22296 -0.00004 -0.15329 -0.05633 183 3S 0.54797 0.01910 0.28817 -0.38130 -0.16339 184 3PX -0.04073 -0.13014 0.27965 -0.60012 -0.04079 185 3PY -0.14015 -0.20851 -0.44373 0.12212 0.06081 186 3PZ -0.29946 0.19206 -0.39721 0.19078 0.23336 187 4XX -0.05329 -0.00747 -0.01065 0.01794 0.01436 188 4YY -0.02425 0.00320 -0.01971 0.03247 0.00732 189 4ZZ 0.01363 -0.00480 0.00701 -0.00650 -0.00649 190 4XY 0.00004 0.00209 0.02805 0.01734 -0.01624 191 4XZ 0.00772 -0.02706 0.01822 0.00338 -0.02276 192 4YZ -0.01959 0.00106 -0.00776 0.02481 0.00484 193 18 C 1S 0.01537 -0.00740 0.03666 0.03517 -0.01769 194 2S -0.22521 -0.01232 0.04816 0.17088 -0.20097 195 2PX 0.07096 -0.04228 0.16411 -0.02937 -0.30130 196 2PY -0.01250 0.15229 -0.07327 -0.01191 0.06537 197 2PZ -0.16629 -0.20034 -0.17230 -0.01440 -0.02900 198 3S 0.15231 -0.05872 -0.18226 0.43368 0.28955 199 3PX 0.25517 -0.00783 0.78458 0.10635 -0.07736 200 3PY -0.18874 -0.18592 -0.15477 0.19480 0.00397 201 3PZ 0.07700 0.18767 0.03540 0.11548 0.10139 202 4XX 0.00953 -0.01316 0.04706 0.08886 -0.02783 203 4YY -0.01976 0.00767 0.03138 0.02480 -0.03108 204 4ZZ -0.01125 -0.01000 -0.02286 -0.02417 0.00282 205 4XY -0.00543 -0.00709 -0.00540 -0.00258 0.00604 206 4XZ -0.01447 0.00427 -0.01604 0.00057 0.01550 207 4YZ -0.01711 -0.02222 0.03567 0.04306 -0.03805 208 19 C 1S -0.01480 -0.00546 -0.00667 0.00789 -0.02724 209 2S -0.17837 0.02684 0.08324 -0.06873 -0.27747 210 2PX -0.09182 0.06094 -0.12595 -0.31361 -0.00786 211 2PY 0.04020 0.09477 -0.03739 -0.39677 -0.07086 212 2PZ -0.22657 0.08477 -0.23584 -0.08748 0.16289 213 3S 0.28652 0.11245 -0.01221 -0.10787 0.09027 214 3PX 0.28318 -0.19342 0.64914 0.67850 -0.19775 215 3PY 0.22331 -0.08445 0.82543 0.47563 -0.34566 216 3PZ 0.35981 -0.07782 0.66625 0.10651 -0.41557 217 4XX -0.03748 0.00041 0.00624 -0.02818 -0.07064 218 4YY -0.01267 -0.00929 0.00918 0.01039 -0.04894 219 4ZZ 0.00354 0.01156 -0.00570 0.00960 0.02739 220 4XY 0.00979 0.00463 -0.01566 0.01287 0.00309 221 4XZ 0.02219 0.01138 0.00579 0.00275 -0.00197 222 4YZ -0.02926 0.00633 -0.00000 0.01239 -0.04490 223 20 C 1S -0.01461 0.02026 -0.02215 -0.05461 -0.00974 224 2S -0.17209 0.00562 0.08596 -0.30949 -0.15591 225 2PX -0.07595 0.05365 -0.13649 -0.00570 -0.06418 226 2PY 0.12738 -0.17891 0.19719 -0.15830 0.10065 227 2PZ 0.02828 0.22268 0.07757 -0.01497 0.22024 228 3S 0.06665 -0.07805 -0.39429 0.42550 0.30167 229 3PX 0.08330 0.11487 -0.11639 -0.26972 0.20307 230 3PY 0.10786 0.20785 0.54135 0.25516 -0.56453 231 3PZ 0.15081 -0.20787 0.33715 0.06461 -0.50425 232 4XX -0.04978 0.00974 -0.00772 -0.08561 -0.04538 233 4YY -0.02617 0.01715 -0.02854 -0.05627 0.00646 234 4ZZ 0.02175 -0.00472 0.01344 0.01997 0.00168 235 4XY -0.00162 0.00434 0.02318 -0.00656 0.00137 236 4XZ -0.00860 -0.02597 0.01163 -0.00252 -0.00477 237 4YZ -0.01853 0.01836 -0.01940 -0.07966 -0.01578 238 21 C 1S 0.00836 -0.01479 0.02282 -0.00769 0.01889 239 2S -0.17363 0.01579 0.06618 -0.33325 -0.00006 240 2PX -0.04879 0.06933 -0.21325 -0.28297 -0.02608 241 2PY -0.09008 -0.20217 0.03132 0.11136 0.07380 242 2PZ 0.25535 0.17520 0.19980 -0.00497 -0.06962 243 3S 0.24529 0.17219 -0.07252 -0.14815 0.16490 244 3PX -0.19353 -0.09931 -0.60079 0.43830 0.45682 245 3PY 0.17824 0.15258 -0.10277 0.22597 -0.11393 246 3PZ -0.34557 -0.21749 -0.26094 0.21801 0.10873 247 4XX 0.01078 -0.00777 0.02942 -0.04696 0.04058 248 4YY -0.00904 0.00541 0.03475 -0.04096 -0.00258 249 4ZZ -0.01815 -0.01009 -0.01646 0.00917 -0.01061 250 4XY -0.01445 -0.00174 -0.01388 -0.01689 -0.00878 251 4XZ -0.01061 0.01009 -0.01618 -0.00260 -0.00010 252 4YZ -0.02287 -0.02316 0.02871 -0.04062 0.00788 253 22 H 1S -0.08250 -0.06560 0.16475 -0.19912 0.01159 254 2S 0.05621 0.01116 0.15045 -0.19664 -0.00414 255 23 H 1S -0.17681 0.03930 -0.01704 -0.34964 -0.12331 256 2S -0.01542 -0.06883 -0.03782 0.09679 0.05634 257 24 H 1S -0.17037 -0.03757 0.04782 -0.04318 -0.24132 258 2S 0.05284 0.07154 0.07053 -0.05990 -0.07039 259 25 H 1S -0.08415 -0.07208 0.18566 0.16670 -0.15317 260 2S -0.04225 -0.01937 -0.04552 0.10661 0.01443 261 26 H 1S -0.15956 -0.01656 0.01445 0.07671 0.00934 262 2S -0.09780 -0.05462 -0.01041 -0.25766 0.10672 263 27 H 1S 0.06573 -0.05280 0.06475 0.04840 0.04335 264 2S -0.12070 -0.05345 -0.28154 0.04983 0.04656 121 122 123 124 125 V V V V V Eigenvalues -- 0.57994 0.58131 0.58885 0.59634 0.60064 1 1 C 1S -0.00872 -0.01116 0.01303 -0.00219 0.02543 2 2S -0.00813 0.11153 -0.04282 -0.00177 0.09149 3 2PX 0.01257 -0.00328 -0.14307 -0.14520 0.08792 4 2PY -0.04662 -0.05683 0.10701 -0.02464 -0.06204 5 2PZ 0.10303 0.00335 0.10165 0.07353 0.32136 6 3S 0.21897 -0.13190 -0.07628 0.14169 0.20666 7 3PX 0.60213 0.62237 0.15309 -0.10967 -0.44893 8 3PY -0.34098 -0.09719 -0.07282 -0.04666 0.22365 9 3PZ -0.34266 -0.10467 -0.04492 -0.13929 -0.32285 10 4XX -0.00844 -0.00858 0.01175 0.01364 0.04400 11 4YY 0.01012 0.00278 0.00596 -0.00680 0.04831 12 4ZZ -0.00144 0.00388 -0.00378 -0.00477 -0.03364 13 4XY 0.01648 0.01096 -0.00596 -0.01245 -0.00202 14 4XZ 0.00644 -0.00018 0.00005 -0.01014 0.00263 15 4YZ -0.00012 0.00967 0.03003 -0.00964 0.03827 16 2 C 1S 0.01153 0.01175 -0.00649 0.01379 -0.01211 17 2S -0.02404 -0.11163 -0.04049 -0.00170 0.05800 18 2PX -0.00185 -0.05054 0.01583 0.02654 0.19611 19 2PY -0.01117 0.03409 -0.07713 -0.03178 0.02058 20 2PZ 0.04517 0.06569 0.08808 -0.02251 -0.03725 21 3S -0.28417 0.23230 0.39285 -0.02142 -0.20338 22 3PX 0.59227 0.64587 -0.05842 -0.30271 -0.70320 23 3PY 0.53055 0.38897 0.37369 -0.01781 -0.19078 24 3PZ 0.12498 -0.00947 -0.33821 0.05948 -0.13403 25 4XX -0.00504 0.00180 0.00839 0.02027 -0.00673 26 4YY 0.01019 0.00656 -0.01328 0.00129 -0.00215 27 4ZZ -0.00505 -0.01198 0.00189 -0.00442 -0.00359 28 4XY -0.01450 -0.00069 -0.00275 0.01602 -0.01375 29 4XZ 0.00044 0.01024 -0.01060 0.00987 -0.01763 30 4YZ 0.00996 0.02620 0.02915 -0.00363 -0.00823 31 3 H 1S 0.04925 0.06152 0.11178 -0.00815 0.01074 32 2S 0.02312 0.02179 -0.04874 0.02000 0.00049 33 4 Br 1S -0.00188 -0.00176 -0.00207 -0.00096 0.00078 34 2S 0.01222 0.01106 0.01242 0.00669 -0.00402 35 3S -0.01438 -0.01192 -0.01224 -0.00895 0.00224 36 4S -0.02793 -0.02771 -0.03316 -0.01324 0.01424 37 5S 0.16764 0.16928 0.26075 0.10203 0.08159 38 6S -0.31076 -0.33492 -0.59086 -0.17809 -0.23607 39 7PX -0.00040 0.01122 0.00858 0.00283 -0.01323 40 7PY -0.01534 -0.01117 -0.00922 -0.00003 0.00098 41 7PZ -0.01521 -0.00505 0.00823 0.00847 -0.00440 42 8PX 0.00128 -0.03622 -0.02766 -0.00915 0.04264 43 8PY 0.04949 0.03594 0.02961 0.00011 -0.00291 44 8PZ 0.04918 0.01638 -0.02644 -0.02740 0.01414 45 9PX -0.00198 0.12641 0.09264 0.03122 -0.14152 46 9PY -0.16768 -0.12197 -0.10394 -0.00123 -0.00497 47 9PZ -0.17040 -0.05700 0.09098 0.09701 -0.04485 48 10PX -0.04146 -0.18061 -0.11017 -0.01485 0.14938 49 10PY 0.19975 0.20220 0.31863 0.00244 0.07804 50 10PZ 0.12878 -0.00979 -0.24211 -0.11390 0.03283 51 11XX 0.00809 -0.01129 -0.01708 0.02077 -0.00261 52 11YY -0.00277 0.00451 0.02369 -0.01178 0.01463 53 11ZZ 0.01315 0.02197 0.00841 0.00279 -0.01426 54 11XY -0.01110 -0.02182 -0.01455 0.01065 0.00261 55 11XZ 0.00260 0.01286 -0.01095 -0.00326 -0.01785 56 11YZ 0.01748 0.00777 -0.02713 -0.00566 -0.00789 57 12XX 0.03818 0.12523 0.18561 -0.04721 0.05257 58 12YY 0.08939 0.02955 -0.06710 0.11165 -0.03458 59 12ZZ -0.00035 -0.05179 0.03479 0.03677 0.12254 60 12XY 0.06685 0.12075 0.07611 -0.05769 -0.01798 61 12XZ -0.02284 -0.07471 0.04966 0.02129 0.09325 62 12YZ -0.07525 -0.01905 0.17527 0.02881 0.04399 63 5 C 1S 0.02388 -0.01591 0.00893 -0.00135 -0.00148 64 2S -0.21787 0.08339 -0.03752 -0.01744 -0.01851 65 2PX 0.12038 0.04433 -0.02280 0.06112 -0.17045 66 2PY 0.18442 0.14223 0.10249 0.06833 -0.06310 67 2PZ 0.07616 0.10576 -0.11443 0.06465 -0.15319 68 3S 0.27524 -0.72715 -0.08905 -0.09156 -0.29781 69 3PX 0.36142 0.30266 0.14292 -0.06731 0.12891 70 3PY 0.75203 0.68778 -0.01181 -0.19897 -0.31605 71 3PZ 0.35410 0.05503 -0.19195 -0.29279 0.59140 72 4XX -0.00111 0.02567 0.00441 -0.00458 0.00420 73 4YY -0.01955 -0.00115 -0.00058 -0.00108 -0.02332 74 4ZZ 0.02393 -0.04616 -0.00610 -0.00596 -0.00471 75 4XY 0.00758 0.00047 0.00763 -0.00620 -0.01153 76 4XZ -0.00905 0.00514 -0.00922 -0.01136 -0.01138 77 4YZ 0.00307 0.01919 -0.01026 0.01083 -0.00391 78 6 C 1S -0.02903 -0.02290 -0.01899 -0.01598 0.02312 79 2S -0.14297 0.05183 0.11688 -0.00642 0.13989 80 2PX 0.21889 -0.15505 -0.20085 0.14302 0.00753 81 2PY -0.00509 -0.17060 -0.09707 -0.08367 -0.01272 82 2PZ 0.16201 -0.19356 -0.08427 -0.02242 0.00981 83 3S 0.76329 1.02043 0.28118 -0.17057 -0.14595 84 3PX -0.40645 -0.15105 -0.09494 -0.15406 0.20843 85 3PY -0.38113 -0.53751 -0.33274 0.04503 0.37289 86 3PZ 0.21085 0.62646 -0.21213 -0.03830 0.34365 87 4XX 0.00706 -0.00718 0.00528 -0.01343 -0.01317 88 4YY -0.00649 -0.00119 -0.01775 0.00419 0.03097 89 4ZZ -0.04101 0.01899 0.01934 -0.02166 0.03956 90 4XY -0.03302 0.00280 -0.00992 -0.02899 0.02689 91 4XZ -0.00400 -0.01669 -0.00577 0.00316 0.01301 92 4YZ -0.00879 -0.02129 -0.00209 -0.01364 0.01661 93 7 C 1S 0.00068 0.06202 0.02532 -0.00746 0.00243 94 2S -0.26747 -0.01471 0.13424 0.22489 0.10118 95 2PX 0.05628 0.10224 -0.13482 0.16595 0.31942 96 2PY -0.17998 -0.01073 -0.19667 -0.41950 0.09167 97 2PZ -0.03614 -0.22599 0.04740 0.13070 -0.02190 98 3S -0.28204 -0.94070 -0.09350 -0.30601 0.05123 99 3PX -0.18249 -0.47266 -0.27066 -0.14165 -0.09606 100 3PY 0.06992 -0.49627 -0.49228 0.48062 0.28383 101 3PZ -0.38238 -0.39522 0.09476 -0.06635 -0.07586 102 4XX 0.01132 -0.02496 -0.01161 0.00902 0.00125 103 4YY -0.03615 0.01146 0.03519 0.00017 0.01565 104 4ZZ -0.03301 0.06639 0.03274 0.01753 0.00603 105 4XY -0.02398 0.03706 0.03555 0.00831 0.01154 106 4XZ 0.00819 0.01667 0.00542 0.03451 0.00509 107 4YZ 0.00614 0.00464 0.00495 0.00877 -0.02749 108 8 C 1S 0.00123 -0.04908 0.01382 0.04057 -0.01553 109 2S -0.35724 0.07726 0.10253 0.37993 -0.00530 110 2PX -0.18814 0.09826 0.04712 0.07153 0.19760 111 2PY -0.01530 0.03489 -0.00861 -0.11051 -0.00517 112 2PZ -0.11012 -0.11840 -0.14740 0.16763 -0.08723 113 3S 0.81917 0.61905 -0.00434 -0.30808 0.00406 114 3PX 0.31842 0.27498 -0.10803 -0.05236 -0.19962 115 3PY 0.22560 0.55181 -0.15816 0.16987 0.08164 116 3PZ 0.16007 0.63838 1.07944 -0.16460 -0.30977 117 4XX -0.01133 0.02573 -0.00241 -0.00625 0.01463 118 4YY -0.01805 0.01149 0.01349 0.04584 -0.03073 119 4ZZ -0.01451 -0.05852 0.02914 0.08475 -0.00884 120 4XY -0.01946 0.00140 0.02585 0.07963 -0.01950 121 4XZ -0.01484 0.00645 0.00419 -0.01319 -0.00663 122 4YZ 0.00902 0.02580 -0.00250 -0.00101 0.00513 123 9 C 1S -0.01793 0.02713 -0.02064 0.02741 -0.00559 124 2S -0.30459 -0.00989 0.03660 0.37106 -0.08803 125 2PX -0.30274 0.01611 0.08454 -0.33234 -0.06728 126 2PY 0.10698 0.16444 0.00642 -0.01607 0.06663 127 2PZ -0.02506 0.29153 -0.01958 -0.20640 0.00093 128 3S -0.31390 -1.00841 -0.16419 -0.36720 0.16083 129 3PX 0.10333 -0.19756 0.29348 0.42786 -0.03669 130 3PY -0.41773 -0.45824 0.56714 0.06627 -0.35397 131 3PZ 0.25827 0.29811 0.61605 0.25881 -0.26492 132 4XX -0.00211 -0.01847 0.01290 -0.02098 0.00041 133 4YY -0.02453 0.00597 -0.01333 0.06467 -0.00636 134 4ZZ -0.06647 0.01866 -0.02084 0.05673 -0.01756 135 4XY -0.05808 0.00171 -0.01350 0.05140 -0.01585 136 4XZ 0.00360 -0.01927 -0.01652 0.00190 0.00806 137 4YZ -0.01841 -0.03450 -0.01478 -0.01354 0.02392 138 10 C 1S -0.02253 0.00699 -0.00102 -0.01412 -0.00381 139 2S -0.24344 0.02776 -0.03355 0.19408 -0.12781 140 2PX -0.02573 -0.18483 0.17341 -0.27599 -0.08670 141 2PY 0.32382 0.04508 0.14663 -0.04683 -0.01904 142 2PZ -0.02386 0.15642 -0.05153 -0.02127 -0.02443 143 3S 0.78386 0.71893 -0.30395 -0.19734 0.09630 144 3PX -0.15081 0.19785 0.15343 0.29661 -0.15690 145 3PY -0.60812 -0.09883 0.45552 0.15667 -0.26107 146 3PZ -0.43120 -0.91040 -0.15263 -0.07107 0.18714 147 4XX 0.02028 -0.00605 -0.00724 0.00795 0.00182 148 4YY -0.02464 0.01104 0.00090 -0.01875 0.00122 149 4ZZ -0.04721 0.04045 -0.00986 0.02418 -0.04043 150 4XY -0.01947 0.02967 -0.00994 -0.00411 -0.00812 151 4XZ 0.01959 0.02099 0.00785 0.01151 -0.00035 152 4YZ 0.00349 0.00339 0.02085 -0.00702 -0.01000 153 11 H 1S -0.12020 0.21144 0.02231 0.04924 -0.12879 154 2S 0.26534 0.29861 0.04642 -0.00964 0.00546 155 12 H 1S -0.16027 0.19435 -0.03860 0.25190 -0.12642 156 2S -0.18518 -0.33221 -0.01095 -0.00092 0.02948 157 13 H 1S -0.05658 0.00979 0.10709 0.31008 -0.13713 158 2S 0.06032 0.24909 0.01981 0.02665 0.01221 159 14 H 1S -0.07730 0.31962 0.14360 0.07201 -0.02051 160 2S -0.20797 -0.37790 -0.03222 0.02335 0.03978 161 15 H 1S -0.11593 0.11719 -0.03105 -0.03147 0.07640 162 2S 0.29533 0.30818 0.05006 -0.02370 0.04682 163 16 C 1S -0.00949 0.01114 -0.01605 -0.00114 0.00335 164 2S -0.06762 0.02169 -0.21860 -0.05702 0.16416 165 2PX 0.14575 0.16144 -0.07589 -0.12875 -0.12612 166 2PY -0.10109 0.00620 0.23968 -0.03692 0.15644 167 2PZ 0.05513 0.06366 0.03953 0.07135 0.04362 168 3S -0.25788 -0.05900 -0.21844 -0.12875 -0.07712 169 3PX 0.31000 -0.08577 -0.23583 0.32515 -0.29870 170 3PY -0.46825 -0.69874 -0.20746 0.40912 -0.39071 171 3PZ -0.32374 -0.41010 -0.02592 0.13243 -0.16945 172 4XX -0.00589 0.01240 -0.05472 -0.02489 0.01973 173 4YY -0.02189 0.01746 -0.03536 -0.00039 0.00017 174 4ZZ 0.00072 -0.00492 0.01562 0.00608 0.00979 175 4XY -0.00256 -0.00375 0.00085 0.00497 0.01397 176 4XZ -0.00095 0.00373 0.00207 0.00298 -0.01357 177 4YZ -0.02742 0.01535 -0.03350 -0.00575 0.02394 178 17 C 1S -0.00699 -0.00270 -0.04373 0.00521 -0.01717 179 2S -0.03899 -0.23153 -0.21077 -0.00740 -0.10164 180 2PX -0.20513 -0.01761 0.17809 0.09877 0.20726 181 2PY -0.26099 0.10998 -0.09441 0.09115 0.11966 182 2PZ 0.05038 0.13562 -0.14934 0.02871 -0.25838 183 3S -0.42333 -0.25137 0.64833 0.17131 0.37705 184 3PX -0.15331 -0.40203 0.14469 -0.07999 0.12275 185 3PY 0.12610 -0.51627 0.03335 0.21753 -0.64926 186 3PZ -0.08447 -0.34507 0.05877 0.23193 0.13429 187 4XX -0.02581 -0.04609 -0.06015 0.01017 -0.02932 188 4YY -0.00043 -0.02342 -0.04343 0.00214 -0.01081 189 4ZZ 0.01458 0.00691 0.01090 -0.00756 -0.00877 190 4XY -0.00438 -0.00905 0.02088 0.00022 0.01009 191 4XZ 0.01600 0.00333 0.00473 0.00700 0.00773 192 4YZ -0.00972 -0.02213 -0.05227 0.00519 -0.02695 193 18 C 1S -0.01608 -0.03561 0.02859 0.00740 0.01488 194 2S 0.04168 -0.30276 0.04966 0.03657 -0.13626 195 2PX 0.20422 0.04899 0.38456 -0.03194 0.14593 196 2PY -0.05006 0.00158 -0.02427 -0.08515 -0.21704 197 2PZ 0.16098 -0.00957 -0.20576 0.18825 0.19764 198 3S 0.53613 0.63259 -0.60426 -0.28790 -0.05942 199 3PX -0.07423 0.07656 -0.33917 -0.39734 0.43915 200 3PY 0.40782 0.25164 -0.34312 -0.00763 -0.01728 201 3PZ -0.02485 0.13431 0.07682 -0.32003 -0.42560 202 4XX 0.00823 -0.05235 0.01046 -0.00415 -0.00456 203 4YY -0.01510 -0.05064 0.03240 0.00592 -0.01338 204 4ZZ 0.00973 0.01347 -0.01030 0.00595 0.00598 205 4XY 0.00003 -0.00865 -0.02246 0.00052 -0.02425 206 4XZ -0.00919 -0.00790 -0.00777 0.00136 0.00794 207 4YZ -0.00327 -0.05598 0.02691 0.01466 0.01328 208 19 C 1S 0.03560 -0.00673 0.02161 -0.00468 -0.01251 209 2S 0.06471 -0.15910 0.31663 0.05977 -0.03964 210 2PX 0.05515 0.16827 0.03894 -0.01539 0.02995 211 2PY 0.07454 0.24022 -0.02021 0.02732 -0.13205 212 2PZ -0.12450 0.02419 0.12895 -0.01842 0.29585 213 3S -0.48209 -0.04827 0.20326 0.22954 0.26281 214 3PX 0.44001 0.06967 -0.31503 -0.43959 0.19998 215 3PY -0.18694 -0.33287 0.35419 -0.18930 0.73411 216 3PZ 0.07820 -0.06124 0.02683 -0.04905 -0.10536 217 4XX 0.03947 -0.02531 0.07789 0.00561 -0.00709 218 4YY 0.02703 -0.02220 0.03505 0.01742 -0.00959 219 4ZZ -0.02590 0.00198 -0.00778 -0.00722 0.00298 220 4XY 0.00021 0.01748 0.00074 0.00644 0.01499 221 4XZ -0.00085 0.01602 -0.00320 -0.00289 -0.02052 222 4YZ 0.01739 -0.03087 0.06407 0.00160 -0.01120 223 20 C 1S -0.01307 0.00892 0.03177 0.01728 0.00173 224 2S 0.09725 0.03013 0.24408 -0.03072 0.02825 225 2PX -0.00907 -0.05759 0.06779 0.07104 -0.07621 226 2PY 0.02509 0.13149 -0.27493 0.00519 0.29198 227 2PZ -0.26827 0.03418 0.08685 -0.25288 -0.18985 228 3S 0.46159 0.39846 -0.77415 -0.20920 -0.20834 229 3PX -0.53892 -0.15596 0.26140 0.30680 0.01433 230 3PY 0.04800 -0.02123 0.53561 -0.27349 0.18912 231 3PZ 0.36431 0.03398 -0.00281 0.17452 0.63275 232 4XX 0.01491 -0.00393 0.06687 0.00793 0.00549 233 4YY -0.00152 0.02473 0.02369 0.00005 0.00085 234 4ZZ 0.00753 0.00344 -0.02285 -0.00020 -0.00811 235 4XY -0.00508 -0.00314 0.00548 -0.01733 0.00809 236 4XZ 0.01211 -0.00055 -0.01107 0.00147 0.01445 237 4YZ 0.01116 0.02835 0.02340 0.01202 -0.00720 238 21 C 1S 0.01907 0.01626 -0.01732 -0.02527 0.00621 239 2S -0.04744 0.12866 0.00139 -0.06253 0.15563 240 2PX 0.04284 0.00972 0.21013 0.12847 -0.15730 241 2PY 0.01367 -0.07462 0.00262 -0.07059 0.06991 242 2PZ 0.03841 0.02961 -0.08712 0.00643 -0.09136 243 3S -0.49153 -0.21011 0.40953 0.28203 -0.16659 244 3PX -0.19469 -0.31307 -0.38951 0.20924 -0.45553 245 3PY 0.47714 0.33813 -0.34981 -0.11527 -0.06053 246 3PZ 0.17408 0.10053 -0.03915 -0.17638 0.03503 247 4XX -0.00529 0.03970 -0.01408 -0.02537 0.02278 248 4YY 0.00364 0.01271 0.00037 -0.02768 0.01346 249 4ZZ 0.00090 -0.01045 0.00119 0.01326 0.00514 250 4XY 0.02109 0.00370 0.00537 -0.00176 -0.00844 251 4XZ 0.00230 -0.00329 0.01110 -0.00691 -0.00433 252 4YZ 0.01350 0.01556 -0.00905 -0.02843 0.03087 253 22 H 1S 0.05195 0.04550 -0.00267 -0.14091 0.11941 254 2S -0.30551 -0.11772 0.15915 0.11334 0.09954 255 23 H 1S 0.01126 0.00056 0.20938 0.02737 0.03030 256 2S 0.20156 0.08364 -0.19021 -0.10402 -0.10564 257 24 H 1S 0.14069 -0.14864 0.24430 0.00245 -0.04423 258 2S -0.21407 -0.05167 0.18942 0.11667 0.11277 259 25 H 1S -0.02440 -0.28582 0.12842 0.02575 0.00165 260 2S 0.19880 0.15049 -0.17001 -0.12374 -0.12107 261 26 H 1S -0.16021 -0.14540 -0.13845 0.08182 -0.03938 262 2S -0.07037 -0.33453 -0.03595 0.05444 -0.00576 263 27 H 1S 0.03682 0.02118 0.07509 -0.06173 0.18773 264 2S 0.02808 -0.04434 -0.04454 0.13422 -0.06469 126 127 128 129 130 V V V V V Eigenvalues -- 0.60388 0.61085 0.62204 0.64152 0.64705 1 1 C 1S -0.00292 -0.00744 0.00159 0.01418 -0.00524 2 2S -0.03793 -0.01803 -0.04056 0.01771 -0.13565 3 2PX 0.20101 -0.23816 0.12939 0.02094 0.01887 4 2PY -0.01571 0.03092 0.06070 0.11247 0.05484 5 2PZ -0.06017 -0.12221 -0.10594 -0.10087 -0.06961 6 3S 0.29358 -0.11482 0.29521 0.17703 -0.17396 7 3PX -0.23256 -0.14356 -0.51742 0.07741 -0.18455 8 3PY -0.04380 0.10298 0.05923 -0.14718 0.20348 9 3PZ 0.03645 0.20662 0.28696 0.11817 0.23810 10 4XX -0.00756 0.00077 0.00638 0.02063 -0.03440 11 4YY 0.00182 -0.02326 -0.01628 0.00725 -0.00329 12 4ZZ -0.00510 0.00548 0.00618 -0.00767 0.00634 13 4XY 0.00059 -0.01000 -0.02389 -0.00543 0.01321 14 4XZ -0.00665 -0.02155 0.00280 0.01747 -0.01646 15 4YZ -0.00974 -0.02477 -0.00735 0.03271 -0.01780 16 2 C 1S 0.00552 0.00445 -0.00938 -0.01970 -0.00102 17 2S 0.00449 0.00762 0.02530 0.05582 0.00812 18 2PX 0.05779 -0.11230 0.05694 0.11302 -0.17637 19 2PY 0.07727 -0.08766 0.02218 0.10057 -0.14075 20 2PZ -0.00403 -0.05710 0.08800 -0.07112 0.03718 21 3S -0.42251 0.09165 -0.04960 0.33469 -0.34327 22 3PX -0.01478 -0.17735 -0.48310 -0.30398 0.25878 23 3PY -0.10381 -0.14140 -0.51123 0.20062 0.16489 24 3PZ 0.16599 -0.02643 -0.23034 -0.38072 0.18363 25 4XX -0.02467 0.02832 -0.01450 0.00401 -0.01259 26 4YY 0.01426 -0.02359 0.00489 -0.00394 -0.00807 27 4ZZ 0.00916 0.00394 0.00385 0.00416 0.00937 28 4XY 0.00097 0.00647 0.01007 0.01455 -0.01746 29 4XZ 0.01412 0.01914 -0.00014 -0.03804 0.02065 30 4YZ -0.00393 -0.00965 -0.01615 0.01040 0.00182 31 3 H 1S -0.06369 -0.03053 -0.12704 0.11800 -0.05569 32 2S -0.02810 0.05943 0.06537 -0.04892 -0.06296 33 4 Br 1S 0.00139 -0.00089 0.00175 0.00022 -0.00055 34 2S -0.00869 0.00557 -0.01169 -0.00110 0.00313 35 3S 0.00927 -0.00594 0.01415 0.00087 -0.00278 36 4S 0.02209 -0.01428 0.02653 0.00266 -0.00861 37 5S -0.15366 0.00829 -0.19050 0.11056 -0.00929 38 6S 0.32254 0.04225 0.37112 -0.35712 0.06673 39 7PX -0.00830 0.01809 -0.00833 -0.01645 0.00349 40 7PY 0.00659 -0.00011 0.00507 -0.00095 -0.00580 41 7PZ -0.00430 0.00967 -0.00500 0.01455 -0.01453 42 8PX 0.02675 -0.05838 0.02696 0.05324 -0.01129 43 8PY -0.02123 0.00023 -0.01640 0.00316 0.01868 44 8PZ 0.01384 -0.03125 0.01617 -0.04712 0.04706 45 9PX -0.08978 0.19687 -0.09761 -0.18875 0.04102 46 9PY 0.07507 0.00630 0.05821 -0.02187 -0.05772 47 9PZ -0.04876 0.10818 -0.05975 0.17227 -0.16833 48 10PX 0.09380 -0.17616 0.15174 0.21964 -0.07018 49 10PY -0.18276 -0.04473 -0.10550 0.20969 0.00214 50 10PZ 0.12140 -0.10036 0.14400 -0.31055 0.19771 51 11XX 0.00578 0.01027 0.00232 -0.04861 0.00760 52 11YY -0.01721 -0.00708 0.00420 0.02941 -0.00516 53 11ZZ -0.00041 0.00450 -0.02519 0.01879 0.00054 54 11XY 0.00641 0.00611 0.01398 -0.00175 0.00221 55 11XZ 0.00764 -0.00089 -0.01339 -0.00158 0.01472 56 11YZ 0.01672 -0.00341 0.01104 -0.05823 0.03473 57 12XX -0.09381 -0.04554 -0.09909 0.29384 -0.04933 58 12YY 0.04860 0.04248 -0.10713 -0.13684 0.03359 59 12ZZ -0.04946 -0.01869 0.05531 -0.05931 -0.01426 60 12XY -0.03215 -0.03673 -0.08058 0.00554 -0.00422 61 12XZ -0.03698 0.00885 0.07602 0.01399 -0.08125 62 12YZ -0.10260 0.01203 -0.06923 0.31889 -0.17690 63 5 C 1S -0.00422 0.00470 -0.00722 -0.00140 0.00735 64 2S -0.21591 0.14928 -0.06375 0.01546 0.02285 65 2PX 0.12527 -0.05502 0.11961 -0.09237 -0.20216 66 2PY 0.10420 -0.04687 -0.13427 0.07927 -0.04908 67 2PZ -0.08558 -0.16894 -0.20626 -0.02175 0.01061 68 3S 0.18018 0.05027 -0.11761 -0.18774 0.26543 69 3PX -0.06845 -0.18996 -0.57448 0.15617 0.52258 70 3PY 0.00173 -0.32830 -0.42951 -0.41769 0.20079 71 3PZ 0.41435 0.01848 0.02098 0.57289 -0.28657 72 4XX -0.00037 -0.01103 0.00751 -0.00095 -0.01555 73 4YY -0.01084 0.02818 -0.00229 -0.00551 0.01964 74 4ZZ -0.03011 0.01746 -0.02770 -0.00051 0.00731 75 4XY -0.01597 0.01919 -0.01401 -0.00960 0.02068 76 4XZ 0.00519 -0.00963 -0.00168 -0.00712 0.00302 77 4YZ -0.01019 -0.01528 -0.00869 0.00095 -0.00786 78 6 C 1S -0.01094 0.02754 0.01987 -0.00287 0.00753 79 2S 0.15455 0.21240 -0.01504 0.01814 0.03662 80 2PX -0.10705 -0.15550 -0.18549 0.09948 0.17160 81 2PY -0.15466 -0.02519 -0.01873 0.05089 -0.20789 82 2PZ -0.08834 -0.04856 -0.12359 0.01621 0.00346 83 3S -0.09962 -0.47542 -0.25164 0.24581 -0.13549 84 3PX 0.15213 0.27930 0.56540 -0.03438 -0.25986 85 3PY 0.24516 0.21347 0.21357 0.15563 0.05976 86 3PZ 0.41449 -0.14544 -0.14841 0.27031 -0.09900 87 4XX 0.00707 -0.01427 -0.02053 -0.00275 -0.02104 88 4YY -0.01098 0.02742 0.00742 0.00833 0.01842 89 4ZZ 0.02027 0.04631 0.02537 0.00761 -0.00026 90 4XY 0.00220 0.03723 0.00768 -0.00072 0.00318 91 4XZ -0.01418 0.01099 0.00915 0.00622 0.00522 92 4YZ -0.01976 0.00734 0.00667 0.00586 0.00094 93 7 C 1S 0.03734 0.01533 0.00526 -0.00523 0.00367 94 2S 0.31572 0.13828 0.10883 -0.01917 0.09294 95 2PX -0.35283 0.15883 0.38408 0.12742 0.37604 96 2PY -0.02692 0.17905 -0.16262 -0.06086 -0.11895 97 2PZ 0.06336 -0.05957 -0.01100 0.01617 -0.04167 98 3S -0.45347 0.30226 0.35797 0.02326 0.00806 99 3PX 0.52729 -0.13449 -0.50413 -0.06342 -0.68460 100 3PY 0.26776 -0.21970 0.29409 0.25943 0.09186 101 3PZ -0.23725 0.30839 0.28394 -0.12543 0.21084 102 4XX -0.01397 -0.01103 -0.00026 0.00459 0.01606 103 4YY 0.04081 0.03690 0.02150 -0.01225 -0.00127 104 4ZZ 0.07777 0.03019 0.01752 -0.00631 0.01008 105 4XY 0.06007 0.03058 0.02304 -0.00941 0.02759 106 4XZ -0.00335 -0.00106 0.01034 0.00119 -0.00704 107 4YZ 0.01922 -0.02857 -0.01798 -0.00535 -0.00767 108 8 C 1S 0.03841 -0.01220 0.00771 -0.00020 -0.00746 109 2S 0.20785 -0.09474 0.01154 0.00415 0.04757 110 2PX -0.11366 0.27117 0.03595 -0.09608 -0.49282 111 2PY 0.09537 -0.04015 0.03310 0.06227 0.36319 112 2PZ -0.34537 -0.29731 -0.11645 0.04304 -0.03157 113 3S -0.00753 -0.21486 -0.25953 -0.00479 -0.16834 114 3PX 0.21139 -0.45748 -0.18746 0.14963 0.74292 115 3PY 0.04881 -0.17406 -0.26873 -0.06358 -0.65056 116 3PZ 0.14470 0.39067 0.17290 -0.25905 0.20821 117 4XX -0.02718 0.01717 -0.00035 -0.00042 -0.01481 118 4YY 0.04202 -0.04037 -0.00960 0.00412 0.00979 119 4ZZ 0.08226 -0.02185 0.01350 -0.00391 -0.00352 120 4XY 0.04866 -0.02596 0.00035 0.00016 -0.02093 121 4XZ 0.02492 0.00907 -0.01870 -0.00776 -0.00909 122 4YZ 0.00716 0.01040 0.01613 -0.00145 0.01279 123 9 C 1S -0.02057 -0.04047 -0.01354 0.00604 -0.01423 124 2S -0.05906 -0.21068 -0.15124 0.02406 0.07099 125 2PX -0.00405 0.08447 -0.46942 -0.02415 0.10953 126 2PY -0.35601 0.03987 0.15913 0.02289 0.07294 127 2PZ -0.33414 0.02407 -0.06545 0.01758 0.04513 128 3S -0.23372 0.49380 0.56057 0.09468 -0.06330 129 3PX -0.17812 0.04484 0.75177 0.00344 -0.08861 130 3PY 0.16873 0.16592 0.02128 -0.11495 0.13269 131 3PZ 0.23351 -0.14205 0.01553 -0.18844 0.01928 132 4XX 0.02286 0.00606 -0.00593 0.00299 0.01213 133 4YY -0.01244 -0.03337 0.00447 0.00664 -0.02007 134 4ZZ -0.05647 -0.05691 -0.03177 0.00802 0.00195 135 4XY -0.01284 -0.05717 -0.02189 0.01497 -0.01046 136 4XZ -0.01450 -0.01279 0.01846 0.00698 0.02113 137 4YZ -0.01553 0.01304 0.00005 0.00108 -0.01284 138 10 C 1S -0.03552 0.00655 -0.00880 0.00164 0.01141 139 2S -0.30000 -0.09315 -0.18950 -0.00161 0.12891 140 2PX 0.15060 -0.03608 0.02008 0.07874 0.45453 141 2PY -0.03263 0.32128 -0.03505 -0.16331 -0.07379 142 2PZ 0.02444 -0.03564 -0.00478 -0.00503 -0.05155 143 3S 0.43614 -0.24943 -0.24696 -0.29928 -0.04667 144 3PX -0.33228 0.13492 0.04190 -0.27966 -0.50934 145 3PY -0.34414 -0.24592 0.28551 0.07113 0.29538 146 3PZ -0.04693 0.38354 0.39024 0.18346 -0.05586 147 4XX 0.00276 0.00504 0.01913 -0.00497 -0.00860 148 4YY -0.04182 0.00061 -0.04155 0.00144 0.02093 149 4ZZ -0.05914 -0.02301 -0.03297 -0.00806 0.02590 150 4XY -0.06046 -0.00080 -0.02435 -0.00552 0.02200 151 4XZ -0.01025 0.00306 0.00009 -0.00419 -0.00990 152 4YZ 0.01048 0.00263 -0.00418 0.00424 0.00544 153 11 H 1S -0.19439 -0.05983 -0.13212 -0.01613 0.08147 154 2S 0.01935 -0.16982 -0.23516 -0.00010 0.02943 155 12 H 1S -0.07739 -0.25115 -0.11444 0.02913 -0.05200 156 2S -0.05282 0.10794 0.09253 0.01912 0.05861 157 13 H 1S 0.26030 -0.13338 -0.00844 -0.00590 -0.04631 158 2S 0.04362 -0.08398 -0.08278 -0.01951 -0.01563 159 14 H 1S 0.27739 0.07645 0.03867 -0.02948 0.02816 160 2S -0.04046 0.12489 0.12599 -0.03245 0.07162 161 15 H 1S 0.07033 0.12310 0.03015 -0.00799 0.03501 162 2S 0.03216 -0.12269 -0.23068 0.01934 0.07071 163 16 C 1S 0.01239 -0.00746 0.00735 0.00068 0.00206 164 2S 0.09150 -0.07952 0.08000 0.08204 -0.15486 165 2PX 0.01224 -0.13884 -0.11415 -0.04838 0.00975 166 2PY -0.10160 -0.03228 -0.07286 0.28691 -0.03599 167 2PZ -0.00229 0.03418 -0.00341 -0.31085 0.05525 168 3S 0.13978 0.14997 0.29484 -0.13846 0.30326 169 3PX 0.05390 0.25046 0.09157 -0.02885 -0.41268 170 3PY -0.22610 0.68841 0.12509 -0.58151 0.22702 171 3PZ -0.19820 0.36332 -0.05296 0.32017 0.01868 172 4XX 0.03062 -0.03582 0.01601 0.01411 -0.02060 173 4YY 0.01566 0.01070 0.02041 -0.00390 0.00861 174 4ZZ -0.00992 0.00298 -0.00967 0.00204 -0.00401 175 4XY -0.00672 -0.00186 -0.00379 0.00795 -0.00834 176 4XZ -0.00330 0.01246 -0.00292 0.00216 0.00198 177 4YZ 0.01966 -0.00904 0.01419 0.00825 0.00225 178 17 C 1S 0.00469 0.01825 0.00749 -0.00745 0.00742 179 2S 0.03631 0.05946 0.02841 -0.04582 -0.09553 180 2PX -0.00822 0.04582 0.08273 0.08310 0.24516 181 2PY 0.02095 0.14072 -0.08511 -0.04653 0.14201 182 2PZ -0.00868 0.11183 0.28381 0.02985 -0.02817 183 3S -0.18270 0.12755 0.03328 0.02419 0.20310 184 3PX -0.16761 0.00443 -0.17107 -0.01190 0.06605 185 3PY -0.39280 0.34598 -0.00977 -0.13729 -0.20476 186 3PZ -0.10486 0.23258 -0.51083 -0.09144 0.04030 187 4XX -0.00356 0.04495 0.00538 -0.01273 0.01391 188 4YY 0.00998 0.00578 0.00125 -0.00446 -0.01700 189 4ZZ -0.00030 -0.01443 0.00008 -0.00522 -0.01222 190 4XY 0.00108 -0.00507 0.00605 -0.00486 0.01310 191 4XZ 0.00426 0.00441 0.00650 0.01011 0.00024 192 4YZ 0.00793 0.02054 0.01725 -0.01770 -0.00408 193 18 C 1S -0.01114 0.00574 -0.00339 0.00619 0.00942 194 2S -0.06847 0.12764 -0.02153 -0.06159 -0.00097 195 2PX 0.00768 -0.17047 -0.02352 0.07132 0.01772 196 2PY -0.07325 -0.05782 0.15267 -0.23639 -0.02593 197 2PZ 0.12300 0.22983 -0.29610 0.36391 0.01615 198 3S 0.41312 -0.54624 0.13532 0.01098 -0.40922 199 3PX 0.38214 -0.50040 0.24683 0.08258 -0.10316 200 3PY 0.27548 0.01027 -0.17569 0.30772 -0.21096 201 3PZ -0.11743 -0.40477 0.45892 -0.73865 -0.14706 202 4XX -0.00428 -0.00757 -0.00601 -0.00211 -0.00569 203 4YY -0.01744 0.02107 0.00680 -0.00911 0.01001 204 4ZZ 0.00343 0.00592 -0.00680 0.00561 -0.00270 205 4XY -0.00237 0.01662 0.00330 -0.00483 -0.00889 206 4XZ -0.00221 0.00238 -0.01212 -0.01166 -0.00106 207 4YZ -0.01209 0.01928 -0.00667 0.00700 0.00921 208 19 C 1S -0.00437 -0.00670 -0.00743 -0.00313 -0.01180 209 2S -0.08758 0.07027 -0.02928 -0.02634 0.04235 210 2PX 0.03110 -0.04282 0.02385 0.00062 0.00539 211 2PY 0.07073 0.09563 0.06946 0.25319 -0.01488 212 2PZ -0.05491 -0.22268 -0.05884 -0.48428 0.06215 213 3S -0.14275 0.18367 -0.02029 0.13075 0.31492 214 3PX 0.39803 -0.66316 0.12535 0.05581 -0.33416 215 3PY 0.09054 -0.52509 0.05903 -0.29501 0.15341 216 3PZ 0.17035 0.13967 0.18336 1.00211 -0.05377 217 4XX -0.01711 0.00228 -0.00885 -0.00241 -0.00248 218 4YY -0.00957 0.02222 -0.01660 0.00457 0.00627 219 4ZZ -0.00340 -0.00927 0.01014 -0.00582 0.00142 220 4XY 0.00490 -0.00626 -0.00471 -0.00164 0.01151 221 4XZ 0.00264 0.00144 0.01450 0.00566 0.00427 222 4YZ -0.02298 -0.00035 -0.00494 -0.00593 -0.00122 223 20 C 1S -0.01072 0.01867 0.00050 -0.00101 0.00846 224 2S -0.02440 -0.05857 -0.01907 0.01790 0.03516 225 2PX -0.05281 0.10368 -0.00093 -0.02908 -0.02431 226 2PY 0.18051 -0.07533 -0.11140 -0.09770 0.07225 227 2PZ -0.06307 -0.20010 0.35371 0.27315 -0.10689 228 3S 0.31888 -0.26269 0.05355 -0.13500 -0.33822 229 3PX -0.31285 0.45721 -0.10523 0.04163 0.33403 230 3PY 0.09199 -0.48152 0.39922 0.38740 -0.07559 231 3PZ 0.27168 -0.07961 -0.45982 -0.40985 0.21490 232 4XX -0.01151 0.00515 -0.00046 0.00164 -0.00325 233 4YY -0.00698 -0.00772 0.00348 -0.01204 0.00510 234 4ZZ 0.00855 0.00587 -0.00548 0.00687 0.00219 235 4XY 0.00391 -0.02070 0.00641 0.01225 -0.00806 236 4XZ 0.00905 -0.00508 -0.00366 -0.00355 -0.00030 237 4YZ -0.00051 0.01491 -0.00412 0.00035 0.00676 238 21 C 1S 0.01138 -0.03145 -0.00405 0.00532 -0.01044 239 2S 0.09597 -0.13534 0.07660 0.08173 -0.02577 240 2PX -0.15197 0.21799 -0.09959 -0.09195 0.03926 241 2PY -0.04222 -0.15690 0.09448 -0.08443 -0.05840 242 2PZ 0.09382 0.16699 -0.20910 0.17624 0.05904 243 3S -0.50180 0.54682 -0.30290 -0.03735 0.40744 244 3PX -0.19996 0.42290 -0.05799 -0.05201 -0.12236 245 3PY 0.33257 -0.15574 -0.16058 0.11948 -0.20047 246 3PZ 0.01537 -0.46739 0.43029 -0.23349 -0.26468 247 4XX 0.00927 -0.03354 -0.00685 0.01417 0.00207 248 4YY 0.01732 -0.03423 0.00692 0.02321 -0.01306 249 4ZZ -0.00121 0.00851 0.00566 -0.01249 0.00158 250 4XY -0.00071 -0.00381 -0.01135 -0.00412 -0.01156 251 4XZ -0.00635 -0.00984 0.00142 0.00437 -0.01178 252 4YZ 0.01879 -0.04762 0.00554 0.00820 -0.01278 253 22 H 1S 0.07576 -0.20158 0.02225 0.07276 -0.06823 254 2S -0.10483 0.19218 0.03128 -0.00764 0.22059 255 23 H 1S -0.03689 0.02817 0.01039 0.00610 0.00586 256 2S 0.08136 -0.11148 -0.01074 -0.05715 -0.10630 257 24 H 1S -0.06634 0.01288 -0.03866 -0.01258 -0.05073 258 2S -0.06478 0.11766 0.02280 0.04979 0.19209 259 25 H 1S -0.07291 0.07159 -0.01949 0.00017 0.00458 260 2S 0.11890 -0.14102 0.03007 -0.05124 -0.14821 261 26 H 1S -0.01373 0.19027 0.05906 -0.02825 0.11953 262 2S -0.16360 0.07087 -0.13705 -0.01192 0.04929 263 27 H 1S -0.01734 -0.13855 -0.06914 0.11754 -0.10356 264 2S 0.01529 0.06852 0.00425 -0.05019 -0.15524 131 132 133 134 135 V V V V V Eigenvalues -- 0.69078 0.69401 0.71978 0.75119 0.76107 1 1 C 1S 0.00787 0.01036 0.00072 0.02031 0.00132 2 2S 0.12579 0.09335 0.14325 0.02087 0.13564 3 2PX -0.12635 -0.12367 -0.12161 -0.35074 -0.00548 4 2PY -0.03648 0.05079 -0.11977 -0.30397 -0.29646 5 2PZ 0.20513 -0.30099 0.15754 0.12670 0.08871 6 3S 0.18926 -0.30056 -0.22625 -1.22382 -0.79367 7 3PX 0.21333 0.76359 0.13964 1.66036 0.13720 8 3PY -0.23547 0.08516 0.41545 1.36267 0.88055 9 3PZ -0.23210 0.65495 -0.69861 -0.14945 0.08973 10 4XX 0.03193 0.00263 0.00246 -0.06212 -0.01391 11 4YY 0.01924 -0.00629 0.01521 0.05465 -0.00411 12 4ZZ -0.01172 0.00088 -0.00243 -0.00184 0.01168 13 4XY -0.01941 -0.01418 -0.00588 0.03073 0.01556 14 4XZ 0.01867 0.01855 -0.03412 -0.01668 -0.03812 15 4YZ 0.02075 0.03629 -0.00468 0.03826 -0.00032 16 2 C 1S 0.00842 -0.02978 0.01749 0.00175 0.00065 17 2S -0.00754 0.01502 -0.18943 -0.22261 -0.01227 18 2PX 0.05335 -0.08914 0.01607 -0.33981 -0.14408 19 2PY -0.00960 0.38163 0.02306 0.31242 0.13614 20 2PZ -0.04297 -0.20824 -0.11580 -0.29716 0.03111 21 3S 0.11805 1.38065 0.72078 1.97184 0.35035 22 3PX -0.23745 0.37181 -0.03987 1.49309 0.56842 23 3PY 0.04243 -0.41686 -0.75023 -1.23139 -0.74409 24 3PZ -0.05881 -0.50393 0.50965 0.71515 0.18294 25 4XX 0.02443 0.03198 0.00102 0.00363 0.01104 26 4YY -0.00279 0.00379 -0.00884 0.01217 0.00246 27 4ZZ -0.01574 -0.00918 0.00223 0.00282 0.00042 28 4XY 0.00590 0.03824 0.00532 -0.00893 0.00856 29 4XZ -0.00554 -0.01756 0.01293 0.01833 0.05340 30 4YZ -0.01213 -0.01078 0.00110 -0.00245 -0.01334 31 3 H 1S 0.02444 0.01176 0.08489 0.10511 -0.17183 32 2S 0.05931 0.20716 -0.15529 -0.08340 0.28521 33 4 Br 1S -0.00130 -0.00102 0.00208 0.00070 0.00275 34 2S 0.00789 0.00543 -0.01098 -0.00416 -0.01757 35 3S -0.00786 -0.00363 0.00726 0.00388 0.01947 36 4S -0.02120 -0.01810 0.03602 0.01217 0.04420 37 5S 0.07403 0.06169 -0.14096 -0.24410 -0.28276 38 6S -0.10932 -0.08760 0.32404 0.76668 0.60976 39 7PX 0.00063 0.01509 -0.00363 0.00626 0.02097 40 7PY -0.00431 -0.00846 0.00322 -0.01214 0.01237 41 7PZ -0.00468 0.01886 0.00553 -0.00536 0.00529 42 8PX -0.00201 -0.04884 0.01158 -0.02065 -0.06829 43 8PY 0.01388 0.02759 -0.01021 0.03974 -0.04005 44 8PZ 0.01522 -0.06144 -0.01790 0.01726 -0.01734 45 9PX 0.00316 0.16886 -0.02991 0.09771 0.26286 46 9PY -0.04602 -0.11225 0.02838 -0.15154 0.14520 47 9PZ -0.05558 0.23582 0.05907 -0.06324 0.06525 48 10PX 0.02787 -0.16682 0.00356 -0.22974 -0.37962 49 10PY 0.07152 0.22289 -0.18999 -0.15605 -0.35206 50 10PZ 0.04417 -0.30899 0.09330 0.36037 0.07695 51 11XX 0.00780 -0.05714 0.02536 0.01429 0.01351 52 11YY 0.00077 0.04050 -0.00483 0.00927 -0.02583 53 11ZZ 0.00120 0.02059 -0.02766 -0.02855 -0.01294 54 11XY 0.00124 -0.03774 0.00944 -0.02847 -0.03434 55 11XZ -0.01430 0.00535 0.00584 0.03226 0.01109 56 11YZ 0.00046 -0.08628 0.02170 0.01251 0.00920 57 12XX -0.00955 0.30949 -0.16599 -0.17951 -0.19601 58 12YY 0.01403 -0.22121 0.03611 -0.07097 0.05050 59 12ZZ 0.01427 -0.08858 0.14073 0.09600 -0.01973 60 12XY -0.01303 0.18650 -0.04434 0.16882 0.18461 61 12XZ 0.07888 -0.02262 -0.02864 -0.18062 -0.06901 62 12YZ 0.00443 0.43895 -0.14423 -0.13283 -0.08736 63 5 C 1S -0.00190 -0.00723 -0.00608 -0.01012 -0.00124 64 2S 0.03252 0.14195 0.04000 0.20909 0.06921 65 2PX -0.13048 -0.02776 0.16082 0.04348 0.00939 66 2PY 0.11958 0.17265 -0.07007 0.02734 0.03991 67 2PZ -0.08589 -0.01776 0.09799 0.12403 0.13976 68 3S -0.10451 -0.42315 -0.31526 -0.36381 -0.21150 69 3PX 0.10361 -0.50922 -0.85469 -0.43125 -0.44673 70 3PY -0.31906 -0.84015 -0.10078 -0.23226 0.01826 71 3PZ 0.20068 0.44368 -0.77671 -1.08706 -0.82051 72 4XX 0.00102 0.00094 0.02197 0.00124 -0.00652 73 4YY -0.00796 0.00065 -0.00360 -0.00191 0.00822 74 4ZZ 0.00656 0.00972 -0.01833 0.01154 0.01178 75 4XY -0.00639 -0.01643 0.00270 0.00397 0.00221 76 4XZ -0.01444 0.00900 -0.00471 0.01217 0.03363 77 4YZ 0.01622 0.01320 -0.01371 0.00099 0.00557 78 6 C 1S 0.01135 0.00512 -0.00438 0.01554 -0.00343 79 2S 0.06373 0.07634 -0.15626 -0.01020 0.08294 80 2PX 0.29350 -0.07826 -0.24532 0.21858 -0.49663 81 2PY -0.12264 0.23480 0.00017 -0.17987 0.25502 82 2PZ 0.00702 0.04026 -0.08210 0.03145 0.04049 83 3S -0.04939 -0.16802 -0.39185 -0.74341 -0.87395 84 3PX -0.37031 0.48250 0.73431 -0.30070 0.97672 85 3PY 0.28934 0.10646 0.05951 0.39711 -0.38410 86 3PZ 0.03992 0.04706 -0.25443 -0.49549 -0.43971 87 4XX -0.01661 -0.00157 0.00187 -0.00447 0.01038 88 4YY 0.02106 0.00520 -0.01599 -0.00069 -0.01149 89 4ZZ 0.01961 0.02607 -0.02974 -0.00463 0.00250 90 4XY 0.00935 0.01168 -0.01730 0.01954 -0.00908 91 4XZ 0.01873 -0.00813 -0.00809 -0.01837 -0.03795 92 4YZ -0.00707 -0.00309 0.00330 -0.01244 -0.00406 93 7 C 1S -0.00076 -0.00611 0.00461 0.00522 -0.00391 94 2S 0.07687 -0.02909 -0.07335 0.05489 -0.11215 95 2PX 0.08592 0.19312 0.18616 -0.08679 0.11606 96 2PY 0.04744 -0.08212 -0.15869 0.19180 -0.25167 97 2PZ 0.00908 0.00546 -0.05284 -0.03865 -0.04193 98 3S -0.04997 0.17866 0.43338 0.13782 0.21909 99 3PX -0.07750 -0.17354 -0.49751 0.38439 -0.36155 100 3PY 0.05111 0.58575 0.44604 -0.25220 0.69148 101 3PZ 0.00110 -0.03059 0.26456 0.28189 0.14452 102 4XX 0.00485 -0.00280 0.00043 -0.00571 0.00503 103 4YY -0.00778 -0.01545 0.00715 -0.00315 0.00247 104 4ZZ 0.01443 0.00842 -0.00263 0.03079 -0.02131 105 4XY 0.00426 -0.01670 0.01147 0.01361 -0.00197 106 4XZ 0.00017 0.00072 0.00032 -0.00890 0.00692 107 4YZ -0.00609 -0.00139 0.00503 0.00725 0.01120 108 8 C 1S -0.00026 0.00673 0.00264 0.00256 0.00235 109 2S 0.03090 -0.06321 -0.04263 0.03447 -0.09800 110 2PX -0.21834 -0.15919 -0.27352 0.12386 -0.12285 111 2PY 0.16086 0.08916 0.16981 -0.02117 0.00997 112 2PZ 0.00080 0.00495 -0.02605 -0.09102 0.05994 113 3S -0.09591 -0.06445 -0.06750 -0.23638 0.26578 114 3PX 0.47458 0.28467 0.59062 -0.42351 0.33429 115 3PY -0.34742 -0.25261 -0.53374 0.05428 -0.11048 116 3PZ -0.12956 -0.47751 0.04120 -0.02021 -0.15807 117 4XX 0.00208 -0.00074 -0.00327 -0.01361 -0.00283 118 4YY 0.00031 -0.00002 -0.00481 0.00685 -0.01235 119 4ZZ -0.00006 -0.00520 0.00283 0.00897 0.00560 120 4XY 0.00039 0.00246 -0.00491 -0.00847 -0.00479 121 4XZ 0.00494 -0.00260 0.00330 0.00557 0.00297 122 4YZ -0.00348 -0.00183 0.00470 0.01428 -0.00852 123 9 C 1S 0.00251 0.00515 -0.00114 -0.00085 0.00422 124 2S -0.03910 -0.13292 -0.08956 -0.08114 -0.08201 125 2PX 0.37809 0.00514 0.20816 -0.27113 0.00930 126 2PY -0.28985 -0.16466 -0.22579 -0.00494 -0.05290 127 2PZ -0.03244 -0.05185 -0.05531 -0.08994 -0.04136 128 3S 0.18687 0.65431 0.31407 0.43043 0.20408 129 3PX -0.77398 -0.14582 -0.54188 0.55735 -0.09475 130 3PY 0.50957 0.19147 0.60744 -0.09986 0.08379 131 3PZ -0.04790 -0.28888 0.08542 0.03651 0.19040 132 4XX 0.00279 0.00064 -0.00166 -0.00963 -0.00222 133 4YY 0.00113 0.01009 -0.00139 0.01045 -0.00675 134 4ZZ -0.00472 -0.01479 -0.01036 -0.01833 -0.00493 135 4XY 0.00699 0.01347 -0.00381 -0.00684 -0.00187 136 4XZ -0.00316 0.00830 -0.00095 0.02276 -0.00085 137 4YZ 0.01270 0.01261 -0.00346 0.00813 0.00761 138 10 C 1S -0.00854 -0.00867 0.00377 -0.00524 -0.00267 139 2S -0.05896 -0.12895 -0.03835 -0.01256 -0.06442 140 2PX -0.39230 -0.10245 -0.29878 0.13337 0.06604 141 2PY 0.13689 -0.21255 0.14433 -0.22687 -0.10648 142 2PZ 0.00729 0.07279 -0.00986 0.05243 0.08446 143 3S -0.06574 -0.38350 0.08536 0.29297 0.38392 144 3PX 0.63225 0.10924 0.82780 -0.10610 0.12547 145 3PY -0.29005 0.13691 -0.16471 0.61055 0.31013 146 3PZ 0.07878 0.43229 0.22779 0.04146 -0.18902 147 4XX -0.00099 0.00866 -0.00192 0.02382 0.00012 148 4YY 0.00323 -0.01566 -0.00730 -0.00707 -0.00022 149 4ZZ -0.02692 -0.03775 0.01552 -0.01204 -0.00164 150 4XY -0.01942 -0.02522 -0.00239 0.00941 0.00525 151 4XZ 0.00679 -0.00938 0.00423 -0.00142 -0.01631 152 4YZ -0.00528 -0.00810 -0.01607 -0.03838 -0.00668 153 11 H 1S -0.08486 -0.15444 0.01392 -0.11035 -0.03569 154 2S -0.00673 -0.15459 -0.27229 -0.10084 -0.02090 155 12 H 1S -0.01139 -0.01225 -0.02976 -0.06587 0.00381 156 2S 0.03002 0.07897 0.01897 0.05983 -0.07475 157 13 H 1S -0.00557 0.01575 -0.00025 0.01586 -0.01100 158 2S -0.02194 -0.09553 -0.04211 -0.05605 0.02197 159 14 H 1S 0.02062 -0.00809 0.01669 0.08559 -0.07288 160 2S -0.00137 -0.01675 0.07376 0.06784 0.10575 161 15 H 1S 0.07266 0.05289 -0.08401 0.11921 -0.01649 162 2S -0.02237 -0.18830 -0.20209 -0.27256 -0.20920 163 16 C 1S -0.00208 -0.00219 -0.00381 -0.01158 0.00203 164 2S 0.11079 0.08480 0.14764 -0.03443 0.01841 165 2PX -0.08574 -0.00287 -0.10104 0.13878 0.06170 166 2PY -0.10218 -0.04686 0.32335 0.32522 -0.14930 167 2PZ 0.34504 0.27343 -0.54875 -0.01240 0.13214 168 3S -0.37565 -0.03793 -0.06786 0.04287 0.41245 169 3PX 0.31510 -0.08356 0.27019 -1.34120 -0.46719 170 3PY 0.15099 -0.30397 -0.70343 -1.19489 0.26656 171 3PZ -0.72490 -0.61707 1.29280 -0.04315 -0.44557 172 4XX -0.00245 0.01800 0.00513 0.00390 0.01375 173 4YY -0.00108 0.00298 0.02510 0.00662 0.00790 174 4ZZ 0.01130 -0.00518 -0.01124 -0.01609 -0.00744 175 4XY 0.01762 -0.00754 -0.00418 0.00611 -0.02640 176 4XZ -0.00706 0.00941 0.00704 0.00808 -0.01332 177 4YZ 0.00671 -0.00067 -0.00631 -0.02174 0.00291 178 17 C 1S 0.00458 -0.00200 -0.00107 0.00525 -0.00732 179 2S 0.01333 -0.00124 0.06068 0.03017 0.02577 180 2PX 0.06219 0.01194 -0.06656 0.05201 -0.11473 181 2PY -0.04122 -0.07285 -0.05422 0.03910 0.17705 182 2PZ 0.15468 0.10239 0.15493 0.10761 -0.39328 183 3S -0.13525 -0.41197 -0.10357 -0.78997 -0.20075 184 3PX -0.07743 -0.28842 -0.23062 0.41857 -0.18343 185 3PY 0.02684 -0.01354 0.31983 -0.27859 -0.55514 186 3PZ 0.02347 -0.21327 -0.61792 -0.45793 0.77664 187 4XX 0.01104 -0.00718 -0.00273 0.04867 -0.02854 188 4YY -0.00314 -0.01158 -0.00057 -0.04724 0.01298 189 4ZZ -0.00331 0.00406 0.00884 -0.00134 0.00479 190 4XY 0.00506 0.00808 -0.00746 -0.00696 -0.00060 191 4XZ 0.00326 -0.00859 0.03022 0.01780 0.01010 192 4YZ 0.00300 -0.00682 0.01337 -0.01662 -0.00280 193 18 C 1S 0.00372 -0.00104 -0.00544 0.00974 -0.01127 194 2S -0.01566 -0.02978 -0.01948 0.03140 -0.00445 195 2PX 0.00011 -0.01690 -0.02807 -0.08451 -0.01943 196 2PY 0.01356 0.09750 0.02978 0.02827 -0.22633 197 2PZ -0.00256 -0.24234 -0.08514 0.03082 0.20298 198 3S -0.02593 0.24252 0.25139 -0.65371 0.47191 199 3PX -0.13576 -0.01628 0.02894 -0.03297 0.20070 200 3PY -0.03073 -0.04014 0.03475 -0.30281 0.96756 201 3PZ -0.14744 0.57779 0.48335 -0.11728 -0.38489 202 4XX -0.00782 0.00241 -0.00267 -0.01926 0.02111 203 4YY 0.01155 0.01074 -0.01363 0.01992 -0.02690 204 4ZZ -0.00462 -0.01170 0.01486 0.00785 0.01073 205 4XY 0.00149 0.00022 0.00071 -0.00448 0.00636 206 4XZ -0.00893 -0.00801 0.01242 0.00707 0.00787 207 4YZ 0.00304 -0.00735 0.00849 0.03043 -0.00826 208 19 C 1S -0.00280 0.00159 0.00513 -0.00553 0.00885 209 2S -0.02278 -0.00207 -0.02301 -0.00214 0.03943 210 2PX 0.00567 -0.00424 -0.00566 0.03192 -0.08450 211 2PY 0.09836 -0.09667 -0.08513 -0.05395 0.12013 212 2PZ -0.18588 0.16575 0.17450 -0.02231 -0.12037 213 3S 0.13790 -0.12490 -0.18623 0.29171 -0.53395 214 3PX -0.14084 0.04874 0.11885 -0.53632 0.60576 215 3PY -0.26624 0.17104 0.08961 0.04671 -0.49789 216 3PZ 0.42368 -0.49534 -0.49278 0.06073 0.36360 217 4XX -0.00152 -0.00512 -0.00222 -0.00712 -0.00384 218 4YY 0.00123 0.00818 -0.01008 0.00603 -0.00352 219 4ZZ -0.00222 -0.00476 0.00838 0.00696 0.00465 220 4XY -0.00248 -0.00512 -0.00008 0.00092 -0.00138 221 4XZ 0.00739 0.00858 -0.01812 -0.01213 -0.00640 222 4YZ -0.00309 -0.00213 0.00706 0.01011 0.00507 223 20 C 1S 0.00343 0.00074 0.00066 0.00492 -0.00340 224 2S -0.02738 -0.01318 -0.03434 0.00030 -0.01735 225 2PX 0.01185 0.01865 0.03468 -0.01206 0.08585 226 2PY -0.15125 0.10411 0.00036 -0.12111 -0.11870 227 2PZ 0.25134 -0.27058 -0.07163 0.06521 0.16323 228 3S 0.04638 0.09806 0.12692 -0.37512 0.38495 229 3PX 0.06075 -0.03958 -0.08330 0.55053 -0.48873 230 3PY 0.32986 -0.30599 -0.24248 0.04622 0.29574 231 3PZ -0.65735 0.51237 0.27694 -0.22565 -0.49904 232 4XX 0.00002 0.00120 0.00053 -0.01416 -0.00174 233 4YY -0.00231 -0.00733 0.00804 0.00504 0.01165 234 4ZZ -0.00092 0.00455 -0.01016 -0.00425 -0.00293 235 4XY -0.00559 -0.00663 0.00837 -0.00059 0.00437 236 4XZ 0.00053 0.01282 -0.01463 -0.01471 -0.01089 237 4YZ 0.00058 0.00551 -0.00693 -0.00643 0.00284 238 21 C 1S -0.00325 0.00226 -0.00371 0.00039 -0.00159 239 2S 0.00673 -0.00278 0.00720 -0.10026 -0.07622 240 2PX 0.01596 0.01466 0.03878 0.09611 0.05910 241 2PY 0.17799 -0.10725 -0.03512 0.08323 0.08748 242 2PZ -0.35319 0.15132 0.13328 -0.13800 -0.19552 243 3S -0.01115 0.14487 -0.14568 1.41713 0.00325 244 3PX 0.03023 -0.02747 0.06751 -0.28958 -0.26451 245 3PY -0.36841 0.23523 0.29091 -0.48266 -0.16453 246 3PZ 0.81587 -0.21631 -0.57265 -0.08824 0.58071 247 4XX 0.00081 0.00653 -0.00340 0.03988 -0.00878 248 4YY -0.01652 -0.00875 0.01401 -0.01123 -0.00190 249 4ZZ 0.01122 0.00530 -0.01483 -0.02495 -0.00677 250 4XY -0.00684 0.01195 -0.00126 0.00053 0.00851 251 4XZ 0.00376 -0.00713 0.00329 0.00527 0.01408 252 4YZ 0.00112 0.00750 -0.02110 -0.01665 -0.01214 253 22 H 1S -0.02823 0.00723 -0.03526 -0.05088 -0.02855 254 2S -0.01528 -0.08868 0.02860 0.17990 -0.04073 255 23 H 1S 0.00120 -0.00289 0.01075 -0.01374 -0.01973 256 2S -0.04240 0.01526 0.02961 -0.17323 0.21607 257 24 H 1S -0.01679 0.00617 0.03757 -0.01542 0.06181 258 2S 0.04585 -0.03145 -0.12065 0.20918 -0.30667 259 25 H 1S 0.01667 0.00273 -0.00024 0.11608 -0.07475 260 2S -0.10369 0.09054 0.11587 -0.24947 0.43275 261 26 H 1S 0.05186 -0.00951 -0.00192 0.11353 -0.07022 262 2S 0.05880 -0.17910 -0.19316 0.33450 -0.28487 263 27 H 1S 0.07651 0.11879 0.00652 0.28636 -0.01204 264 2S 0.08519 -0.32472 0.09394 -0.99646 -0.32691 136 137 138 139 140 V V V V V Eigenvalues -- 0.79122 0.80079 0.80407 0.80982 0.82167 1 1 C 1S 0.02298 -0.00236 -0.00152 -0.00468 0.00807 2 2S -0.43552 -0.01901 0.15865 -0.11593 0.21162 3 2PX -0.22857 -0.04491 0.01941 0.02364 -0.06048 4 2PY -0.19889 0.14213 0.03196 -0.08092 -0.05711 5 2PZ -0.26797 0.03764 0.13537 0.09308 0.01222 6 3S 2.26628 -1.13146 -0.50090 1.05803 -0.71057 7 3PX 1.27376 0.82594 0.66114 -0.25497 0.40085 8 3PY 0.33384 -0.37493 -0.63647 -0.27990 0.29851 9 3PZ 0.62001 0.09139 -0.57709 -0.70883 0.30546 10 4XX 0.00510 -0.02846 0.00099 0.02103 0.02306 11 4YY -0.00027 -0.00409 0.01822 0.00192 -0.00089 12 4ZZ -0.02987 0.01979 0.00127 -0.02230 0.00289 13 4XY -0.01451 0.00677 0.01301 0.01484 -0.01970 14 4XZ 0.00858 0.02941 -0.00395 -0.03674 -0.00258 15 4YZ 0.03197 0.00257 0.01871 -0.01285 0.01398 16 2 C 1S -0.00361 -0.01253 -0.01221 0.02132 -0.01302 17 2S 0.07237 -0.00269 0.19699 0.13551 0.27757 18 2PX 0.08066 -0.06069 -0.25335 0.05229 -0.22303 19 2PY 0.01111 0.04778 -0.14740 -0.09836 0.01230 20 2PZ 0.22673 0.10293 -0.08555 -0.14052 0.44195 21 3S 0.36833 0.33330 -1.79837 -1.92808 -0.08031 22 3PX -0.05030 1.18408 1.79555 -0.21300 0.61371 23 3PY -0.60708 0.13328 1.73038 0.94365 -0.03200 24 3PZ -0.70286 -0.40596 0.59001 1.18374 -1.31334 25 4XX 0.00880 -0.00739 0.00600 0.01091 0.04767 26 4YY 0.00450 0.00652 -0.01761 -0.00807 0.01682 27 4ZZ -0.01223 0.00147 0.00111 -0.00467 -0.02445 28 4XY 0.00665 -0.02314 -0.05545 -0.01919 0.02406 29 4XZ -0.00044 -0.03199 -0.01168 0.03541 0.01863 30 4YZ -0.00215 0.01525 -0.01276 -0.02808 -0.01102 31 3 H 1S -0.08613 0.08663 -0.00940 -0.10490 -0.29894 32 2S 0.54399 0.25260 -0.07532 -0.41421 1.12952 33 4 Br 1S 0.00117 -0.00170 -0.00186 0.00230 0.00118 34 2S -0.00866 0.00954 0.01294 -0.01465 -0.00566 35 3S 0.01220 -0.00773 -0.01730 0.01576 0.00263 36 4S 0.01698 -0.02937 -0.02576 0.03883 0.02003 37 5S -0.20143 0.04648 0.32544 -0.18365 0.07389 38 6S 0.39155 -0.03838 -0.70348 0.33964 -0.39073 39 7PX -0.01077 -0.00157 -0.00491 0.01018 -0.00699 40 7PY 0.00245 -0.00585 -0.00717 0.01378 0.00589 41 7PZ -0.00473 -0.00074 0.00191 0.00233 0.00150 42 8PX 0.03510 0.00527 0.01595 -0.03329 0.02275 43 8PY -0.00809 0.01898 0.02356 -0.04489 -0.01915 44 8PZ 0.01558 0.00261 -0.00637 -0.00784 -0.00475 45 9PX -0.13747 -0.02772 -0.05110 0.13341 -0.08117 46 9PY 0.03632 -0.07100 -0.09796 0.17912 0.06604 47 9PZ -0.07390 -0.02200 0.03565 0.04162 0.01135 48 10PX 0.22546 0.01473 -0.07899 -0.18197 0.02006 49 10PY -0.03764 0.15665 0.18548 -0.43221 0.15511 50 10PZ 0.19837 0.04768 -0.20506 -0.07148 -0.09253 51 11XX 0.00208 -0.00902 -0.01167 0.01782 -0.01850 52 11YY 0.00568 0.02832 0.00204 -0.07101 0.02414 53 11ZZ -0.02460 -0.01041 0.03199 0.03220 -0.00674 54 11XY 0.01888 -0.00667 -0.00832 -0.00992 -0.00580 55 11XZ -0.02000 -0.01118 0.01512 0.00782 0.00732 56 11YZ 0.01710 -0.00097 -0.01984 0.00200 0.00605 57 12XX -0.10423 0.05544 0.20784 -0.17479 0.15404 58 12YY -0.14919 -0.17087 0.15733 0.36015 -0.12371 59 12ZZ 0.05173 0.05592 -0.04848 -0.25411 0.09687 60 12XY -0.10502 0.04775 0.07799 0.04268 0.05619 61 12XZ 0.11400 0.04625 -0.11362 -0.04259 -0.04863 62 12YZ -0.09975 0.00738 0.11538 -0.03129 -0.00501 63 5 C 1S 0.00142 -0.00206 -0.00908 -0.00673 0.00699 64 2S 0.02731 0.01657 -0.17105 0.04188 0.03233 65 2PX 0.21583 0.44233 0.08423 -0.41538 -0.15829 66 2PY -0.07271 -0.30672 -0.48588 0.11311 0.07133 67 2PZ -0.02135 -0.08578 -0.19598 -0.02647 -0.19388 68 3S -0.22668 -0.12578 -0.13160 -0.28868 0.06839 69 3PX -0.70413 -0.83480 1.34246 2.02858 -0.14344 70 3PY -0.32359 1.15577 3.58304 1.53861 -0.79853 71 3PZ 0.20838 0.82446 1.38314 -0.01647 1.06490 72 4XX -0.01369 0.02766 0.02476 -0.01940 -0.00586 73 4YY 0.00105 -0.04596 -0.05095 0.01632 0.01708 74 4ZZ 0.00855 0.00612 -0.03413 -0.00240 0.00583 75 4XY -0.00102 0.00442 -0.02454 -0.02179 0.00132 76 4XZ -0.01165 0.00387 0.01062 0.01918 0.01181 77 4YZ -0.01297 -0.00916 0.02249 0.01088 0.05193 78 6 C 1S -0.00038 0.00381 -0.00616 -0.01060 0.01730 79 2S -0.06791 0.02714 -0.02588 0.16787 -0.16480 80 2PX -0.04865 -0.08302 0.20809 0.06117 -0.10122 81 2PY -0.07006 0.08814 0.32175 0.34123 -0.40635 82 2PZ 0.01056 0.01313 -0.21339 -0.19913 0.17013 83 3S 0.19313 0.64298 2.13633 0.74011 -0.51579 84 3PX 0.24883 0.38184 -0.81460 -0.87888 0.86012 85 3PY 0.13471 -0.56203 -1.87119 -1.41978 2.09456 86 3PZ -0.06568 0.41239 1.50473 0.75835 -0.72858 87 4XX 0.00112 0.00787 0.00964 -0.00913 -0.01875 88 4YY -0.00186 -0.00455 -0.00838 0.02288 -0.06117 89 4ZZ -0.01135 0.01785 0.04019 0.03573 0.03495 90 4XY 0.00130 0.01816 0.01688 -0.00455 -0.03294 91 4XZ 0.00559 -0.01744 0.00709 0.01203 0.00997 92 4YZ 0.00612 0.01464 0.02981 0.00404 -0.00834 93 7 C 1S 0.00303 0.00310 -0.00561 -0.00329 -0.02353 94 2S -0.03274 0.01820 0.16509 0.03354 -0.07177 95 2PX 0.00619 0.09813 0.07975 0.03036 -0.17561 96 2PY -0.03756 -0.01583 0.14016 -0.00072 -0.18184 97 2PZ 0.00841 0.05196 0.09714 0.07535 -0.45995 98 3S 0.10661 -0.35817 -1.61230 -1.32071 2.17438 99 3PX -0.09912 -0.39231 -0.53368 -0.32208 0.83282 100 3PY 0.03574 0.07919 -0.70922 -0.47383 0.87185 101 3PZ -0.05389 -0.34523 -0.75441 -0.69667 2.42096 102 4XX -0.00124 0.00037 -0.00145 0.00524 0.01227 103 4YY 0.00292 -0.01159 -0.02351 -0.01978 0.04748 104 4ZZ -0.00819 0.00359 0.02046 -0.00358 -0.02615 105 4XY 0.00466 0.00173 -0.02705 -0.02678 0.02230 106 4XZ -0.00185 -0.01358 -0.03192 0.01040 -0.01279 107 4YZ 0.00654 0.00647 -0.02261 -0.01480 -0.02006 108 8 C 1S -0.00238 0.00124 0.01793 0.00878 0.01748 109 2S -0.00386 0.05950 0.08435 -0.12037 0.01606 110 2PX -0.05515 -0.08998 0.01194 -0.00396 0.23755 111 2PY -0.00069 0.05251 0.11843 -0.09027 0.32566 112 2PZ -0.01040 -0.00635 0.03722 0.01697 0.15176 113 3S 0.06768 0.17007 0.37283 0.80412 -1.27247 114 3PX 0.18920 0.43591 0.22321 0.24562 -1.20244 115 3PY 0.03172 0.07338 0.11096 0.61687 -1.78437 116 3PZ 0.11207 -0.01317 0.02399 0.20145 -0.55238 117 4XX -0.00420 -0.01415 -0.01126 0.01027 -0.00233 118 4YY 0.00175 0.02374 0.05975 0.01279 -0.01669 119 4ZZ 0.00370 0.00559 -0.01258 -0.01387 -0.01535 120 4XY -0.00382 0.00478 0.04692 0.03779 -0.00524 121 4XZ -0.00173 0.00151 0.01129 0.01440 0.01076 122 4YZ 0.00150 0.00870 0.02833 0.00760 0.02519 123 9 C 1S 0.00089 0.00235 -0.00019 0.00611 0.00310 124 2S 0.03932 0.11953 0.13342 -0.09595 0.01842 125 2PX 0.07312 0.10145 0.09096 0.01199 -0.00104 126 2PY 0.02149 0.06442 0.14990 0.05588 -0.02458 127 2PZ -0.00598 -0.02864 -0.04660 -0.10391 0.07107 128 3S -0.22986 -0.69979 -1.60805 -1.03566 0.90603 129 3PX -0.21427 -0.54422 -0.72587 -0.28859 0.23624 130 3PY -0.01345 -0.34081 -1.03649 -0.79786 0.39727 131 3PZ 0.07518 0.15186 0.45008 0.67101 -0.59903 132 4XX -0.00145 -0.00404 -0.00582 -0.00206 -0.01127 133 4YY -0.00011 -0.00031 -0.02843 -0.02468 -0.01846 134 4ZZ 0.00337 0.01046 0.02682 -0.00902 0.05833 135 4XY -0.00094 -0.00698 -0.03555 -0.01779 -0.00169 136 4XZ -0.00256 0.01540 0.01772 -0.02590 0.00502 137 4YZ -0.01317 -0.01046 -0.00314 -0.00509 0.00613 138 10 C 1S 0.00491 -0.00520 -0.02618 -0.01514 -0.02085 139 2S 0.11936 0.07070 -0.07239 -0.04975 0.07677 140 2PX -0.03171 -0.03215 0.06355 0.10636 0.00054 141 2PY 0.13832 0.11395 0.15440 0.03132 0.04422 142 2PZ -0.02412 0.14312 0.54683 0.27939 0.32169 143 3S -0.40435 0.15368 1.80141 1.58413 -1.32436 144 3PX 0.09764 0.15924 -0.38376 -0.64704 -0.11384 145 3PY -0.42260 -0.79638 -1.08086 -0.22830 -0.10647 146 3PZ 0.19698 -0.64446 -2.77621 -1.75161 -0.37520 147 4XX -0.00376 0.01385 0.03109 0.00858 0.02976 148 4YY 0.00493 0.01575 0.03248 0.01268 0.01876 149 4ZZ 0.02003 -0.01684 -0.04741 0.00356 -0.05892 150 4XY 0.01000 0.01248 0.00650 0.00080 -0.02296 151 4XZ 0.01006 0.02421 0.00361 -0.02794 -0.01093 152 4YZ 0.00963 -0.01340 -0.03512 0.00503 -0.01257 153 11 H 1S 0.06691 -0.06537 -0.28503 -0.10538 -0.28215 154 2S -0.08404 0.52005 1.77248 0.91378 0.72407 155 12 H 1S 0.02135 0.03713 0.03528 0.08376 0.03155 156 2S -0.09041 -0.19221 -0.39815 -0.50583 0.25078 157 13 H 1S -0.02555 0.02555 0.19758 0.12457 0.15060 158 2S 0.09295 0.08124 -0.25779 0.07192 -1.17163 159 14 H 1S -0.00465 0.03377 0.01651 0.00990 -0.29825 160 2S -0.04482 -0.17955 -0.27168 -0.26794 1.49052 161 15 H 1S -0.01306 0.05015 -0.08530 -0.09735 0.09940 162 2S -0.12858 0.22031 1.24498 0.87345 -1.23511 163 16 C 1S -0.00758 -0.00459 0.00343 0.00058 0.00284 164 2S -0.07685 -0.04759 -0.02963 0.02741 0.17407 165 2PX -0.04067 0.12796 0.01442 -0.04739 0.00528 166 2PY 0.27962 -0.06040 0.05564 0.04953 0.03404 167 2PZ 0.22828 0.09859 -0.03056 -0.14225 -0.09287 168 3S 1.08953 -1.31647 0.02396 -0.69580 -0.52628 169 3PX 0.97020 -0.98594 0.68001 0.66038 -0.48843 170 3PY -2.24661 0.67374 -0.64455 -0.38822 -0.17798 171 3PZ -1.56628 -0.05355 -0.20063 0.32148 0.12053 172 4XX 0.05514 -0.02374 0.00543 0.00268 0.00689 173 4YY -0.04195 -0.02901 0.00213 0.01383 0.00230 174 4ZZ -0.00946 0.01843 -0.00342 -0.01629 0.00967 175 4XY 0.01330 0.03264 -0.00346 -0.01416 -0.01533 176 4XZ 0.00230 0.01919 0.00024 -0.00558 -0.00256 177 4YZ -0.00793 -0.01759 0.00125 -0.01413 0.01984 178 17 C 1S -0.00206 0.00290 0.00086 0.00201 0.00302 179 2S 0.07221 -0.12312 0.00358 0.03413 0.12053 180 2PX 0.07227 -0.13115 0.05296 -0.01848 -0.07234 181 2PY 0.05283 0.07125 0.00249 -0.11220 -0.05604 182 2PZ -0.06011 -0.15403 0.00485 0.10618 0.00413 183 3S -1.95304 1.79240 -0.89047 0.46099 -0.20437 184 3PX -0.87267 1.59468 -0.65320 0.14110 0.22266 185 3PY -0.78309 0.02777 -0.08998 0.46097 0.09951 186 3PZ -0.15114 0.44927 -0.08260 -0.21777 -0.06141 187 4XX 0.00126 0.05805 -0.02129 0.03433 0.00965 188 4YY -0.03226 -0.00755 -0.00285 -0.01704 0.01821 189 4ZZ 0.00006 -0.03133 0.00840 0.00488 -0.00408 190 4XY -0.02853 -0.01646 -0.00556 -0.00487 0.00805 191 4XZ -0.02657 -0.01782 0.00475 0.00918 0.00486 192 4YZ -0.04623 -0.00253 -0.00425 0.01580 0.00885 193 18 C 1S 0.00818 0.02018 -0.00261 0.00832 -0.00367 194 2S 0.04671 0.04734 0.03088 -0.04024 0.03283 195 2PX -0.10024 -0.04408 -0.04473 0.12915 0.01810 196 2PY -0.00323 0.37873 -0.12054 0.23976 -0.00547 197 2PZ 0.02916 0.28869 -0.06223 0.05685 -0.01564 198 3S 0.68455 -2.13297 0.99983 -0.73177 -0.26126 199 3PX 0.22579 -0.10405 0.18813 -0.67404 -0.07738 200 3PY 0.42333 -2.19346 0.98298 -1.36918 -0.14803 201 3PZ 0.10353 -1.46789 0.53810 -0.46155 -0.01188 202 4XX 0.01326 -0.05954 0.02225 -0.01817 0.00516 203 4YY 0.02207 0.02112 0.01297 -0.02168 -0.01175 204 4ZZ -0.00829 0.00397 -0.00245 0.00164 0.00314 205 4XY -0.00383 -0.00028 0.01440 -0.03018 -0.00919 206 4XZ -0.00867 -0.00510 0.00879 -0.00543 -0.00680 207 4YZ 0.01944 0.01655 0.01880 -0.01543 -0.01088 208 19 C 1S -0.01453 -0.01854 0.01378 -0.02643 -0.00303 209 2S 0.05376 -0.00633 0.00839 0.04773 -0.03167 210 2PX -0.00079 0.37118 -0.26708 0.40705 0.10412 211 2PY -0.07460 -0.27464 0.20011 -0.32163 -0.06945 212 2PZ -0.06533 -0.20344 0.12260 -0.13413 -0.01875 213 3S -0.83503 1.86968 -1.19440 1.26608 0.45611 214 3PX 0.35378 -2.25763 1.33474 -1.69635 -0.35933 215 3PY -0.05183 1.52593 -1.10597 1.37217 0.40594 216 3PZ 0.02839 1.04225 -0.64796 0.63088 0.14584 217 4XX -0.01965 0.02053 0.00137 -0.00208 -0.00604 218 4YY -0.01087 0.02336 -0.02157 0.01132 0.00483 219 4ZZ 0.01249 0.00472 -0.00649 0.02042 0.00463 220 4XY 0.02815 -0.00171 -0.01553 0.07231 0.00938 221 4XZ 0.02402 0.00475 -0.01145 0.02930 0.00650 222 4YZ -0.02522 0.01878 -0.00912 -0.00936 0.00368 223 20 C 1S -0.00887 0.01387 -0.01278 0.00616 0.00551 224 2S -0.04582 0.04895 -0.02089 -0.03151 -0.09987 225 2PX 0.24559 -0.40463 0.29884 -0.16060 -0.08908 226 2PY 0.02342 -0.11159 0.09034 -0.10255 -0.06295 227 2PZ -0.02035 -0.04833 0.05299 -0.03250 -0.07136 228 3S 1.49060 -2.32550 1.38970 -0.41520 -0.14145 229 3PX -1.65339 2.60595 -1.65542 0.74960 0.50119 230 3PY -0.11688 0.60958 -0.57757 0.78538 0.35858 231 3PZ 0.00393 0.20119 -0.28225 0.44006 0.32075 232 4XX 0.04057 -0.00966 -0.01086 0.01412 -0.00221 233 4YY -0.01128 -0.03620 0.03155 -0.02596 -0.01273 234 4ZZ -0.00668 -0.00346 0.00842 -0.00867 -0.00861 235 4XY -0.03245 0.00564 -0.00773 -0.02922 -0.00156 236 4XZ -0.01176 0.00705 -0.00724 -0.02446 0.00222 237 4YZ 0.00168 -0.02832 0.01706 -0.01907 -0.00865 238 21 C 1S 0.03678 -0.00015 0.00085 0.01511 -0.00261 239 2S -0.14533 0.09003 -0.05666 -0.10798 -0.07373 240 2PX -0.10641 -0.03578 0.03653 0.03774 0.06951 241 2PY -0.67457 0.24584 -0.11649 -0.18682 -0.00604 242 2PZ -0.31045 0.15501 -0.07162 -0.15125 0.07534 243 3S -0.70094 1.72138 -0.87473 0.10483 0.57225 244 3PX 0.00690 0.24736 -0.07408 -0.27340 -0.41662 245 3PY 2.77285 -1.80178 1.01192 0.65177 -0.20909 246 3PZ 1.50356 -0.89551 0.52461 0.29114 -0.31728 247 4XX -0.03857 0.03993 -0.00543 -0.04203 -0.00632 248 4YY 0.02042 0.02266 -0.02665 0.04613 0.00674 249 4ZZ -0.01912 0.00013 -0.00288 -0.01518 -0.00287 250 4XY 0.04189 -0.02219 0.01524 0.00095 0.00833 251 4XZ 0.02082 -0.01435 0.00841 0.00263 -0.00340 252 4YZ 0.05127 0.03169 -0.03109 0.03316 0.00541 253 22 H 1S 0.40637 -0.02011 -0.02374 0.17535 -0.00872 254 2S -2.08373 0.83591 -0.46838 -0.70458 0.09798 255 23 H 1S -0.10678 0.13868 -0.15094 0.04940 0.06398 256 2S 0.72362 -1.28430 0.95212 -0.54251 -0.39584 257 24 H 1S -0.14713 -0.16152 0.13896 -0.33990 -0.04719 258 2S 0.18651 1.44814 -1.00256 1.53396 0.30933 259 25 H 1S 0.10419 0.24898 -0.01268 0.03278 -0.03907 260 2S 0.03180 -1.39711 0.47237 -0.74531 0.02726 261 26 H 1S -0.04625 0.02395 -0.05361 0.04538 -0.02648 262 2S -0.18717 0.70986 -0.05088 -0.21418 0.17488 263 27 H 1S 0.24512 0.08995 -0.01616 -0.07141 -0.03058 264 2S -1.06773 0.08102 0.29681 0.25800 -0.15891 141 142 143 144 145 V V V V V Eigenvalues -- 0.82619 0.82994 0.84088 0.84222 0.86476 1 1 C 1S 0.01302 0.00485 -0.00796 -0.00874 -0.00459 2 2S -0.19939 -0.06564 0.38910 -0.25745 0.07603 3 2PX -0.10452 0.04656 0.00492 0.00844 0.10978 4 2PY -0.17528 -0.00406 0.28570 0.01730 0.18707 5 2PZ -0.15384 -0.01283 0.18959 -0.05398 0.28900 6 3S 0.42013 -0.24782 -0.26693 0.92275 -0.35059 7 3PX 0.15961 -0.65409 0.55517 -0.10223 0.26845 8 3PY 0.88188 0.45431 -1.29214 -0.34228 -0.73217 9 3PZ 0.63059 0.27213 -0.80576 -0.25022 -0.83816 10 4XX 0.00209 -0.00568 0.02120 -0.01979 -0.00086 11 4YY 0.00137 0.00225 -0.00004 -0.00169 -0.01979 12 4ZZ -0.01621 0.00157 0.01654 -0.00774 0.02575 13 4XY 0.01918 0.01367 -0.05626 0.01740 -0.01112 14 4XZ 0.01124 0.00660 -0.02839 0.01542 -0.02601 15 4YZ 0.01213 -0.00359 0.00189 -0.01587 -0.03866 16 2 C 1S -0.00573 0.00023 -0.00472 0.01788 0.00545 17 2S 0.10056 0.08998 -0.20545 -0.24140 0.35947 18 2PX 0.06379 0.08549 -0.25024 0.26432 -0.04366 19 2PY 0.09800 0.14056 -0.09085 -0.10109 0.15075 20 2PZ 0.16641 0.17996 -0.19042 -0.42153 0.17734 21 3S -0.30843 -0.29151 0.79537 0.31960 -0.53081 22 3PX -0.23665 -0.60289 0.81602 -0.67873 0.60320 23 3PY -0.64593 -0.78096 0.81158 0.27269 -0.20776 24 3PZ -0.51234 -0.52053 0.49206 1.25980 -0.23783 25 4XX 0.01772 0.00344 -0.00855 -0.03763 0.01694 26 4YY 0.00091 0.01827 -0.02354 -0.01290 0.06977 27 4ZZ -0.00829 -0.00545 0.00665 0.01911 -0.03327 28 4XY -0.01416 0.00969 0.01458 -0.01782 0.04249 29 4XZ 0.00151 0.01185 -0.00896 -0.02919 0.04657 30 4YZ -0.01232 -0.00635 0.01336 0.02079 -0.02286 31 3 H 1S -0.08788 -0.09420 0.10474 0.32027 -0.26330 32 2S 0.47232 0.44961 -0.45725 -1.22007 0.86908 33 4 Br 1S 0.00126 0.00221 -0.00216 0.00008 0.00101 34 2S -0.00845 -0.01501 0.01651 -0.00218 -0.00988 35 3S 0.01010 0.01882 -0.02399 0.00599 0.01806 36 4S 0.02021 0.03362 -0.03213 -0.00110 0.01294 37 5S -0.15590 -0.27545 0.34601 -0.19101 -0.32289 38 6S 0.31961 0.54007 -0.73220 0.52388 0.73238 39 7PX -0.00419 0.00176 -0.00064 0.00570 0.00847 40 7PY 0.00285 0.00974 -0.01123 -0.00149 0.01814 41 7PZ -0.00073 0.00254 0.00530 -0.00124 0.01472 42 8PX 0.01365 -0.00575 0.00217 -0.01848 -0.02784 43 8PY -0.00926 -0.03179 0.03677 0.00465 -0.05935 44 8PZ 0.00239 -0.00825 -0.01728 0.00399 -0.04816 45 9PX -0.05282 0.02132 -0.00926 0.06215 0.11849 46 9PY 0.03481 0.12427 -0.15222 -0.00164 0.24534 47 9PZ -0.01572 0.02437 0.07289 -0.01038 0.18310 48 10PX 0.09778 0.00913 -0.03594 0.01149 -0.21680 49 10PY -0.08076 -0.21467 0.31710 -0.21164 -0.47694 50 10PZ 0.13512 0.08819 -0.24700 0.02803 -0.14167 51 11XX 0.00301 0.00426 -0.01310 0.01717 0.01725 52 11YY -0.00049 -0.01257 0.03862 -0.02962 -0.05631 53 11ZZ -0.01607 -0.01661 0.00843 0.00322 0.01209 54 11XY 0.00856 -0.00407 0.00129 0.00945 -0.03251 55 11XZ -0.00951 -0.00819 0.01174 -0.00645 0.00283 56 11YZ 0.00690 0.00737 -0.01850 -0.00350 -0.01196 57 12XX -0.08539 -0.15180 0.25467 -0.19041 -0.27350 58 12YY -0.07001 -0.06396 -0.02940 0.10199 0.13641 59 12ZZ 0.04375 -0.00960 0.10142 -0.13660 -0.22069 60 12XY -0.05249 0.01047 0.01144 -0.07600 0.18302 61 12XZ 0.05625 0.05382 -0.07205 0.04611 -0.01744 62 12YZ -0.05817 -0.05986 0.12982 0.00883 0.02944 63 5 C 1S -0.00394 0.00181 -0.00442 -0.00277 0.00296 64 2S 0.08145 0.26866 -0.26970 -0.04225 0.20333 65 2PX -0.05100 -0.11529 0.08361 0.13195 0.33266 66 2PY -0.01665 0.16427 -0.17360 0.06379 0.16981 67 2PZ -0.06235 -0.09644 0.06736 0.06044 -0.13125 68 3S -1.47538 -1.43149 0.43892 1.21742 1.52140 69 3PX 0.30929 0.10449 -0.18101 -0.07511 -0.97858 70 3PY 0.28620 -0.55977 0.47552 -0.03651 -0.65073 71 3PZ 0.42848 0.37700 -0.39294 -0.78758 0.46511 72 4XX -0.01190 -0.00974 0.03130 -0.00923 -0.01553 73 4YY -0.01434 0.00622 -0.01854 -0.01807 0.00696 74 4ZZ 0.00356 0.03015 -0.04198 0.03333 0.06824 75 4XY -0.03205 -0.01227 0.01200 0.00026 0.06376 76 4XZ -0.00838 0.00869 0.01714 0.01974 0.02928 77 4YZ -0.00322 0.00990 0.03887 -0.00306 0.01686 78 6 C 1S 0.00361 0.01922 0.00999 0.00341 0.00655 79 2S -0.10859 0.01969 -0.12312 0.22775 0.28124 80 2PX 0.05587 -0.06751 -0.07703 -0.04397 0.12551 81 2PY -0.00577 -0.14771 -0.18247 0.06106 0.08152 82 2PZ -0.06704 0.07500 0.13146 0.19871 0.20769 83 3S 1.38391 0.47226 -0.31156 -1.47847 -0.31459 84 3PX -0.33276 0.19884 0.46096 0.23440 0.06253 85 3PY -0.39848 0.59124 0.65828 0.18443 -0.02101 86 3PZ 0.62226 -0.06566 -0.33597 -1.37086 -1.04915 87 4XX -0.01168 -0.02970 0.00560 -0.00476 -0.03466 88 4YY 0.01430 0.01085 -0.02415 -0.00385 0.00186 89 4ZZ 0.00896 0.03846 -0.01444 0.00267 0.05895 90 4XY 0.02265 0.01523 0.01058 -0.02645 0.03643 91 4XZ 0.00440 -0.00392 -0.03521 0.00687 -0.02185 92 4YZ -0.00961 -0.02844 -0.03130 0.02264 -0.02019 93 7 C 1S 0.00570 -0.00500 -0.01364 -0.02945 -0.00615 94 2S -0.03079 -0.06626 0.13179 0.20950 0.07718 95 2PX 0.02397 0.00911 -0.11201 -0.00456 -0.05109 96 2PY 0.04897 -0.06139 0.00648 -0.03640 0.00734 97 2PZ 0.23945 0.03378 -0.08734 -0.66324 -0.03002 98 3S -1.20252 -0.34886 -0.35847 0.52767 -0.20843 99 3PX -0.22056 0.04435 0.38800 -0.01019 -0.00849 100 3PY -0.34314 0.16704 0.39528 -0.00785 -0.09237 101 3PZ -1.51857 -0.56006 -0.05660 2.71329 0.38847 102 4XX -0.00042 0.01552 0.02837 0.04063 0.00097 103 4YY -0.01074 0.01150 0.04284 0.04203 -0.01910 104 4ZZ -0.02753 -0.05924 -0.05701 -0.02645 0.02551 105 4XY -0.01412 0.00228 0.00824 0.01345 -0.01135 106 4XZ 0.00965 0.01990 -0.01314 -0.01950 -0.00443 107 4YZ 0.01863 0.01805 0.02373 -0.03495 0.01903 108 8 C 1S -0.01020 -0.01494 -0.02323 0.00944 -0.00234 109 2S -0.03632 -0.04233 0.11042 -0.02860 -0.11945 110 2PX -0.19400 -0.20616 -0.23843 0.13156 -0.07576 111 2PY -0.31288 -0.36808 -0.35645 0.23567 -0.05715 112 2PZ -0.09230 -0.10933 -0.06661 0.00236 0.05061 113 3S 1.55306 1.36177 0.76653 -0.90533 -0.40377 114 3PX 1.07096 1.01394 0.82614 -0.61641 0.03296 115 3PY 1.75496 1.69204 1.37032 -1.13366 -0.07723 116 3PZ 0.57196 0.66799 0.34877 0.29006 -0.18434 117 4XX -0.00147 0.00179 -0.00452 -0.00430 -0.00602 118 4YY 0.00634 -0.02403 -0.02910 -0.00544 0.01011 119 4ZZ 0.03384 0.04925 0.06569 -0.01330 -0.02852 120 4XY 0.00980 -0.01132 -0.05278 0.00415 -0.01234 121 4XZ 0.00336 0.01098 -0.00985 0.04221 -0.01140 122 4YZ 0.00488 0.00923 -0.01146 0.06131 -0.00863 123 9 C 1S 0.01360 0.02268 0.01144 0.02708 -0.00158 124 2S 0.00088 -0.04803 -0.08155 -0.14728 -0.09189 125 2PX 0.15137 0.16521 0.08238 0.10715 -0.05363 126 2PY 0.24293 0.26380 0.23469 0.20078 -0.06861 127 2PZ -0.28832 -0.39746 -0.26442 -0.29267 0.12614 128 3S -1.66281 -1.42558 -0.22955 0.04185 0.29182 129 3PX -0.78953 -0.74937 -0.31833 -0.36285 0.07415 130 3PY -1.36918 -1.38490 -0.69956 -0.65705 0.27105 131 3PZ 1.58853 1.88615 1.40420 0.61754 -0.67691 132 4XX -0.00368 -0.01010 -0.00516 -0.03836 0.00011 133 4YY -0.01203 -0.00929 0.00545 -0.01526 0.00906 134 4ZZ -0.02675 -0.02845 -0.03017 0.03764 -0.01143 135 4XY -0.01057 0.00236 0.00374 0.01402 0.00182 136 4XZ -0.01524 -0.02991 0.00720 -0.04867 0.00156 137 4YZ -0.02141 -0.03208 -0.01170 -0.08139 -0.02168 138 10 C 1S -0.00435 -0.00592 0.00220 -0.00900 -0.00066 139 2S 0.11111 0.14117 -0.27386 -0.06421 0.11344 140 2PX 0.04684 0.06213 -0.05569 0.07326 -0.00709 141 2PY 0.13572 0.07555 -0.11880 0.05177 0.08809 142 2PZ 0.28669 0.25586 0.02018 -0.03284 -0.15029 143 3S 0.89999 0.49520 0.92620 0.62818 -1.07729 144 3PX -0.42796 -0.48636 0.35637 -0.29787 -0.02313 145 3PY -0.69720 -0.51556 0.44896 -0.37447 -0.53574 146 3PZ -1.48094 -1.26412 -0.47057 -0.30475 0.99516 147 4XX 0.00714 0.00606 -0.01047 0.00077 -0.00142 148 4YY 0.03059 0.02686 -0.01627 0.00099 -0.01661 149 4ZZ 0.01665 0.01806 0.00032 -0.00189 0.00604 150 4XY 0.02553 0.02274 0.00113 0.01072 -0.01309 151 4XZ 0.00977 0.00990 0.03233 0.00530 0.03757 152 4YZ 0.01860 0.03551 0.01141 0.02335 0.02363 153 11 H 1S -0.06680 -0.06651 0.02693 -0.01065 0.10264 154 2S 0.80946 0.71310 -0.05445 0.20093 -0.45323 155 12 H 1S 0.15551 0.26309 0.13605 0.33508 0.02797 156 2S -1.17233 -1.45754 -0.95316 -1.05324 0.27602 157 13 H 1S -0.11832 -0.16966 -0.33020 0.16237 0.00926 158 2S 1.04777 1.16281 1.22903 -0.74927 -0.01247 159 14 H 1S 0.05205 -0.05646 -0.17436 -0.32461 -0.00581 160 2S -0.73379 -0.10988 0.34406 1.79505 0.17941 161 15 H 1S 0.03721 0.18306 0.12952 0.06332 0.16956 162 2S 0.14153 -0.62309 -0.59896 -0.39102 -0.68200 163 16 C 1S -0.00348 -0.00193 0.00601 -0.00357 -0.00220 164 2S -0.01708 -0.06537 0.27844 -0.18446 -0.43884 165 2PX 0.01345 0.03285 -0.14909 0.01490 0.00436 166 2PY 0.04708 -0.00661 0.03108 -0.00888 0.08511 167 2PZ 0.00226 -0.07210 0.06880 0.07371 -0.10565 168 3S 0.42977 0.49816 -0.91726 0.37138 1.54557 169 3PX -0.73240 -0.62546 1.53513 0.34255 0.97534 170 3PY -0.28653 0.69305 -0.71479 -0.08648 -0.61612 171 3PZ -0.10745 0.57745 -0.53747 -0.20333 0.09955 172 4XX -0.02311 0.00796 0.01336 -0.01490 -0.00718 173 4YY 0.01459 -0.01370 0.02945 -0.00752 -0.01326 174 4ZZ 0.00568 -0.00641 0.00467 -0.00379 -0.01893 175 4XY 0.00204 0.01435 -0.02467 0.02440 0.00974 176 4XZ 0.00173 0.01032 -0.01217 0.00372 0.01961 177 4YZ 0.01055 -0.00954 0.02701 -0.01975 -0.01421 178 17 C 1S 0.00624 -0.00847 0.01485 -0.00314 0.01470 179 2S 0.13182 -0.13163 0.16136 -0.08647 -0.35761 180 2PX 0.08886 -0.10155 0.17136 0.01848 0.29264 181 2PY 0.04408 -0.00781 -0.01842 0.04561 0.10441 182 2PZ 0.06151 0.07692 -0.06945 0.04475 0.12116 183 3S -0.97725 1.13444 -1.18474 0.14759 0.16095 184 3PX -0.65090 1.17212 -1.45128 -0.06873 -1.13549 185 3PY -0.45811 0.19366 0.15784 -0.28636 -0.73709 186 3PZ -0.30949 -0.12263 0.26228 -0.15209 -0.62894 187 4XX -0.02982 0.02804 0.01550 -0.01895 -0.00132 188 4YY 0.01340 -0.01440 0.01008 -0.01086 -0.05001 189 4ZZ 0.01236 -0.00880 -0.00960 0.01033 -0.00679 190 4XY 0.00559 -0.00067 0.02738 -0.02190 -0.02438 191 4XZ 0.00212 0.00080 0.01665 -0.01417 0.00071 192 4YZ -0.00010 0.00178 0.00957 -0.00941 -0.01334 193 18 C 1S -0.02749 0.02232 -0.00577 -0.00222 -0.00357 194 2S 0.15494 -0.16151 0.03457 0.04268 0.18927 195 2PX -0.15149 0.08078 0.11198 -0.10392 -0.21601 196 2PY -0.44453 0.36635 -0.14639 -0.05641 -0.22312 197 2PZ -0.25338 0.16177 -0.05836 -0.04089 -0.13536 198 3S 0.27909 -0.54368 0.75802 0.06887 0.28480 199 3PX 0.67677 -0.18107 -0.72427 0.52800 1.04834 200 3PY 1.59080 -1.32816 0.71355 0.26117 0.91384 201 3PZ 0.89763 -0.59066 0.31787 0.14126 0.58869 202 4XX 0.05592 -0.06359 0.02422 0.00948 0.03488 203 4YY -0.03538 0.04530 -0.01400 0.00159 0.00200 204 4ZZ 0.01379 -0.01219 0.00304 0.00007 0.00996 205 4XY -0.02691 0.04202 -0.03712 0.00736 -0.00621 206 4XZ -0.01552 0.02544 -0.02298 0.00488 0.00404 207 4YZ -0.04522 0.04707 -0.01001 -0.00481 0.00130 208 19 C 1S 0.00465 0.00875 -0.01238 0.00345 -0.00342 209 2S -0.03156 -0.03968 0.00529 0.01730 0.26158 210 2PX -0.09545 -0.10118 0.21443 -0.12365 -0.01182 211 2PY 0.02273 0.11719 -0.10088 0.02820 -0.13644 212 2PZ 0.02301 0.08535 -0.07149 0.00977 -0.04428 213 3S -0.09588 -0.05612 0.04104 -0.32135 -1.35332 214 3PX 0.57911 -0.06533 -0.33091 0.46180 0.59907 215 3PY 0.22759 -0.58833 0.07926 -0.00997 0.33433 216 3PZ 0.07364 -0.39607 0.09958 0.01173 0.07027 217 4XX -0.04892 0.05201 -0.02739 -0.00527 -0.02656 218 4YY 0.03822 -0.03385 -0.00193 0.01053 0.02355 219 4ZZ 0.00551 -0.02166 0.02052 -0.00513 0.02266 220 4XY -0.02904 -0.02625 0.06294 -0.02318 0.01804 221 4XZ -0.01402 -0.01780 0.03772 -0.01272 0.00246 222 4YZ 0.02884 -0.01001 -0.02138 0.00855 0.00624 223 20 C 1S 0.02780 -0.02085 -0.00139 0.00468 -0.00085 224 2S -0.14950 0.19377 -0.12871 0.03009 0.26329 225 2PX -0.46705 0.33451 0.12375 -0.10847 0.09121 226 2PY -0.17547 0.20985 -0.05800 -0.01658 0.03792 227 2PZ -0.09962 0.09291 -0.02862 0.00864 0.02240 228 3S -0.42248 -0.26554 1.05253 -0.14343 -0.47416 229 3PX 1.66935 -0.91276 -0.72594 0.20286 -0.50561 230 3PY 0.58122 -0.95700 0.40647 -0.01721 -0.15545 231 3PZ 0.32360 -0.43570 0.20692 -0.07912 -0.01885 232 4XX 0.04972 -0.04832 -0.00426 0.02684 0.02168 233 4YY -0.04090 0.04194 -0.00204 -0.01180 0.01859 234 4ZZ -0.04059 0.03501 0.00072 -0.00855 0.00169 235 4XY 0.06535 -0.02545 -0.03565 0.02401 0.00739 236 4XZ 0.03537 -0.01167 -0.01870 0.01147 -0.00224 237 4YZ -0.00240 0.00620 -0.00138 0.00327 0.00545 238 21 C 1S -0.01026 -0.00649 0.00886 0.00323 0.01113 239 2S -0.11240 0.18649 -0.05039 0.02682 0.27467 240 2PX 0.00224 -0.05224 0.11872 -0.09099 -0.17068 241 2PY 0.12778 0.11571 -0.17287 -0.00452 0.01071 242 2PZ 0.08639 0.08342 -0.09911 -0.04767 0.01128 243 3S 1.15260 -0.27471 -1.02959 -0.09997 -1.25333 244 3PX -0.13595 0.36190 -0.44193 0.39501 0.81552 245 3PY -1.01424 -0.31083 1.18720 0.01340 0.47931 246 3PZ -0.59807 -0.27057 0.69897 0.13026 0.10915 247 4XX 0.00013 0.04127 -0.03849 0.00148 0.00549 248 4YY 0.00947 -0.03019 0.01072 0.00656 0.03758 249 4ZZ -0.00177 0.00383 0.00391 0.00108 -0.00421 250 4XY -0.01793 -0.00120 0.01488 -0.00918 -0.00180 251 4XZ -0.01171 -0.00384 0.00947 0.00233 -0.00839 252 4YZ 0.01370 -0.03483 0.00772 0.01328 0.01144 253 22 H 1S -0.06939 -0.10129 0.08706 0.04201 0.06889 254 2S 0.60037 0.50017 -0.84866 -0.09467 -0.26781 255 23 H 1S 0.36034 -0.25810 -0.04786 0.07355 -0.06046 256 2S -1.44452 1.09499 0.21778 -0.22062 0.38665 257 24 H 1S 0.07761 0.15377 -0.23339 0.06647 -0.11198 258 2S -0.26984 -0.45029 0.57110 -0.27356 0.20985 259 25 H 1S -0.33228 0.30575 -0.11592 -0.03281 -0.10937 260 2S 1.47591 -1.19185 0.42312 0.24301 0.81023 261 26 H 1S 0.04936 0.01191 0.05957 -0.01693 0.13280 262 2S -0.27427 0.46625 -0.69562 -0.03601 -0.79637 263 27 H 1S 0.17493 0.07914 -0.30224 0.06915 -0.16333 264 2S -0.87165 -0.20228 1.12940 0.06187 0.94029 146 147 148 149 150 V V V V V Eigenvalues -- 0.86953 0.87274 0.88208 0.89797 0.90869 1 1 C 1S 0.01105 0.00212 -0.00481 -0.01449 0.00593 2 2S 0.16241 -0.06437 0.03529 0.23931 -0.28198 3 2PX -0.07609 0.23196 0.13321 0.05003 -0.16425 4 2PY 0.00857 -0.47927 -0.29154 0.00936 -0.17008 5 2PZ -0.00087 -0.20697 0.00289 0.03277 -0.18176 6 3S -0.26306 -1.25283 -1.04800 -0.43014 1.49386 7 3PX 0.57769 -2.21111 -0.00235 -0.66487 0.81546 8 3PY 0.16258 2.24186 0.61588 0.22247 0.01585 9 3PZ 0.14076 1.17143 0.13240 -0.14065 0.16655 10 4XX 0.02522 -0.02654 -0.01093 0.03373 -0.02411 11 4YY 0.01232 -0.01582 -0.00957 -0.03501 0.03418 12 4ZZ -0.00478 -0.00096 0.00342 0.01222 -0.02757 13 4XY -0.00891 0.06769 0.02779 0.00226 0.00400 14 4XZ -0.01615 0.02340 0.02050 -0.05237 0.00377 15 4YZ 0.01869 0.02558 0.00795 -0.05206 0.04167 16 2 C 1S -0.01208 -0.03069 -0.00932 -0.01155 0.00670 17 2S 0.33079 0.09135 0.16255 0.18354 0.03016 18 2PX -0.19319 0.11790 -0.07738 0.01968 0.04320 19 2PY 0.22926 0.02507 -0.21798 0.12374 -0.09429 20 2PZ 0.26744 -0.01465 0.01566 -0.17388 -0.02888 21 3S -0.30252 -0.35422 -0.71700 0.28953 -0.41664 22 3PX 0.59894 -1.03374 0.91283 -0.75265 0.23919 23 3PY -0.71840 -0.57945 1.31469 -0.74609 0.36669 24 3PZ -0.77826 -0.63179 -0.08802 0.25273 0.39068 25 4XX 0.05132 -0.01047 0.00203 0.03171 0.00594 26 4YY 0.04316 -0.01012 0.01516 -0.01640 -0.00854 27 4ZZ -0.04211 0.01090 -0.02057 0.02280 -0.00709 28 4XY 0.02080 -0.01223 -0.00625 0.02804 -0.01137 29 4XZ 0.02638 -0.00298 -0.00646 0.05513 0.00534 30 4YZ -0.06106 -0.00008 -0.00148 -0.01995 -0.00456 31 3 H 1S -0.36617 -0.05652 -0.12194 -0.07933 -0.00557 32 2S 1.27478 0.16316 0.12469 -0.03717 -0.11593 33 4 Br 1S -0.00149 -0.00197 -0.00035 -0.00374 0.00227 34 2S 0.01004 0.01454 0.00125 0.02609 -0.01409 35 3S -0.01311 -0.02131 0.00052 -0.03438 0.01480 36 4S -0.01977 -0.02514 -0.00596 -0.05486 0.03717 37 5S 0.16173 0.58904 0.25517 0.35664 -0.23183 38 6S -0.22035 -1.24489 -0.72575 -0.46014 0.39801 39 7PX -0.00455 -0.00554 -0.00171 0.00501 -0.00633 40 7PY -0.00612 -0.01257 0.00639 -0.01806 0.00298 41 7PZ -0.00273 0.00389 0.00002 0.00881 -0.00323 42 8PX 0.01481 0.01781 0.00533 -0.01637 0.02073 43 8PY 0.02040 0.04157 -0.02098 0.05939 -0.00985 44 8PZ 0.00881 -0.01318 -0.00031 -0.02912 0.01058 45 9PX -0.05575 -0.04996 0.00041 0.06226 -0.08425 46 9PY -0.09730 -0.19896 0.08065 -0.24626 0.04816 47 9PZ -0.03851 0.08253 0.02396 0.12687 -0.04491 48 10PX 0.06481 -0.01648 -0.18616 -0.02446 0.13495 49 10PY 0.13550 0.49950 0.11016 0.21988 -0.15877 50 10PZ 0.20445 -0.24413 -0.33853 -0.08013 0.08189 51 11XX -0.01618 -0.00324 -0.00632 0.01034 -0.00020 52 11YY 0.02572 0.03486 -0.02702 0.03538 -0.01799 53 11ZZ 0.00655 -0.00381 0.03131 -0.00032 -0.00035 54 11XY -0.00398 0.00536 -0.02180 0.01254 0.01280 55 11XZ -0.00380 0.01940 0.02675 0.00732 -0.00971 56 11YZ 0.01126 -0.03739 -0.02093 -0.02045 0.00555 57 12XX 0.16475 0.27055 0.11383 0.12244 -0.08260 58 12YY -0.06483 0.05193 0.20442 0.02453 0.03277 59 12ZZ 0.08515 0.29486 -0.12336 0.20103 -0.08864 60 12XY 0.02697 -0.01862 0.15214 -0.08122 -0.07130 61 12XZ 0.02140 -0.11428 -0.17541 -0.02228 0.05082 62 12YZ -0.09454 0.22082 0.16421 0.07933 -0.03956 63 5 C 1S 0.00365 0.00079 -0.00339 0.00915 -0.00590 64 2S 0.04263 -0.13758 -0.11957 0.14804 -0.28904 65 2PX -0.00210 0.02507 -0.02212 -0.03435 0.06304 66 2PY -0.06800 -0.11250 -0.05200 -0.00332 -0.02756 67 2PZ 0.08773 0.02824 -0.19918 0.03821 0.09158 68 3S -0.63014 -0.35198 1.11899 -0.98193 1.10290 69 3PX -0.17598 -0.23485 0.42544 -0.16079 0.25475 70 3PY 0.13360 -0.36582 0.66534 -0.52395 0.59325 71 3PZ -0.28500 -0.28757 1.13110 -0.91378 -0.23798 72 4XX 0.00222 -0.02163 -0.00163 -0.01471 -0.01778 73 4YY -0.00057 -0.00011 0.02696 0.03216 -0.00861 74 4ZZ -0.00688 -0.01296 -0.02165 -0.00308 -0.01101 75 4XY -0.00426 -0.02687 0.02125 -0.01882 -0.00428 76 4XZ -0.02392 -0.02659 0.01778 -0.03097 0.01245 77 4YZ -0.01575 0.01253 0.04243 -0.00905 0.00805 78 6 C 1S -0.02565 0.00392 0.01465 0.00630 -0.00461 79 2S 0.16618 -0.08671 0.09336 -0.40338 0.10390 80 2PX 0.23589 0.05783 0.07034 0.03337 0.01723 81 2PY 0.26727 -0.03059 0.04758 -0.12806 0.11175 82 2PZ -0.37868 0.03150 0.00174 0.03084 0.00206 83 3S 0.09961 0.02827 0.44158 0.68293 -0.48935 84 3PX -0.79593 -0.14419 -0.05552 -0.18826 -0.09522 85 3PY -1.18993 0.07628 0.03714 0.25231 -0.38390 86 3PZ 0.86729 -0.19786 0.17117 -0.54936 -0.16822 87 4XX 0.05996 0.00979 -0.01260 0.00261 0.00515 88 4YY 0.00362 0.00550 0.00534 -0.00750 0.00542 89 4ZZ -0.04267 -0.02622 0.03775 -0.05698 -0.00186 90 4XY -0.00992 -0.00217 0.00275 -0.00950 0.00546 91 4XZ 0.05497 0.02665 0.01679 0.02709 -0.01283 92 4YZ 0.10113 -0.00044 0.00330 0.00160 -0.00675 93 7 C 1S -0.00583 -0.00071 -0.00999 0.00101 0.00207 94 2S 0.25197 0.09610 0.30647 -0.19711 0.44689 95 2PX -0.02276 0.05385 0.07284 0.16910 -0.16536 96 2PY 0.08964 0.08360 -0.00465 0.23445 -0.09857 97 2PZ -0.18862 -0.06592 -0.23352 0.04448 -0.18053 98 3S -0.69335 0.02560 -0.43319 1.10522 -1.73401 99 3PX -0.37244 -0.12695 -0.13327 -0.56097 0.39974 100 3PY -0.90119 -0.29379 -0.06631 -1.07485 0.47227 101 3PZ 0.27196 0.28427 0.57001 0.28691 0.11472 102 4XX 0.02035 -0.00219 0.02890 -0.02039 0.02614 103 4YY 0.03932 0.01644 0.04036 -0.00407 0.02920 104 4ZZ -0.03847 0.00252 -0.03857 0.00112 0.01695 105 4XY -0.00365 0.00126 0.01303 -0.00083 0.00017 106 4XZ -0.04675 -0.00353 -0.01489 -0.00697 -0.00541 107 4YZ -0.05071 -0.01598 -0.03856 -0.02506 0.01444 108 8 C 1S 0.00445 -0.00008 -0.01203 0.00301 -0.00213 109 2S -0.03348 0.13148 0.54945 0.11692 0.18976 110 2PX 0.04595 0.01956 -0.19818 0.07100 -0.13801 111 2PY 0.08647 0.03237 -0.32073 0.08789 -0.21211 112 2PZ -0.13176 -0.05720 -0.13026 -0.23496 0.16444 113 3S 0.23258 -0.31893 -1.35828 -0.18249 -0.59569 114 3PX -0.14157 -0.04587 0.42454 -0.21624 0.26750 115 3PY -0.26491 -0.13574 0.57890 -0.35036 0.54142 116 3PZ 1.05308 0.28056 0.43172 1.44294 -1.11684 117 4XX -0.00851 0.00431 0.01980 -0.00173 0.01104 118 4YY 0.00743 -0.00366 -0.02594 -0.00753 0.00822 119 4ZZ 0.00279 0.01545 0.07196 0.02490 0.01192 120 4XY 0.00911 0.00268 -0.04724 0.00550 -0.01391 121 4XZ 0.00765 0.00073 -0.01862 0.02025 -0.02361 122 4YZ 0.02456 0.01316 -0.03084 0.03910 -0.03884 123 9 C 1S 0.00829 0.00258 -0.00232 0.00082 -0.00556 124 2S -0.29443 0.05280 0.26615 0.22633 0.00771 125 2PX 0.05651 0.07100 -0.02500 -0.01627 -0.03218 126 2PY 0.11612 0.02753 -0.11875 -0.03340 -0.03441 127 2PZ -0.28691 -0.06832 0.15797 -0.19370 0.31143 128 3S 0.51376 -0.00636 -0.48860 -0.70062 0.02482 129 3PX 0.16280 -0.11466 0.14332 0.32718 -0.26227 130 3PY 0.23774 0.03906 0.40705 0.41867 -0.39837 131 3PZ 1.05164 0.23433 -0.36221 1.04761 -1.04718 132 4XX -0.02076 0.00343 0.02142 0.00312 0.01221 133 4YY 0.00290 -0.00341 0.02355 0.01243 -0.01812 134 4ZZ -0.01688 0.00725 -0.00181 0.00212 0.01138 135 4XY 0.02097 0.01048 0.01178 0.01147 -0.02982 136 4XZ -0.03187 -0.00293 0.01753 -0.00359 0.02409 137 4YZ -0.07150 -0.00456 0.03326 -0.00434 0.03731 138 10 C 1S 0.02152 0.00359 0.00478 0.00246 -0.00382 139 2S -0.20988 -0.07213 -0.28933 0.29721 -0.08780 140 2PX -0.08962 -0.09748 -0.08684 0.05326 0.04374 141 2PY -0.07517 0.02577 -0.10310 0.02146 0.12515 142 2PZ -0.33307 -0.04480 -0.16469 0.08727 0.13892 143 3S 0.33775 0.11003 0.02529 -0.47162 0.63719 144 3PX 0.49046 0.26157 0.15090 0.16387 -0.25169 145 3PY 0.56125 0.08027 0.12573 0.49209 -0.52559 146 3PZ 0.83979 0.16524 0.53632 -0.39377 -0.29295 147 4XX -0.05359 -0.01276 -0.01300 -0.00157 0.01643 148 4YY -0.05771 0.00966 -0.02702 0.02312 0.01186 149 4ZZ 0.09689 -0.00337 -0.02092 0.02950 -0.02966 150 4XY -0.00896 -0.00151 -0.02484 0.02069 -0.00281 151 4XZ 0.03183 -0.00522 0.01139 -0.01748 -0.00741 152 4YZ 0.01711 0.00434 0.02557 -0.00762 -0.00887 153 11 H 1S 0.33386 0.00642 0.07321 -0.04568 -0.06688 154 2S -1.21491 -0.17369 -0.44648 0.21946 0.31852 155 12 H 1S 0.19168 0.01463 -0.08507 -0.02653 -0.16163 156 2S -0.75417 -0.14375 0.56473 -0.13559 0.49378 157 13 H 1S 0.05057 -0.02955 -0.29445 0.00335 -0.13997 158 2S -0.14300 0.03487 1.12514 -0.01946 0.44392 159 14 H 1S -0.17491 -0.02564 -0.15653 0.09395 -0.16531 160 2S 0.42622 0.15939 0.66465 -0.25561 0.57877 161 15 H 1S -0.44336 -0.00952 0.06611 0.01084 -0.06441 162 2S 1.56726 0.00867 -0.01980 -0.36364 0.15539 163 16 C 1S 0.00448 -0.00046 -0.00111 0.00331 0.00720 164 2S 0.22686 -0.38425 -0.23679 -0.00893 0.29710 165 2PX -0.02861 0.14976 0.26088 -0.05691 -0.15466 166 2PY 0.00095 -0.22250 -0.02023 -0.18718 -0.08171 167 2PZ -0.00915 -0.15613 -0.12943 -0.07275 -0.02496 168 3S -0.80937 1.66445 -0.00637 -0.16820 -1.44857 169 3PX 0.02390 -1.87486 -1.46543 0.14601 1.05064 170 3PY -0.11762 2.22351 -0.07196 1.01154 -0.07792 171 3PZ -0.07633 1.41566 0.32789 0.58015 -0.16667 172 4XX 0.02062 -0.00736 -0.01790 0.03216 0.03765 173 4YY 0.00403 -0.01365 -0.02641 -0.01194 -0.00458 174 4ZZ -0.00095 -0.00899 0.00218 -0.02150 -0.00065 175 4XY -0.00350 -0.07343 -0.02211 -0.01121 -0.00348 176 4XZ 0.00406 -0.02607 -0.00323 0.00391 -0.01179 177 4YZ 0.00772 -0.01973 -0.01932 -0.03739 0.00232 178 17 C 1S 0.00210 -0.00240 -0.01439 -0.02278 0.00815 179 2S -0.01861 -0.20311 -0.14388 -0.51659 -0.24863 180 2PX 0.05363 -0.07783 -0.18859 -0.18697 0.28969 181 2PY -0.04866 -0.09198 -0.05603 -0.13868 -0.09630 182 2PZ -0.07519 -0.02768 0.06353 -0.09150 -0.04864 183 3S -0.13670 1.16484 0.89545 2.47587 -0.08595 184 3PX -0.26361 0.57617 1.45375 0.99217 -1.63355 185 3PY 0.27864 0.93755 -0.08256 0.38677 0.72688 186 3PZ 0.24315 0.41026 -0.33144 0.20248 0.44377 187 4XX 0.00271 -0.02437 -0.02365 -0.10726 -0.00770 188 4YY 0.00257 -0.00371 -0.01055 0.00131 -0.01668 189 4ZZ -0.00947 0.00902 0.01410 0.03768 -0.01273 190 4XY 0.01741 0.01180 -0.04577 -0.06481 0.06260 191 4XZ 0.00702 0.01898 -0.01263 -0.02038 0.02661 192 4YZ 0.00318 0.00008 -0.00974 -0.00855 -0.01082 193 18 C 1S 0.00090 -0.00784 0.00324 -0.00736 -0.01311 194 2S -0.13033 0.26113 0.04907 -0.42547 -0.75798 195 2PX 0.06124 -0.03236 -0.11254 -0.27440 0.00319 196 2PY 0.04365 -0.14876 0.23308 0.09631 0.00306 197 2PZ 0.04106 -0.07729 0.09989 0.07642 -0.00998 198 3S 0.40822 -0.86252 -0.69433 1.51231 3.06746 199 3PX -0.38119 -0.36997 0.79397 1.94410 -0.28064 200 3PY -0.05499 0.10345 -0.96153 -0.67021 0.45219 201 3PZ -0.07476 0.08320 -0.41212 -0.45062 0.26927 202 4XX -0.01330 0.05086 -0.00452 0.02116 -0.03000 203 4YY 0.00049 -0.03238 0.00033 -0.08150 -0.04339 204 4ZZ -0.00360 0.01359 -0.00377 -0.01073 -0.01482 205 4XY -0.00715 -0.01150 0.02932 0.02960 -0.02047 206 4XZ -0.00482 -0.00293 0.01969 0.02126 -0.01128 207 4YZ 0.00661 -0.03164 0.00694 -0.05653 -0.03120 208 19 C 1S 0.00014 -0.00450 0.00567 0.00224 -0.00745 209 2S -0.13288 0.65618 -0.02659 0.03533 -0.31839 210 2PX -0.00885 0.34624 -0.20004 -0.30854 -0.17296 211 2PY 0.01957 -0.16120 0.08014 -0.28331 -0.17373 212 2PZ 0.00712 -0.08729 0.07111 -0.15135 -0.09269 213 3S 0.50909 -1.32471 0.35758 0.16398 1.18272 214 3PX -0.07228 -1.06037 0.38194 1.80595 1.00019 215 3PY -0.05245 0.06752 0.31083 2.02311 0.89273 216 3PZ -0.00894 0.04564 0.07338 1.09007 0.46362 217 4XX -0.00630 0.02195 0.02446 -0.03747 -0.08323 218 4YY -0.00633 0.02802 -0.00205 0.03901 0.02542 219 4ZZ -0.00274 0.03687 -0.01719 0.00780 0.01184 220 4XY -0.00187 0.06441 -0.04499 -0.01177 0.01997 221 4XZ -0.00015 0.02993 -0.03135 -0.01079 0.01552 222 4YZ 0.00079 -0.00724 0.01918 0.02926 0.00741 223 20 C 1S 0.00031 -0.00850 0.00154 0.00687 0.00979 224 2S -0.04933 0.42941 -0.22323 0.36431 0.49584 225 2PX -0.00490 0.18081 -0.26718 0.04299 0.12151 226 2PY -0.04881 0.22966 -0.07031 -0.26125 -0.22858 227 2PZ -0.02713 0.13690 -0.03685 -0.11657 -0.13225 228 3S 0.05469 -1.20944 0.19065 -1.65382 -1.33828 229 3PX 0.11596 0.04949 0.66098 -0.58352 -0.43288 230 3PY 0.18053 -0.79400 0.39949 1.77022 1.29569 231 3PZ 0.09866 -0.46109 0.26229 0.90429 0.72024 232 4XX -0.00883 -0.05671 0.01206 0.08997 0.05070 233 4YY -0.00111 0.06785 -0.02618 -0.02113 0.00884 234 4ZZ -0.00198 0.04393 -0.02360 -0.01660 0.00501 235 4XY -0.00496 -0.02421 0.02955 0.00372 -0.03050 236 4XZ -0.00222 -0.01680 0.01209 -0.00796 -0.01533 237 4YZ -0.00296 0.01819 -0.00973 -0.00483 0.00945 238 21 C 1S -0.00272 -0.01006 -0.00378 0.01366 0.00213 239 2S 0.10405 -0.22858 -0.36484 0.36356 0.61121 240 2PX 0.05161 0.02796 0.01042 -0.03931 0.11005 241 2PY 0.06729 0.21478 -0.12900 -0.07033 0.13478 242 2PZ 0.04871 0.08660 -0.06424 -0.08827 0.07448 243 3S -0.09534 0.99478 1.55241 -1.62946 -2.01836 244 3PX -0.22926 0.12382 -0.58103 -0.22412 -0.48738 245 3PY -0.24540 -1.09008 -0.09126 0.21469 -0.25598 246 3PZ -0.15223 -0.58676 -0.15081 0.21207 -0.10684 247 4XX 0.01614 -0.00282 -0.02951 -0.02218 0.05246 248 4YY -0.00015 -0.03136 0.00872 0.07999 0.01117 249 4ZZ 0.00040 -0.00131 -0.01921 -0.00362 0.01394 250 4XY 0.00415 -0.02234 0.01760 0.02656 -0.01278 251 4XZ -0.00170 -0.01379 0.00361 0.01653 -0.00493 252 4YZ -0.00355 -0.04642 0.00663 0.05722 0.01045 253 22 H 1S -0.06536 -0.18570 0.10702 0.15151 -0.21603 254 2S 0.26652 0.90948 -0.25844 -0.25745 0.78197 255 23 H 1S 0.00199 -0.20561 0.14021 0.04104 -0.03821 256 2S -0.10117 0.72344 -0.69514 0.02215 0.21435 257 24 H 1S 0.02378 -0.29559 0.16660 0.02143 -0.06180 258 2S -0.08767 1.14026 -0.39964 -0.01398 -0.12875 259 25 H 1S 0.04731 -0.17139 0.10722 -0.02840 0.00425 260 2S -0.20014 0.46048 -0.53992 -0.36310 -0.17400 261 26 H 1S 0.01346 -0.04160 -0.17315 -0.24796 0.23702 262 2S -0.07799 0.41540 0.91696 0.66329 -1.06834 263 27 H 1S 0.01183 0.18018 0.06265 -0.32537 0.19442 264 2S -0.20945 -1.16440 -0.34434 0.54370 -0.88006 151 152 153 154 155 V V V V V Eigenvalues -- 0.91126 0.92134 0.94124 0.95779 0.96380 1 1 C 1S 0.01236 0.00308 -0.01627 -0.00183 -0.00077 2 2S 0.15762 0.08614 0.13477 -0.02141 -0.02242 3 2PX -0.24227 0.03589 -0.09934 0.24045 -0.20651 4 2PY 0.23702 -0.16674 0.05691 -0.04219 -0.10727 5 2PZ 0.01777 -0.04458 0.04281 -0.02989 -0.00905 6 3S -0.77449 -0.88318 -0.18636 0.36153 -0.18074 7 3PX 1.56267 0.32006 -0.11465 -0.77862 1.33179 8 3PY -0.74594 0.48203 -0.70048 0.24196 -0.93057 9 3PZ 0.03079 0.41986 -0.46118 0.20502 -0.35938 10 4XX 0.00415 -0.02307 -0.01041 0.01431 -0.05677 11 4YY 0.03651 0.00587 -0.01921 -0.01385 0.03642 12 4ZZ -0.00514 0.00973 0.03001 -0.00065 0.00713 13 4XY -0.02710 -0.01570 -0.00950 -0.00427 -0.02966 14 4XZ 0.06169 0.04656 0.00333 0.02210 0.05970 15 4YZ -0.00480 0.02394 -0.02598 0.02687 0.02589 16 2 C 1S 0.02405 -0.00760 0.00308 -0.00615 0.00888 17 2S -0.18940 -0.16966 0.05665 -0.17047 0.00828 18 2PX -0.02183 -0.09951 -0.01689 0.17329 -0.14822 19 2PY -0.14891 -0.30073 0.05096 -0.11117 -0.31879 20 2PZ 0.05498 0.06123 0.02312 0.06118 0.02607 21 3S 0.42348 0.61809 0.22178 -0.04967 0.04155 22 3PX 1.03597 0.73257 -0.18108 -0.70818 1.54040 23 3PY 0.71096 0.89019 -0.16744 0.63561 1.48481 24 3PZ 0.02411 -0.42317 0.02975 0.05941 0.06703 25 4XX 0.00566 -0.02042 0.01687 -0.02749 0.00330 26 4YY -0.00162 0.00037 -0.00939 -0.00740 0.01965 27 4ZZ -0.00651 -0.00558 0.02739 -0.01065 -0.01651 28 4XY -0.00693 0.01592 0.01729 0.01619 0.01977 29 4XZ -0.06218 -0.04178 -0.01269 -0.02434 -0.04935 30 4YZ 0.01165 0.02406 0.00194 0.02434 0.01146 31 3 H 1S 0.21232 0.06467 0.09966 -0.01870 0.08576 32 2S -0.27908 -0.10115 -0.14268 -0.50677 -0.14344 33 4 Br 1S 0.00162 0.00205 -0.00311 -0.00031 0.00201 34 2S -0.01360 -0.01323 0.02109 0.00437 -0.01620 35 3S 0.02339 0.01568 -0.02635 -0.01014 0.02596 36 4S 0.01649 0.03031 -0.04774 -0.00115 0.02497 37 5S -0.50390 0.03566 0.32054 0.46097 -0.32525 38 6S 0.96277 -0.42285 -0.51279 -1.16095 0.43737 39 7PX -0.00111 -0.00402 0.00749 -0.00104 -0.00216 40 7PY 0.01045 0.01131 -0.01154 -0.00304 0.01556 41 7PZ -0.01825 -0.00804 -0.00191 -0.00414 -0.00759 42 8PX 0.00397 0.01304 -0.02429 0.00346 0.00704 43 8PY -0.03486 -0.03724 0.03805 0.01023 -0.05159 44 8PZ 0.06028 0.02648 0.00634 0.01339 0.02512 45 9PX -0.03666 -0.04158 0.08334 -0.01601 -0.02307 46 9PY 0.17522 0.14720 -0.16786 -0.06984 0.23682 47 9PZ -0.27005 -0.10172 -0.03257 -0.03314 -0.10806 48 10PX 0.10093 -0.07111 -0.05103 0.02615 -0.08289 49 10PY -0.27825 0.10638 0.27919 0.41595 -0.23445 50 10PZ 0.39119 -0.13034 0.09984 -0.20522 -0.05040 51 11XX -0.01431 -0.01486 -0.00223 -0.01095 -0.00801 52 11YY -0.01969 -0.01024 0.04376 0.01966 -0.04120 53 11ZZ 0.00277 0.00576 -0.00695 0.00631 0.01388 54 11XY -0.00058 -0.01338 0.00369 0.00854 -0.01913 55 11XZ -0.01262 0.01600 0.00230 0.00265 0.00833 56 11YZ 0.05426 0.00610 0.01174 -0.01585 0.01234 57 12XX -0.16709 0.08920 0.16358 0.28049 -0.13423 58 12YY -0.16454 0.00307 -0.09316 0.06283 0.01562 59 12ZZ -0.29151 -0.06618 0.19145 0.15358 -0.30581 60 12XY -0.00036 0.10030 -0.03048 -0.05097 0.13312 61 12XZ 0.06689 -0.11084 -0.00192 -0.01798 -0.06830 62 12YZ -0.27606 0.03671 -0.06842 0.14145 -0.02021 63 5 C 1S 0.00110 -0.01262 0.00577 0.00919 -0.01232 64 2S 0.25868 0.02371 0.20040 0.21018 -0.09523 65 2PX -0.16484 -0.06999 -0.09219 0.02947 0.03594 66 2PY 0.04345 -0.08848 -0.03586 -0.18354 0.01762 67 2PZ -0.16673 -0.10270 0.21144 0.17250 -0.17873 68 3S -1.21692 -0.26788 -1.99440 -1.75695 0.81130 69 3PX 0.76034 0.06185 0.36224 0.61608 0.16417 70 3PY 0.72733 -0.04447 0.31074 1.03300 0.57570 71 3PZ 1.41475 0.97187 -0.92462 -1.36506 0.99261 72 4XX 0.02779 0.01058 0.01438 -0.01748 0.02802 73 4YY 0.01044 0.00483 0.01110 0.02358 -0.00531 74 4ZZ -0.01432 -0.02608 -0.01890 -0.00091 -0.02402 75 4XY 0.00711 0.01231 -0.00681 0.02685 0.02703 76 4XZ 0.01689 0.02481 -0.00604 0.00385 0.04177 77 4YZ -0.02298 0.03266 0.00530 0.04305 0.03853 78 6 C 1S -0.00647 0.00052 -0.00625 -0.00118 -0.00551 79 2S 0.03885 0.12935 0.10121 0.39766 -0.25373 80 2PX -0.00513 -0.06002 0.01218 0.02897 -0.06983 81 2PY 0.07011 -0.17162 -0.05171 -0.01686 0.03086 82 2PZ -0.31373 -0.01852 -0.23324 -0.10443 0.07408 83 3S 0.88297 -0.34853 -0.96588 -1.21555 1.60195 84 3PX 0.02661 0.51950 0.02620 -0.26662 0.12109 85 3PY -0.11576 0.89459 0.22164 -0.37025 -0.21036 86 3PZ 1.62726 0.93615 0.93347 0.30847 -0.00931 87 4XX -0.00076 -0.02490 0.02071 0.00033 -0.00895 88 4YY -0.00324 -0.00542 0.00192 0.01467 -0.03280 89 4ZZ 0.03285 0.04532 -0.01393 0.03322 0.01285 90 4XY -0.02535 0.00756 0.00018 0.01011 -0.01023 91 4XZ 0.01834 -0.01754 0.00512 0.00300 -0.01836 92 4YZ 0.05621 -0.03135 0.00250 -0.02909 0.01867 93 7 C 1S -0.00421 0.00048 0.00936 -0.00262 -0.01776 94 2S -0.09672 -0.08247 0.39401 -0.14427 -0.59299 95 2PX 0.02007 -0.07504 -0.17865 -0.11949 0.08852 96 2PY -0.10137 -0.15623 -0.18584 -0.09447 0.20811 97 2PZ -0.13197 0.38536 -0.01466 -0.06479 0.11789 98 3S 0.33800 0.11274 -1.41047 0.49100 2.33287 99 3PX -0.05501 0.82083 0.85822 0.11146 -0.83724 100 3PY 0.14719 1.44478 1.20116 0.00645 -1.38397 101 3PZ -0.08333 -1.14715 -0.55796 -0.07385 0.01751 102 4XX 0.02554 -0.01880 0.01270 0.01557 0.00315 103 4YY 0.01519 -0.02084 0.04164 0.02572 -0.02440 104 4ZZ -0.07058 0.01844 0.00604 -0.05719 -0.06238 105 4XY 0.01077 0.00648 0.01401 -0.00427 -0.02325 106 4XZ -0.01767 0.02837 0.00708 -0.00466 -0.04360 107 4YZ -0.04167 0.04231 0.02334 0.00484 -0.04018 108 8 C 1S -0.00067 -0.00104 -0.00219 -0.01886 -0.00476 109 2S 0.18581 -0.32665 -0.09069 -0.78671 -0.17457 110 2PX -0.06386 0.11170 -0.03816 0.00628 0.05967 111 2PY -0.12310 0.15797 -0.09286 0.03309 0.15658 112 2PZ -0.14996 0.33595 0.22366 -0.20294 -0.34451 113 3S -0.05207 1.13042 0.93438 3.32167 0.79087 114 3PX 0.15811 -0.02066 0.15615 -0.10600 -0.29714 115 3PY 0.24053 0.11462 0.49735 -0.29401 -0.75591 116 3PZ 0.62598 -1.87097 -1.46606 1.81575 2.79296 117 4XX 0.00463 -0.00873 0.00055 -0.02155 -0.01348 118 4YY -0.02029 0.01991 -0.00964 -0.09238 -0.02298 119 4ZZ 0.04287 -0.05694 0.00518 0.01163 0.01398 120 4XY -0.02248 0.02654 -0.01232 -0.07451 -0.02352 121 4XZ 0.00601 -0.01508 -0.02979 -0.01327 0.02450 122 4YZ -0.01257 -0.02255 -0.04290 -0.00604 0.03333 123 9 C 1S 0.00239 -0.00341 -0.01106 -0.00335 0.00924 124 2S 0.20648 -0.59466 -0.43163 -0.12428 0.36318 125 2PX -0.08364 0.17899 0.00009 -0.23787 -0.11652 126 2PY -0.12648 0.30103 0.02288 -0.39221 -0.14387 127 2PZ 0.01839 -0.13153 0.04166 -0.25790 -0.20503 128 3S -0.76666 2.14751 1.78778 0.33882 -1.45688 129 3PX 0.30184 -0.52851 -0.06380 1.41285 1.01022 130 3PY 0.33229 -0.85345 -0.20576 2.29949 1.55939 131 3PZ 0.26243 -0.34204 0.03628 2.51313 1.59953 132 4XX 0.00453 -0.03035 0.00047 0.03809 0.01047 133 4YY 0.02843 -0.03281 -0.03238 0.03637 0.06005 134 4ZZ -0.00298 -0.01415 -0.02859 -0.09010 -0.01096 135 4XY 0.00667 -0.00571 -0.03198 0.02017 0.04136 136 4XZ 0.00249 -0.00726 0.03362 0.01404 -0.02194 137 4YZ 0.02079 -0.01330 0.05666 0.02517 -0.04401 138 10 C 1S 0.00321 -0.00711 -0.00164 0.00663 -0.00104 139 2S 0.01990 -0.61905 -0.09373 0.60921 -0.02623 140 2PX 0.02046 -0.13271 -0.05859 -0.23301 -0.10615 141 2PY -0.13587 -0.19204 -0.10805 -0.27320 -0.19951 142 2PZ 0.06082 -0.20288 0.21789 0.27552 -0.02464 143 3S -0.27165 1.02408 0.76890 -1.90793 -1.41096 144 3PX -0.14541 0.15191 0.46750 1.53639 0.58503 145 3PY 0.21295 0.22091 0.93189 2.41145 0.93853 146 3PZ -0.35916 0.52857 -0.85132 -1.58602 -0.12347 147 4XX 0.00993 -0.01422 0.00879 -0.01026 -0.00039 148 4YY -0.01811 -0.04580 0.00252 0.00361 -0.03630 149 4ZZ 0.01105 -0.04880 -0.00759 0.09865 0.01107 150 4XY 0.00212 -0.02890 -0.00501 -0.01525 -0.02938 151 4XZ -0.00490 0.01059 -0.02720 -0.02146 0.03596 152 4YZ -0.00125 0.01673 -0.04442 -0.03356 0.02957 153 11 H 1S -0.04679 0.07927 -0.09722 -0.00186 0.04841 154 2S 0.23887 -0.61181 0.35087 0.78045 -0.03118 155 12 H 1S -0.05555 0.21739 -0.13966 -0.08123 0.14168 156 2S 0.29218 -0.82572 -0.13912 0.15334 0.12848 157 13 H 1S -0.09812 0.14815 -0.09589 -0.10964 -0.00649 158 2S 0.46275 -0.58822 0.08591 -0.22923 -0.17671 159 14 H 1S -0.12359 0.16322 -0.06816 -0.10611 -0.08821 160 2S 0.18780 -0.64232 0.24574 0.09223 -0.50029 161 15 H 1S -0.16399 0.08396 -0.19409 -0.03417 0.06836 162 2S 0.84662 -0.15076 0.63170 0.58083 -0.27775 163 16 C 1S 0.00237 -0.00003 -0.01692 0.00006 -0.00308 164 2S 0.04524 -0.04833 -0.42131 -0.15945 -0.06258 165 2PX 0.00746 0.11977 -0.29353 0.19698 -0.23384 166 2PY 0.17688 0.02582 -0.17688 0.06847 -0.17538 167 2PZ 0.14752 -0.03269 -0.07926 0.03448 -0.09696 168 3S -0.26091 -0.00772 2.24362 0.24232 -0.20393 169 3PX -1.00986 -1.35243 2.58909 -1.14990 2.54757 170 3PY -1.20983 -0.61866 1.38892 -0.94926 1.09403 171 3PZ -0.93058 -0.25466 0.69160 -0.51242 0.44083 172 4XX -0.01623 -0.01363 -0.01103 -0.03311 0.02922 173 4YY -0.01672 -0.01786 -0.03129 0.00154 -0.05851 174 4ZZ 0.03012 0.02263 -0.00225 0.01359 0.01861 175 4XY 0.06324 -0.02230 0.03012 -0.04227 0.02410 176 4XZ 0.00291 -0.01475 0.02420 -0.01519 -0.00898 177 4YZ 0.03002 0.01717 -0.02908 0.01305 -0.00226 178 17 C 1S -0.00261 -0.00200 -0.00645 0.01080 0.00387 179 2S 0.12456 -0.26132 -0.37217 -0.19609 -0.03959 180 2PX -0.35368 -0.03787 0.00800 0.22323 0.10696 181 2PY 0.17848 0.09118 0.09723 0.14854 -0.15374 182 2PZ 0.08970 0.08394 0.01680 0.05104 -0.11021 183 3S 0.25240 0.94158 1.47689 0.02241 -0.68251 184 3PX 1.52220 0.63000 -0.52237 -0.33863 -1.42554 185 3PY -1.87789 -1.03486 0.31736 -1.06364 1.83458 186 3PZ -0.92875 -0.63176 0.25253 -0.50552 1.11285 187 4XX -0.01028 -0.01283 -0.03870 0.04413 -0.00738 188 4YY 0.03674 -0.00794 -0.00536 -0.03294 0.00878 189 4ZZ -0.00192 -0.01345 -0.00286 -0.03391 -0.01009 190 4XY -0.04560 -0.01154 -0.00505 0.00930 0.06649 191 4XZ -0.04883 -0.00763 0.00268 0.00374 0.02201 192 4YZ -0.00741 -0.01845 -0.00660 -0.01715 -0.02003 193 18 C 1S 0.00229 -0.00695 -0.00572 -0.00102 -0.01008 194 2S 0.29342 -0.23177 -0.14245 0.02499 -0.40621 195 2PX -0.33366 -0.27497 -0.11277 -0.07253 0.15425 196 2PY -0.19124 0.10211 0.04901 0.08445 -0.09591 197 2PZ -0.10087 0.04699 0.04234 0.05665 -0.05331 198 3S -1.24318 0.79543 0.36516 0.30478 1.41562 199 3PX 2.51214 2.07089 0.06497 0.85931 -2.24640 200 3PY -0.03095 -0.39967 0.07275 -0.05134 0.77798 201 3PZ -0.10952 -0.22523 -0.00417 -0.08497 0.44744 202 4XX 0.04004 0.00183 -0.01944 0.00225 -0.03532 203 4YY -0.00777 -0.02742 -0.00190 0.00840 -0.01033 204 4ZZ 0.00462 -0.00798 -0.00032 -0.00276 0.00261 205 4XY 0.04033 0.03379 0.02895 0.00936 -0.02257 206 4XZ 0.00901 0.01228 0.01409 -0.00039 -0.01996 207 4YZ -0.02719 -0.01949 0.00225 0.01418 -0.01528 208 19 C 1S 0.00787 0.00177 0.01396 -0.00478 -0.00169 209 2S 0.37011 0.08194 0.51065 -0.05802 -0.05254 210 2PX 0.04467 -0.20574 -0.00174 -0.13187 0.04800 211 2PY -0.26741 -0.18727 0.05746 0.00315 0.07255 212 2PZ -0.15787 -0.09046 0.02903 0.00253 0.03318 213 3S -1.37529 -0.15073 -2.43049 0.42641 -0.03946 214 3PX 0.82415 1.48461 -0.56456 0.91559 -1.09456 215 3PY 1.40642 1.62727 -0.83431 0.59334 -1.35128 216 3PZ 0.76538 0.81304 -0.42648 0.31154 -0.69518 217 4XX 0.00024 -0.02857 0.05472 -0.01925 -0.01552 218 4YY 0.04058 0.03128 0.01657 0.00142 0.00350 219 4ZZ 0.01448 0.00895 -0.00634 0.00449 0.00202 220 4XY -0.00564 -0.01647 -0.05950 0.00969 -0.00527 221 4XZ 0.00976 -0.00432 -0.03304 0.00878 0.00540 222 4YZ 0.01787 0.02379 0.02641 0.00238 0.00290 223 20 C 1S 0.00435 0.00477 0.00822 -0.00513 0.01089 224 2S 0.30131 0.22490 0.35893 -0.11808 0.40827 225 2PX 0.28234 0.05189 -0.23885 -0.01129 -0.15266 226 2PY -0.01612 -0.17819 0.27505 -0.10825 0.11804 227 2PZ -0.04703 -0.11887 0.15559 -0.06394 0.05338 228 3S -1.33107 -0.95690 -1.33648 0.72679 -0.97705 229 3PX -0.58014 -0.43739 1.01783 -0.51704 0.95816 230 3PY 0.64665 1.54720 -2.52624 1.32064 -1.86486 231 3PZ 0.42034 0.92437 -1.40635 0.74566 -1.01326 232 4XX 0.01070 0.03737 0.05339 -0.01324 0.03549 233 4YY 0.01143 -0.00498 0.01536 -0.00295 0.02339 234 4ZZ 0.01761 -0.00493 -0.01690 0.00044 -0.00614 235 4XY -0.01931 -0.01259 0.07263 -0.01996 0.02255 236 4XZ 0.00231 -0.00278 0.03733 -0.00872 0.01767 237 4YZ 0.00287 -0.00326 0.02329 -0.00753 0.02588 238 21 C 1S 0.00299 -0.00468 0.00552 -0.00872 0.00716 239 2S 0.21507 0.00324 -0.29201 -0.10628 0.08189 240 2PX 0.00667 0.13834 -0.48587 0.20797 -0.28964 241 2PY 0.10754 -0.02581 -0.14665 0.00567 -0.09389 242 2PZ 0.11470 0.02341 -0.05958 0.01406 -0.00864 243 3S 0.09709 0.09739 0.52777 -0.03999 -0.12443 244 3PX -0.62918 -1.48300 3.88571 -2.00019 2.88609 245 3PY -0.27615 -0.07295 0.45591 0.09585 0.24902 246 3PZ -0.16016 -0.10348 0.15338 0.07215 0.03998 247 4XX 0.05012 0.00000 -0.04287 -0.01735 0.01766 248 4YY -0.01861 -0.00204 0.00866 -0.01473 -0.00658 249 4ZZ 0.01575 0.00278 -0.01233 0.00779 -0.00096 250 4XY 0.01115 0.01684 -0.06527 0.01970 -0.05749 251 4XZ 0.00939 0.00299 -0.03704 0.00682 -0.03044 252 4YZ 0.01165 0.00227 0.01677 -0.02201 0.02185 253 22 H 1S -0.06523 -0.03060 0.08182 0.00110 -0.11409 254 2S 0.31754 0.20176 -0.94556 0.18535 -0.35655 255 23 H 1S -0.14379 0.01667 0.09374 0.01323 0.00388 256 2S 0.53241 0.00599 -0.02612 -0.10711 0.00199 257 24 H 1S -0.07246 0.01716 0.11247 -0.03112 -0.00628 258 2S 0.52298 0.00099 0.05756 -0.18632 -0.06695 259 25 H 1S -0.14304 0.01219 0.02645 0.00971 0.02284 260 2S 0.55773 -0.20742 -0.11322 -0.06723 0.07590 261 26 H 1S -0.14788 0.00561 0.09774 0.16195 0.22675 262 2S 0.61873 -0.00070 -0.51505 -0.66594 -0.51363 263 27 H 1S 0.11797 0.07111 -0.10143 0.01851 0.14304 264 2S 0.08234 -0.48389 0.88119 -0.17461 0.10887 156 157 158 159 160 V V V V V Eigenvalues -- 0.99760 1.00352 1.01784 1.07179 1.08888 1 1 C 1S 0.00450 0.00381 -0.02237 0.01344 -0.01978 2 2S 0.28347 -0.12614 -0.51774 0.49270 -0.38755 3 2PX 0.00227 0.21742 0.01855 0.06273 0.07208 4 2PY -0.10100 0.09632 -0.05054 -0.06856 -0.06362 5 2PZ -0.08024 0.13385 0.14921 -0.11486 0.04637 6 3S -0.34351 -0.31600 -0.47933 -0.15420 0.55519 7 3PX 0.40696 -2.03766 -1.19068 -0.34869 -0.82840 8 3PY 0.19081 0.11317 0.65672 0.15315 1.00796 9 3PZ 0.03148 -0.09850 0.08187 0.24492 0.44856 10 4XX 0.02427 -0.01969 -0.07725 0.03244 -0.03761 11 4YY 0.04948 0.00590 -0.08711 0.03124 -0.07874 12 4ZZ -0.04118 0.00162 0.06277 0.00289 0.04999 13 4XY 0.00257 0.04028 0.03788 -0.05005 -0.00648 14 4XZ -0.03742 -0.01668 0.00394 0.02482 -0.02429 15 4YZ -0.01524 0.02789 -0.05004 -0.00571 -0.02159 16 2 C 1S -0.00172 -0.00788 -0.01803 0.01400 -0.02118 17 2S 0.06779 -0.19936 0.05255 0.06035 -0.24943 18 2PX 0.03904 -0.11828 0.01331 0.03257 0.11497 19 2PY 0.03345 0.33114 0.02171 0.02620 0.07721 20 2PZ -0.35806 0.06851 0.05907 -0.01500 0.08700 21 3S 0.24187 -1.04426 -0.25662 0.20739 0.51525 22 3PX 0.26357 -0.48193 -0.37707 -0.43001 -0.95347 23 3PY -0.01877 -0.53787 0.11967 -0.85211 -0.58951 24 3PZ 0.28530 -0.65211 -0.61518 -0.18770 -0.68359 25 4XX 0.01632 -0.05582 -0.02579 0.00566 -0.03676 26 4YY 0.00420 0.00362 0.00317 -0.00430 -0.04766 27 4ZZ -0.01335 0.00812 0.03154 0.02947 0.04722 28 4XY 0.01102 -0.07920 -0.00704 0.05366 0.02336 29 4XZ 0.04880 -0.01561 -0.01364 -0.02234 -0.00312 30 4YZ -0.01850 0.00835 0.03682 -0.01360 0.02778 31 3 H 1S -0.03852 0.00327 0.02546 0.14430 0.07559 32 2S -0.09284 0.40470 0.08318 0.01783 -0.00368 33 4 Br 1S -0.00233 -0.00175 -0.00583 0.00097 -0.00200 34 2S 0.01501 0.01192 0.03668 -0.00699 0.01642 35 3S -0.01707 -0.01546 -0.04043 0.00980 -0.02651 36 4S -0.03744 -0.02498 -0.09270 0.01357 -0.02649 37 5S 0.09514 0.36879 0.84278 -0.32309 0.64893 38 6S -0.01028 -0.69901 -1.63249 0.75850 -1.40591 39 7PX -0.00171 -0.00151 0.01018 -0.00003 0.00690 40 7PY -0.01001 -0.00671 -0.01275 0.00111 -0.00781 41 7PZ -0.00381 0.00423 -0.00025 -0.00210 -0.00096 42 8PX 0.00563 0.00470 -0.03360 0.00026 -0.02280 43 8PY 0.03281 0.02249 0.04226 -0.00379 0.02624 44 8PZ 0.01242 -0.01404 0.00052 0.00716 0.00300 45 9PX -0.02317 0.00051 0.15176 -0.01176 0.10251 46 9PY -0.12325 -0.12220 -0.20925 0.02922 -0.15407 47 9PZ -0.05006 0.06647 0.02198 -0.05045 0.00244 48 10PX 0.03125 -0.09194 -0.31893 0.09604 -0.17121 49 10PY 0.02829 0.28942 0.63674 -0.19978 0.54907 50 10PZ 0.13137 -0.07373 -0.23092 0.27557 -0.10726 51 11XX -0.00279 -0.00212 0.00816 -0.00135 0.00775 52 11YY 0.00245 0.02759 0.03996 0.00264 0.04512 53 11ZZ 0.02218 -0.00589 0.00176 -0.01408 -0.01599 54 11XY 0.00577 -0.01547 -0.02683 0.00824 -0.00933 55 11XZ 0.00822 0.00503 0.02220 -0.00289 0.01292 56 11YZ 0.01198 -0.01343 -0.02129 0.02478 -0.01039 57 12XX 0.05152 0.15466 0.27243 -0.13628 0.26800 58 12YY 0.06671 -0.00559 0.05341 -0.13897 0.00587 59 12ZZ -0.08140 0.21496 0.30061 -0.03428 0.40438 60 12XY -0.02750 0.10079 0.15888 -0.06031 0.04712 61 12XZ -0.04609 -0.03841 -0.13528 0.03176 -0.06918 62 12YZ -0.08551 0.06830 0.15707 -0.16762 0.09126 63 5 C 1S 0.00398 -0.01081 0.01394 0.01139 0.01656 64 2S 0.14143 -0.33590 0.23535 0.34617 0.37223 65 2PX 0.14131 -0.02551 -0.04633 0.00345 -0.12641 66 2PY 0.06736 0.05101 -0.06508 0.06186 -0.14891 67 2PZ -0.49654 -0.15823 -0.04728 0.04107 0.10928 68 3S -0.84734 0.98960 -1.75512 -1.57607 -1.99597 69 3PX -0.48366 -0.21440 0.18520 -0.27552 0.25264 70 3PY -0.68530 -0.46562 0.21019 -0.55709 0.00554 71 3PZ 4.00585 1.74548 0.53935 -0.03741 -0.30010 72 4XX 0.00187 0.03392 0.02482 -0.01059 -0.02720 73 4YY 0.04478 -0.06448 0.01182 0.02108 0.00960 74 4ZZ -0.04142 -0.00847 -0.01093 0.01355 0.03478 75 4XY 0.03327 -0.00752 0.00667 0.01318 0.01041 76 4XZ -0.03281 -0.02635 -0.03781 0.02000 -0.02036 77 4YZ -0.05086 -0.04728 0.00977 -0.00667 0.01483 78 6 C 1S -0.00124 -0.00751 0.00821 -0.01504 -0.00548 79 2S 0.11236 0.05588 0.15030 -0.22552 0.26173 80 2PX -0.08549 -0.01802 0.02032 -0.06825 -0.01687 81 2PY -0.18885 0.01756 -0.04034 -0.02161 -0.08380 82 2PZ -0.53128 -0.10574 -0.19985 -0.03579 -0.06497 83 3S -0.52256 0.02190 -0.65937 0.95527 -0.34484 84 3PX 1.52597 0.29704 0.13416 0.26922 0.05648 85 3PY 2.26467 0.26587 0.38135 0.22720 0.23151 86 3PZ 3.82423 0.98530 1.53214 0.08693 0.40112 87 4XX 0.00207 0.01668 0.01644 -0.00680 0.00219 88 4YY -0.05475 -0.02078 -0.00489 -0.02240 -0.01872 89 4ZZ 0.06589 0.01448 0.02023 -0.00280 0.04292 90 4XY -0.05037 -0.01406 -0.01090 -0.01458 0.00595 91 4XZ 0.00146 -0.01585 0.02344 0.00142 0.02829 92 4YZ 0.00222 0.00992 -0.01884 0.04078 -0.00150 93 7 C 1S -0.01170 -0.00684 0.00020 -0.01171 -0.02209 94 2S -0.38739 -0.36849 0.00134 -0.40804 -0.75459 95 2PX -0.21947 -0.08392 -0.02014 -0.00194 -0.05351 96 2PY -0.31866 -0.06208 -0.15177 0.09718 0.02541 97 2PZ 0.01995 -0.10500 -0.04366 0.02260 -0.03539 98 3S 1.32517 0.76672 -0.06464 1.51578 2.38043 99 3PX 2.00363 0.35310 0.67096 -0.41792 -0.22391 100 3PY 3.32612 0.53486 1.26462 -0.79479 -0.61454 101 3PZ -1.02735 -0.05232 -0.26622 -0.09004 -0.05367 102 4XX 0.02475 0.00880 -0.00199 0.00456 -0.00874 103 4YY 0.02145 -0.00945 0.01891 -0.00986 0.01213 104 4ZZ -0.09952 -0.04521 -0.02788 -0.03524 -0.08699 105 4XY -0.00705 -0.01881 -0.00095 -0.00660 -0.02466 106 4XZ -0.00554 -0.00577 0.01502 -0.03172 -0.01631 107 4YZ 0.02345 0.00732 -0.00531 -0.02412 -0.01127 108 8 C 1S -0.01115 -0.00251 -0.00346 0.02036 0.01747 109 2S -0.37649 -0.11659 -0.01843 0.49397 0.34616 110 2PX 0.00153 -0.02167 0.03059 -0.04044 -0.07825 111 2PY -0.00947 -0.01209 0.02169 -0.04100 -0.11097 112 2PZ 0.14030 -0.07835 0.06004 -0.06485 -0.13513 113 3S 1.83285 0.07300 0.63709 -2.11275 -1.99492 114 3PX 0.21241 0.09477 0.05405 0.04861 0.19657 115 3PY 0.57429 0.15947 0.13331 0.04804 0.32502 116 3PZ -2.36400 -0.19532 -0.99926 0.57062 0.86154 117 4XX -0.01754 -0.00070 0.00040 0.01528 0.02893 118 4YY -0.03589 -0.00473 -0.02921 0.06100 0.04208 119 4ZZ 0.00443 -0.00422 0.01933 -0.00512 -0.01665 120 4XY -0.03892 -0.00135 -0.01567 0.04842 0.04206 121 4XZ -0.01664 0.01195 -0.01817 0.02551 0.01947 122 4YZ -0.02109 0.02288 -0.00914 0.02445 0.05765 123 9 C 1S 0.01054 0.01697 -0.00357 0.00184 0.01308 124 2S 0.38654 0.50592 -0.05516 -0.03801 0.22318 125 2PX 0.06202 0.01000 0.06334 0.00246 -0.01084 126 2PY 0.12489 0.02980 0.04580 0.02672 -0.01891 127 2PZ 0.02320 0.07001 -0.08391 0.13038 0.17074 128 3S -0.98678 -1.97518 0.91565 -0.36857 -1.64920 129 3PX -0.85673 -0.45724 -0.22905 -0.19659 -0.32959 130 3PY -1.42083 -0.69411 -0.23166 -0.34697 -0.49924 131 3PZ -1.18456 -0.84862 0.04766 -0.59579 -0.89823 132 4XX -0.00610 0.00377 0.00977 -0.01562 0.00835 133 4YY 0.02163 0.02662 -0.01253 -0.01315 -0.01788 134 4ZZ 0.03579 0.04407 -0.00838 0.03152 0.04311 135 4XY 0.01591 0.02916 0.00963 -0.01739 -0.00290 136 4XZ 0.00595 -0.02221 0.02383 -0.01744 -0.02476 137 4YZ -0.01151 -0.04680 0.03321 -0.01796 -0.04395 138 10 C 1S 0.01191 0.00592 0.00124 -0.01156 -0.02304 139 2S 0.37299 0.07429 -0.00815 -0.37051 -0.67412 140 2PX 0.13287 0.05936 -0.08430 0.01086 -0.05284 141 2PY 0.20876 0.17749 -0.08551 0.04496 0.01695 142 2PZ -0.18035 -0.17072 -0.07292 0.06072 0.00121 143 3S -1.22125 -0.23247 0.26823 1.17914 2.79766 144 3PX -1.39252 -0.94762 0.30031 -0.17111 -0.20814 145 3PY -2.41510 -1.77514 0.36259 -0.27600 -0.43162 146 3PZ 1.15953 1.07942 0.02927 0.10720 0.19434 147 4XX -0.00039 -0.00356 -0.01431 0.01101 -0.01352 148 4YY 0.02825 0.02347 0.02518 -0.02036 0.00817 149 4ZZ 0.02284 -0.00289 -0.01427 -0.02853 -0.06342 150 4XY 0.04140 0.02116 -0.00372 0.00063 -0.00504 151 4XZ 0.04227 0.03861 -0.00486 -0.01699 -0.03769 152 4YZ 0.04906 0.02221 -0.01514 -0.01589 -0.03839 153 11 H 1S -0.05101 -0.04330 -0.06406 -0.12247 -0.25801 154 2S -0.08924 -0.29758 -0.07304 -0.13925 -0.32107 155 12 H 1S -0.03417 0.06209 -0.07453 0.02323 0.13417 156 2S 0.00581 0.22542 -0.17343 0.07810 0.28924 157 13 H 1S -0.08797 0.02195 -0.04932 0.15715 0.24090 158 2S -0.15453 0.00303 -0.04426 0.31531 0.45559 159 14 H 1S -0.03961 -0.04999 0.04153 -0.19380 -0.23465 160 2S 0.01109 0.00703 0.12902 -0.32984 -0.38222 161 15 H 1S 0.05661 0.05110 0.08570 -0.17892 -0.14431 162 2S 0.71286 0.37355 0.66371 -0.08886 0.40244 163 16 C 1S 0.00922 -0.01494 -0.02927 -0.02516 0.00194 164 2S 0.11138 -0.11027 -0.77268 -0.67920 0.15398 165 2PX 0.01378 -0.05237 0.00980 -0.20624 0.09797 166 2PY -0.05446 0.00585 -0.10756 0.15440 -0.10815 167 2PZ -0.00009 -0.00170 -0.09465 0.11054 -0.06381 168 3S -1.16519 1.90068 3.08014 1.64502 1.06289 169 3PX 0.10974 -0.11634 -0.26028 1.08968 -0.91027 170 3PY 0.14305 0.52473 1.47165 -0.66494 0.17983 171 3PZ 0.00561 0.40647 1.03453 -0.52896 0.18910 172 4XX 0.03243 -0.06991 -0.02885 -0.07973 0.04234 173 4YY -0.01649 0.07832 -0.00966 -0.05191 0.02613 174 4ZZ -0.01454 -0.00515 -0.01845 0.04827 -0.02527 175 4XY -0.01748 -0.02621 0.01256 -0.04133 -0.02175 176 4XZ -0.03417 0.00634 0.05710 -0.05045 0.03918 177 4YZ -0.02778 0.02225 -0.03703 -0.03413 0.01207 178 17 C 1S -0.00571 0.01430 0.01044 0.01363 -0.00680 179 2S -0.39527 0.40687 0.65988 -0.07971 -0.50812 180 2PX 0.06696 0.05739 -0.20079 0.14146 0.17978 181 2PY -0.16720 0.25962 -0.06355 0.12553 0.12193 182 2PZ -0.09344 0.13609 -0.02577 0.01607 0.03126 183 3S 0.31493 -0.10410 -1.53904 -0.85153 1.50765 184 3PX -0.35378 -0.04757 1.13134 -1.34580 -0.25986 185 3PY 1.01596 -0.88515 0.67910 -0.10054 -1.11873 186 3PZ 0.57780 -0.52121 0.25886 0.12645 -0.55933 187 4XX -0.03097 0.05609 0.05381 0.06482 -0.00528 188 4YY -0.03369 0.01382 0.01179 -0.04319 -0.02315 189 4ZZ 0.00817 -0.00471 0.02368 -0.04060 -0.01587 190 4XY 0.00300 0.04669 -0.00926 0.00322 0.02230 191 4XZ -0.00050 0.03303 0.01896 -0.01053 0.03951 192 4YZ -0.02421 0.04916 0.01587 -0.04156 -0.00153 193 18 C 1S 0.00359 -0.02439 0.01205 0.00362 0.00402 194 2S 0.12250 -0.61688 0.29811 0.40617 0.02012 195 2PX 0.05682 -0.09957 0.17059 0.04948 -0.09490 196 2PY -0.01674 0.10503 -0.14925 0.25608 -0.15649 197 2PZ -0.01035 0.06210 -0.07563 0.14742 -0.07027 198 3S -0.28037 2.36543 -1.63992 0.58945 -1.14718 199 3PX -1.08706 1.48755 -1.45503 -0.82014 0.94540 200 3PY 0.20608 -0.24822 0.07490 -0.12116 0.64316 201 3PZ 0.12771 -0.15829 0.08197 -0.11437 0.28720 202 4XX 0.00833 -0.01651 -0.01409 0.06071 -0.05898 203 4YY 0.00993 -0.05782 0.01478 0.01061 0.03843 204 4ZZ 0.00373 -0.01181 0.02559 -0.01661 0.03077 205 4XY -0.00591 0.00355 -0.03952 0.00237 0.02727 206 4XZ 0.00130 0.01368 -0.01362 -0.01512 0.01127 207 4YZ 0.00301 -0.03326 0.00840 0.02897 0.02704 208 19 C 1S 0.00009 0.00279 -0.03374 -0.01672 0.00476 209 2S 0.06947 0.12648 -0.98211 -0.21499 0.08038 210 2PX 0.01332 -0.13982 -0.01774 -0.24039 0.13463 211 2PY 0.09919 -0.15331 -0.00545 0.18727 -0.04715 212 2PZ 0.04847 -0.07525 0.00417 0.09831 -0.02582 213 3S 0.20344 -0.88750 3.73433 2.17682 -1.34630 214 3PX -0.58160 1.41265 -0.38468 1.29237 -0.68532 215 3PY -0.86167 1.41967 -0.12340 -0.31961 -0.12533 216 3PZ -0.42885 0.72618 -0.07400 -0.15921 -0.05090 217 4XX 0.01012 -0.02454 -0.07959 -0.01886 0.00511 218 4YY 0.00082 0.02555 -0.04267 -0.00901 -0.01656 219 4ZZ -0.00366 0.00955 0.00363 -0.00984 0.01839 220 4XY 0.01696 -0.02094 0.06200 0.08270 -0.04014 221 4XZ 0.00564 -0.02076 0.02750 0.05403 -0.02164 222 4YZ -0.00538 0.01533 -0.03233 0.00263 -0.00911 223 20 C 1S -0.00924 0.01675 0.01503 0.00259 -0.01610 224 2S -0.20485 0.50439 0.41153 0.21433 -0.41396 225 2PX -0.11845 0.06868 0.09977 -0.06601 -0.01638 226 2PY -0.00703 0.00739 -0.10281 -0.03795 -0.04712 227 2PZ 0.01017 0.01356 -0.04886 -0.02280 -0.01960 228 3S 1.24135 -2.07539 -1.70517 -0.03476 1.63479 229 3PX 0.40327 -0.66923 -0.18171 -0.66202 0.23250 230 3PY -0.21127 0.39545 0.44729 1.32533 -0.31138 231 3PZ -0.17683 0.21057 0.24395 0.72308 -0.18414 232 4XX -0.04672 0.08884 0.07510 0.00740 -0.04117 233 4YY 0.00764 -0.00607 -0.01155 0.01876 -0.00581 234 4ZZ 0.00875 -0.00677 -0.01283 0.00376 -0.00647 235 4XY -0.01092 0.03490 -0.01464 0.00576 -0.03460 236 4XZ -0.01024 0.00746 -0.01954 0.00779 -0.02445 237 4YZ 0.01181 -0.00041 -0.01399 0.01355 -0.02087 238 21 C 1S 0.00131 -0.01862 0.02196 0.00556 0.00382 239 2S 0.09498 -0.68744 0.58418 -0.07172 0.37194 240 2PX -0.01197 0.08881 -0.08969 0.06351 0.01316 241 2PY 0.01564 -0.10849 -0.04210 0.21245 -0.14931 242 2PZ -0.02156 -0.08479 -0.03822 0.12928 -0.09095 243 3S 0.00571 0.89922 -1.89084 -1.86749 -0.30293 244 3PX -0.18505 -0.02071 1.09558 -0.83633 -0.17503 245 3PY -0.05380 0.39135 -0.13988 -0.27637 0.33467 246 3PZ 0.06279 0.22717 -0.13769 -0.10173 0.17331 247 4XX 0.01523 -0.07826 -0.00221 -0.09804 0.04829 248 4YY 0.00076 -0.03286 0.08927 0.02181 0.01825 249 4ZZ 0.00255 -0.00769 -0.01241 0.05226 -0.02671 250 4XY -0.00025 -0.03252 -0.00652 -0.02455 0.02366 251 4XZ 0.01601 -0.01576 -0.02239 -0.00020 -0.01037 252 4YZ 0.00570 -0.05039 0.04054 0.00583 -0.00313 253 22 H 1S -0.04048 -0.00214 0.14327 0.23913 -0.04559 254 2S 0.06184 -0.46678 0.18056 0.35867 -0.03469 255 23 H 1S -0.10450 0.23888 0.07127 0.05658 -0.12411 256 2S -0.26710 0.39788 0.24932 0.05513 -0.24998 257 24 H 1S -0.04677 0.05973 -0.16037 -0.39908 0.21415 258 2S -0.05317 0.03044 -0.37552 -0.72761 0.30579 259 25 H 1S 0.04162 -0.14121 0.06022 -0.09913 0.22405 260 2S 0.09554 -0.37423 0.25123 -0.16765 0.45242 261 26 H 1S -0.00027 0.25400 0.05540 0.18287 0.14056 262 2S 0.00494 -0.51099 1.25922 -1.03167 -0.97158 263 27 H 1S -0.04001 0.14689 -0.09704 0.05232 -0.26933 264 2S -0.10905 0.31115 0.05213 0.06240 -0.31514 161 162 163 164 165 V V V V V Eigenvalues -- 1.09775 1.11449 1.13380 1.14548 1.15323 1 1 C 1S 0.02044 0.00277 -0.01631 -0.00920 -0.00840 2 2S 0.33925 0.07566 -0.49498 -0.30039 -0.16595 3 2PX 0.24239 -0.03700 -0.14796 -0.12949 -0.13820 4 2PY 0.17456 -0.04553 0.00214 0.15964 -0.10637 5 2PZ 0.03622 -0.02872 0.04775 0.03780 -0.00946 6 3S -0.81231 -0.73129 1.51465 2.00575 0.58644 7 3PX -0.97162 0.18104 1.28681 2.40261 0.99189 8 3PY -0.34741 0.03789 -0.39619 -2.35405 -0.11142 9 3PZ -0.03571 0.12055 -0.30720 -1.50024 -0.05453 10 4XX 0.00801 0.01496 -0.03215 0.01338 -0.01428 11 4YY 0.06761 0.00356 -0.05655 0.03346 -0.01975 12 4ZZ -0.00766 -0.02466 0.03792 -0.05281 0.01232 13 4XY -0.00745 -0.01070 -0.01575 0.13572 -0.02918 14 4XZ 0.02195 0.05439 -0.03593 -0.16242 0.01167 15 4YZ 0.07463 -0.02499 -0.01005 0.04906 -0.01423 16 2 C 1S -0.00321 0.00261 -0.00499 -0.01902 -0.01163 17 2S -0.22825 0.00497 0.07038 0.05428 -0.06124 18 2PX 0.00435 0.09439 0.02477 0.00909 -0.08899 19 2PY 0.05884 -0.10320 -0.13751 -0.06987 -0.06358 20 2PZ 0.14949 -0.09674 0.06603 -0.30202 0.07131 21 3S -0.39863 0.01684 0.36411 -0.70608 -0.07538 22 3PX -0.19027 0.19449 0.28346 1.27088 0.82868 23 3PY 0.01321 0.54823 0.73447 2.80446 0.65348 24 3PZ -0.04763 0.11452 0.19725 1.98900 -0.14710 25 4XX -0.03421 0.01206 0.00015 0.04345 -0.00244 26 4YY -0.00624 0.00859 0.00731 0.05347 -0.04335 27 4ZZ 0.00258 -0.02804 0.00095 -0.14166 0.02032 28 4XY -0.01491 0.05215 0.01241 -0.12583 -0.01699 29 4XZ -0.00914 -0.03211 0.04234 0.14500 -0.02339 30 4YZ 0.00832 -0.00062 0.04678 -0.01940 -0.01324 31 3 H 1S -0.06894 0.01826 -0.10487 -0.53058 -0.01399 32 2S -0.00657 -0.27606 -0.10359 -0.49226 0.13508 33 4 Br 1S 0.00302 -0.00069 -0.00183 -0.00513 0.00093 34 2S -0.01889 0.00335 0.01055 0.03102 -0.00359 35 3S 0.02044 -0.00101 -0.00938 -0.03114 -0.00091 36 4S 0.04906 -0.01484 -0.03170 -0.08560 0.01789 37 5S -0.22061 -0.02089 0.21657 0.54982 0.08969 38 6S 0.28485 0.02928 -0.45690 -0.97488 -0.36892 39 7PX -0.00574 0.00036 0.00440 -0.00576 -0.00076 40 7PY 0.00758 0.00144 -0.00121 -0.01451 0.00202 41 7PZ -0.00010 -0.00244 -0.00148 -0.00032 0.00072 42 8PX 0.01894 -0.00116 -0.01446 0.01937 0.00237 43 8PY -0.02501 -0.00502 0.00390 0.04800 -0.00665 44 8PZ 0.00041 0.00803 0.00477 0.00038 -0.00237 45 9PX -0.08299 0.00287 0.05940 -0.10194 -0.00104 46 9PY 0.10327 0.03557 -0.01719 -0.21069 0.02470 47 9PZ -0.00437 -0.02994 -0.00964 0.04443 0.01492 48 10PX 0.13993 -0.01228 -0.09986 0.18532 -0.08329 49 10PY -0.11607 -0.02823 0.15676 0.34295 0.08311 50 10PZ -0.00191 -0.05785 -0.14605 -0.44831 -0.15189 51 11XX -0.01258 0.00136 0.00326 -0.02947 0.00205 52 11YY -0.00826 -0.01300 -0.00194 0.00891 0.00212 53 11ZZ -0.00429 0.01265 0.00949 0.05788 -0.00040 54 11XY 0.00865 -0.00112 -0.00808 0.02852 -0.00779 55 11XZ -0.01200 0.00634 -0.00139 -0.01955 0.00780 56 11YZ 0.00007 0.00014 -0.01083 -0.03752 -0.01042 57 12XX -0.01047 -0.03215 0.05307 0.35783 0.06756 58 12YY -0.04820 0.03717 0.05395 0.18038 0.04649 59 12ZZ -0.05290 -0.12056 -0.01702 -0.22216 0.05711 60 12XY -0.04802 0.00651 0.04566 -0.14738 0.06256 61 12XZ 0.06586 -0.03639 0.00333 0.09304 -0.05607 62 12YZ 0.00694 0.02005 0.08961 0.25208 0.08361 63 5 C 1S 0.01610 0.02549 0.00243 -0.01115 -0.01998 64 2S 0.28947 0.68257 -0.08907 -0.12646 -0.03290 65 2PX -0.05261 0.04208 0.04923 -0.16407 -0.21854 66 2PY -0.12239 -0.11988 0.06248 -0.30549 -0.27896 67 2PZ -0.02166 -0.26161 0.07810 -0.00779 -0.14640 68 3S -0.40034 -1.81301 -0.65940 1.48653 2.65813 69 3PX 0.35446 0.32080 0.34473 1.77312 0.27856 70 3PY 0.77091 0.70259 0.58462 2.68251 0.39868 71 3PZ -0.53177 1.57015 -0.91469 0.65111 0.28455 72 4XX -0.00512 -0.01457 0.01475 0.00382 -0.01631 73 4YY 0.00378 0.05272 0.03320 0.05432 -0.02667 74 4ZZ 0.03556 0.02194 -0.06042 -0.04905 0.05816 75 4XY 0.02597 0.07117 0.01343 -0.00448 0.00366 76 4XZ -0.01262 -0.01102 -0.01823 0.01307 -0.01719 77 4YZ -0.02922 0.00730 0.02284 0.01435 -0.03191 78 6 C 1S -0.00553 -0.02614 -0.00762 -0.00726 -0.01282 79 2S -0.23671 -0.54339 -0.24310 -0.07617 -0.43621 80 2PX 0.02290 -0.03155 0.01743 -0.22502 -0.00865 81 2PY 0.06877 -0.05840 0.14102 -0.30532 0.02529 82 2PZ 0.04792 -0.04995 -0.14330 0.11869 0.05831 83 3S 0.87289 2.88070 -0.33118 0.85592 1.30240 84 3PX -0.60719 0.14828 -0.32849 0.36512 -0.31829 85 3PY -1.02433 0.10653 -0.80196 0.46908 -0.44726 86 3PZ -0.48985 0.69140 0.79754 0.24907 -1.72662 87 4XX -0.02014 -0.01149 0.00920 0.00852 0.01282 88 4YY -0.00991 -0.07700 -0.01611 -0.00423 -0.04174 89 4ZZ 0.01200 0.02973 -0.01454 -0.01425 -0.02456 90 4XY -0.01843 -0.03999 -0.03193 -0.02337 -0.02611 91 4XZ 0.00073 0.02196 -0.02077 0.00461 0.01109 92 4YZ -0.00619 0.03405 -0.06129 0.00403 0.03799 93 7 C 1S 0.00586 -0.00398 -0.00658 -0.01164 0.01660 94 2S -0.04073 -0.20496 -0.31937 -0.27084 0.39276 95 2PX 0.01994 -0.02522 -0.02331 -0.02359 -0.04489 96 2PY -0.01700 0.01517 0.00869 -0.04840 -0.01099 97 2PZ -0.23212 -0.16319 -0.11916 0.05527 -0.20756 98 3S -1.33741 -0.34853 0.10622 0.96703 -2.48676 99 3PX -0.35153 -0.14615 0.13909 -0.11353 -0.15652 100 3PY -0.48513 -0.33178 0.25376 -0.13509 -0.48171 101 3PZ 0.71819 0.36096 -0.06059 -0.12026 1.57787 102 4XX 0.00267 0.00095 0.00148 0.02378 0.00001 103 4YY -0.04881 -0.02433 -0.02594 0.01319 -0.02750 104 4ZZ 0.03583 0.00001 -0.00623 -0.06668 0.08843 105 4XY -0.03010 -0.05206 -0.04377 0.00007 -0.03380 106 4XZ 0.01720 -0.02076 -0.00842 0.00547 0.03961 107 4YZ -0.00138 -0.00676 -0.02711 0.01041 0.06698 108 8 C 1S 0.01192 0.01727 0.00895 -0.00106 -0.01726 109 2S 0.30130 0.39314 0.39093 0.01308 -0.82076 110 2PX -0.05323 -0.09550 0.06105 -0.05827 -0.16756 111 2PY -0.09772 -0.14291 0.11365 -0.08863 -0.26464 112 2PZ -0.00106 0.01081 0.00293 -0.01090 -0.08244 113 3S -1.72632 -2.07567 -0.45082 -0.50025 0.46992 114 3PX 0.32594 0.45119 -0.02286 0.29035 0.25339 115 3PY 0.52939 0.75709 -0.04876 0.42644 0.47542 116 3PZ -0.57055 -0.54660 -0.43524 0.47449 -0.19597 117 4XX 0.01987 0.02560 0.00083 0.03302 0.02620 118 4YY 0.03655 0.06534 0.00567 0.00831 -0.02650 119 4ZZ -0.02227 -0.03902 0.04032 -0.03678 -0.08717 120 4XY 0.02774 0.02780 0.02182 -0.01418 -0.04549 121 4XZ 0.01497 -0.00205 0.00275 0.00649 0.00525 122 4YZ 0.01861 0.02161 0.01956 0.00232 0.02098 123 9 C 1S -0.01624 -0.02349 -0.00876 -0.00702 0.00944 124 2S -0.43318 -0.68735 -0.09916 -0.27840 0.37340 125 2PX 0.03403 -0.00948 0.07179 -0.07647 -0.01399 126 2PY 0.03681 -0.00781 0.12539 -0.13104 -0.00603 127 2PZ -0.05671 -0.01127 -0.15147 0.10589 -0.03090 128 3S 1.88577 2.29367 1.50473 -0.56413 -0.96068 129 3PX -0.39194 -0.34862 -0.25699 0.04440 -0.04140 130 3PY -0.57043 -0.54469 -0.39863 0.10648 -0.05639 131 3PZ -0.19882 -0.28194 0.78725 -0.32804 -1.01718 132 4XX -0.00441 0.00281 0.00448 0.02394 0.01236 133 4YY -0.01274 -0.02025 -0.02180 -0.02581 0.06196 134 4ZZ -0.04170 -0.06356 0.00167 -0.03314 -0.02007 135 4XY -0.00653 -0.02205 0.01201 -0.04848 0.04666 136 4XZ 0.02318 0.03658 0.03842 -0.02501 -0.02398 137 4YZ 0.04539 0.03929 0.05336 -0.01161 -0.03645 138 10 C 1S 0.00453 0.00583 -0.00335 -0.00897 0.00321 139 2S 0.36512 0.42915 0.05852 -0.13970 0.04525 140 2PX -0.04435 -0.07017 -0.07902 -0.02676 -0.05955 141 2PY -0.07147 -0.11719 -0.06106 -0.00757 -0.07869 142 2PZ -0.19233 -0.11800 -0.10677 -0.02114 -0.21024 143 3S 0.28937 -0.74479 0.69800 1.13688 0.15738 144 3PX 0.28776 0.10863 0.71182 -0.28810 -0.20270 145 3PY 0.40943 0.09214 1.07173 -0.44157 -0.41998 146 3PZ 0.25383 0.05043 -0.30840 -0.92496 1.79761 147 4XX -0.00658 -0.02150 -0.01278 -0.00118 0.00901 148 4YY 0.02465 0.01242 0.03256 -0.03302 0.02907 149 4ZZ 0.02435 0.05205 -0.00671 0.04171 -0.05010 150 4XY 0.03184 0.01589 0.00210 -0.03258 0.02779 151 4XZ -0.01758 -0.00195 -0.00103 -0.03140 -0.01024 152 4YZ -0.04100 -0.02895 -0.00428 -0.00664 -0.02195 153 11 H 1S -0.07239 -0.02584 -0.05459 0.19403 -0.42053 154 2S -0.14297 0.11732 -0.06944 0.23170 -0.63034 155 12 H 1S -0.20681 -0.23776 -0.31577 0.11801 0.28581 156 2S -0.36118 -0.37972 -0.50576 0.19966 0.35438 157 13 H 1S 0.24540 0.32800 0.02670 0.21443 -0.00740 158 2S 0.36932 0.55450 0.00724 0.32455 0.08564 159 14 H 1S 0.17396 0.07017 -0.03462 -0.07920 0.54665 160 2S 0.33937 0.17393 -0.01610 -0.16679 0.80515 161 15 H 1S 0.14032 -0.09916 0.28836 -0.01903 -0.31551 162 2S -0.03708 -0.18481 0.48336 -0.26847 -0.52136 163 16 C 1S 0.00406 0.00488 0.00999 0.00409 -0.00296 164 2S -0.00012 0.19391 -0.13967 -0.14190 -0.10118 165 2PX -0.04305 0.26673 -0.06185 -0.09616 -0.19088 166 2PY 0.04170 -0.13886 0.16364 0.08980 0.01713 167 2PZ 0.02433 -0.05030 0.08203 0.10196 0.02802 168 3S -0.85300 0.10956 -1.47113 -1.38322 -0.11839 169 3PX -0.70525 -0.26495 0.19136 1.97243 1.18797 170 3PY -0.06363 0.71705 -0.88079 -1.98218 -0.13901 171 3PZ -0.06052 0.23760 -0.44361 -1.19890 -0.18039 172 4XX 0.01550 0.01802 -0.01399 -0.02468 -0.01287 173 4YY -0.04448 0.00358 -0.00981 0.10664 -0.02239 174 4ZZ 0.01619 0.01293 -0.00215 -0.12089 0.02124 175 4XY -0.02717 0.02722 -0.02064 0.04228 0.00111 176 4XZ -0.02296 -0.02833 0.03998 0.03457 -0.00125 177 4YZ -0.00314 0.04584 -0.02640 -0.08752 0.00127 178 17 C 1S -0.00349 0.00823 0.00917 0.00978 -0.00073 179 2S -0.18847 0.21216 0.30661 0.16725 -0.03948 180 2PX -0.37042 0.36498 0.15168 -0.10961 0.06109 181 2PY -0.14151 -0.02196 0.04416 0.12575 0.06413 182 2PZ -0.07465 -0.08974 0.01834 0.03544 -0.01404 183 3S -0.67257 -0.13848 -0.81777 -0.92541 0.19705 184 3PX 1.68324 -1.35403 -0.19930 -0.30861 -0.75468 185 3PY 0.75973 0.23279 0.24803 -0.95940 0.03829 186 3PZ 0.39477 0.34818 0.12019 -0.47670 0.15307 187 4XX 0.01633 -0.00454 0.05957 0.04345 0.00215 188 4YY -0.02392 0.04224 0.00017 -0.07589 0.01287 189 4ZZ -0.00233 -0.01996 -0.01938 0.05381 -0.02336 190 4XY 0.05296 -0.00789 0.00609 -0.00751 -0.00247 191 4XZ 0.01354 -0.01321 0.02013 0.01403 -0.00427 192 4YZ -0.05604 0.01225 0.01714 0.07868 -0.00400 193 18 C 1S -0.00014 -0.01002 -0.01394 0.00644 0.00018 194 2S -0.16980 -0.19151 -0.45684 0.10978 0.05853 195 2PX -0.01438 0.11428 0.00849 -0.07217 -0.01804 196 2PY -0.19628 0.03873 0.08452 0.00907 0.07765 197 2PZ -0.10112 0.03621 0.04437 0.01731 0.05465 198 3S -0.82881 1.43480 1.87728 -0.25078 0.43905 199 3PX -0.99372 -0.08571 -0.06578 0.38274 -0.10953 200 3PY 0.48492 0.08812 -0.86124 -0.02993 -0.12328 201 3PZ 0.27307 -0.04901 -0.44977 -0.04227 -0.12167 202 4XX -0.04048 0.00250 0.02824 0.00740 0.02221 203 4YY 0.00486 -0.02576 -0.06840 0.02383 -0.00580 204 4ZZ 0.01638 0.00349 -0.01622 -0.01541 -0.00895 205 4XY 0.04075 -0.04869 -0.00589 -0.01421 0.01214 206 4XZ 0.01283 -0.04437 -0.00935 0.05985 -0.01346 207 4YZ -0.02339 -0.01248 -0.03027 0.03436 0.01241 208 19 C 1S -0.00139 -0.00475 0.02039 0.00426 0.00461 209 2S 0.10778 -0.26477 0.71063 0.04692 0.16337 210 2PX -0.12394 0.13827 -0.08169 -0.02133 -0.02542 211 2PY 0.06475 -0.10881 0.06636 0.01645 0.06612 212 2PZ 0.03518 -0.07170 0.04199 0.00874 0.03221 213 3S 0.65425 -0.23673 -1.43524 -0.21003 -0.24642 214 3PX -0.35757 -0.11673 -0.02354 0.12517 0.08515 215 3PY -0.92406 0.54379 0.40051 -0.05100 -0.13476 216 3PZ -0.48580 0.35578 0.19581 -0.01944 -0.04673 217 4XX -0.02334 -0.02731 0.07040 0.01860 0.02919 218 4YY 0.02652 -0.02124 0.02143 0.03438 -0.00647 219 4ZZ 0.00641 0.02068 -0.01144 -0.04597 -0.00759 220 4XY 0.02272 -0.02745 -0.02228 0.00587 -0.00127 221 4XZ 0.02352 -0.00103 -0.01464 -0.04288 0.01016 222 4YZ 0.02415 -0.03233 0.04878 0.01027 0.01887 223 20 C 1S -0.00444 0.01039 -0.01286 0.00700 -0.00364 224 2S 0.15719 0.15281 -0.55045 0.13840 -0.17858 225 2PX -0.31637 0.20341 0.07057 -0.04682 0.02607 226 2PY -0.12334 0.10851 0.04402 0.02498 0.01242 227 2PZ -0.06620 0.05474 0.02336 0.02935 0.00702 228 3S 1.58602 -1.89772 1.08698 -0.23669 0.32873 229 3PX 0.87385 -0.62939 0.47938 0.26854 0.11694 230 3PY 0.42268 -0.85683 0.35076 -0.09967 0.07411 231 3PZ 0.22610 -0.48929 0.19812 -0.11394 0.02180 232 4XX -0.02896 0.04573 -0.08232 0.02069 -0.01725 233 4YY 0.05030 -0.03238 0.01095 -0.02023 0.00537 234 4ZZ -0.00896 0.01014 0.00258 0.01313 -0.00895 235 4XY -0.05981 0.04579 0.00455 0.02506 0.00418 236 4XZ -0.02444 0.02607 0.00695 -0.01698 0.00671 237 4YZ 0.04514 -0.03484 -0.01776 0.04533 -0.00405 238 21 C 1S -0.00446 -0.01222 0.00621 0.00747 0.01124 239 2S -0.02264 -0.37434 0.27791 0.13271 0.23651 240 2PX 0.07828 -0.03412 -0.00688 -0.09451 -0.03525 241 2PY -0.24486 0.03399 0.12883 0.09586 0.11296 242 2PZ -0.11982 0.02851 0.06936 0.01631 0.06620 243 3S 0.75514 1.22421 -0.54885 -0.43898 -1.28438 244 3PX -1.32686 1.13772 -0.56348 0.47664 0.39610 245 3PY 0.83424 -0.17942 -0.92512 0.24822 -0.44779 246 3PZ 0.46620 -0.07528 -0.52256 0.21005 -0.23256 247 4XX 0.02262 -0.00453 0.00851 0.03125 -0.01326 248 4YY -0.03688 -0.04533 0.05338 0.02403 0.03474 249 4ZZ -0.00593 0.01584 -0.00949 -0.03848 0.00976 250 4XY -0.02759 0.00870 0.04456 -0.03750 0.00469 251 4XZ -0.02284 0.02557 -0.00583 0.03219 -0.00347 252 4YZ -0.00711 -0.01872 0.02583 0.00515 0.03646 253 22 H 1S -0.18875 -0.10280 0.33067 -0.05397 0.18302 254 2S -0.39601 -0.16716 0.54881 -0.11285 0.32310 255 23 H 1S -0.29043 0.35542 -0.29497 -0.06823 -0.08936 256 2S -0.54053 0.59184 -0.35865 -0.07545 -0.11949 257 24 H 1S -0.11995 0.12237 0.24233 -0.03471 -0.00239 258 2S -0.19129 0.23573 0.29184 -0.08665 -0.04596 259 25 H 1S 0.14816 -0.06940 -0.45144 -0.03903 -0.09267 260 2S 0.26429 -0.12000 -0.60144 0.00231 -0.12020 261 26 H 1S 0.29758 -0.14739 0.30108 -0.00274 0.00138 262 2S 1.04063 -0.52262 -0.29411 -0.32790 -0.53721 263 27 H 1S 0.11041 -0.00894 -0.03633 0.30762 -0.06004 264 2S 0.32020 0.06600 -0.21167 0.38426 -0.20382 166 167 168 169 170 V V V V V Eigenvalues -- 1.18239 1.19935 1.20480 1.23219 1.25056 1 1 C 1S -0.00478 -0.00881 -0.00502 -0.03343 -0.01153 2 2S -0.25625 -0.16266 -0.12950 -0.56459 -0.14223 3 2PX 0.12660 0.02458 0.01153 -0.03795 -0.14743 4 2PY -0.07237 -0.03062 0.00525 -0.11834 -0.18875 5 2PZ 0.07807 0.01926 0.04454 0.02086 -0.01757 6 3S -0.76084 0.76086 0.61321 3.17289 0.29070 7 3PX -2.34254 -0.19906 0.33431 1.34480 0.56543 8 3PY 0.79606 -0.65637 -0.41356 -0.51574 0.71287 9 3PZ 0.40637 -0.32884 -0.40130 -0.46587 0.29093 10 4XX -0.06420 -0.02685 -0.00416 -0.03569 0.01484 11 4YY 0.02722 -0.00412 -0.04351 -0.01104 -0.01623 12 4ZZ -0.00175 0.01371 0.03851 0.00115 -0.02360 13 4XY -0.03423 0.02529 0.01836 -0.07690 -0.04449 14 4XZ 0.09260 -0.01390 -0.01691 -0.03025 0.03281 15 4YZ -0.05357 0.01648 0.03413 -0.03026 -0.03461 16 2 C 1S 0.00042 -0.00938 -0.01190 -0.01011 0.00265 17 2S 0.00034 -0.13230 -0.08509 -0.29318 -0.08519 18 2PX -0.06088 -0.08226 0.00010 -0.08307 -0.08187 19 2PY 0.15373 -0.06231 0.01027 0.03562 0.15857 20 2PZ -0.12413 0.07488 -0.14159 0.02476 0.14076 21 3S -1.16025 -0.05188 0.14054 0.14345 -1.00515 22 3PX -0.54596 0.00461 0.08982 0.50109 0.90646 23 3PY -0.38426 0.72389 0.50684 0.50294 0.06366 24 3PZ -1.03366 -0.16896 0.43260 -0.13251 -0.53396 25 4XX -0.04930 -0.02126 0.00120 -0.04691 0.01074 26 4YY 0.05908 0.01948 0.02171 0.00141 -0.07155 27 4ZZ -0.01084 -0.02248 -0.04593 0.00517 0.03880 28 4XY 0.01383 -0.04363 -0.03437 -0.02623 -0.05446 29 4XZ -0.15251 0.01578 0.03276 -0.05187 -0.05061 30 4YZ -0.03563 0.03590 -0.01832 0.00460 -0.02818 31 3 H 1S 0.20349 -0.08944 -0.12658 0.01277 0.14339 32 2S 0.25562 0.00195 -0.18346 0.00272 0.44726 33 4 Br 1S -0.00320 -0.00032 -0.00219 0.00549 -0.00078 34 2S 0.01916 0.00105 0.01205 -0.02550 0.00707 35 3S -0.01883 0.00130 -0.00933 0.00703 -0.01242 36 4S -0.05398 -0.00791 -0.03863 0.10809 -0.01007 37 5S 0.36295 0.14272 0.19000 0.21359 0.20574 38 6S -0.64227 -0.43403 -0.28880 -0.97918 -0.43285 39 7PX -0.00041 -0.00233 -0.00118 0.00281 0.00023 40 7PY -0.00614 0.00257 -0.00408 0.00398 -0.00201 41 7PZ -0.00032 -0.00120 -0.00089 -0.00043 0.00468 42 8PX 0.00074 0.00758 0.00383 -0.00964 -0.00105 43 8PY 0.02045 -0.00857 0.01351 -0.01277 0.00688 44 8PZ 0.00080 0.00386 0.00265 0.00125 -0.01538 45 9PX 0.03401 -0.02289 -0.01248 0.06362 0.02259 46 9PY -0.10066 0.03437 -0.06128 0.02973 -0.04501 47 9PZ 0.01084 -0.00315 0.00763 0.00845 0.06012 48 10PX -0.21608 -0.03650 -0.00342 -0.21094 -0.15057 49 10PY 0.28062 0.14884 0.11357 0.14782 0.14201 50 10PZ -0.06967 -0.21211 -0.12946 -0.15398 -0.05595 51 11XX 0.01131 -0.00915 -0.00395 0.00888 0.01324 52 11YY 0.01385 -0.00365 -0.00032 -0.00503 0.01677 53 11ZZ -0.00273 0.01055 0.01400 -0.00456 -0.01220 54 11XY -0.03268 -0.00823 0.00065 -0.02392 -0.01043 55 11XZ 0.02834 -0.00198 -0.00069 0.01317 0.01489 56 11YZ -0.00906 -0.01429 -0.01278 -0.01355 -0.00646 57 12XX 0.03763 0.08746 0.06077 0.21626 0.03397 58 12YY 0.02260 0.02455 0.04989 0.26226 0.00660 59 12ZZ 0.14400 -0.05279 -0.06123 0.27414 0.19457 60 12XY 0.20330 0.06379 0.00293 0.15113 0.07890 61 12XZ -0.16898 -0.00099 -0.00136 -0.08447 -0.09881 62 12YZ 0.06120 0.12568 0.08757 0.10403 0.02476 63 5 C 1S -0.00178 -0.02769 -0.00834 -0.01145 -0.02324 64 2S -0.01631 -0.58666 -0.18177 -0.36276 -0.68763 65 2PX 0.01400 -0.05392 -0.02893 -0.04891 -0.12674 66 2PY 0.12514 0.24428 0.05287 0.00912 -0.19715 67 2PZ -0.37671 -0.03653 -0.07204 -0.11192 -0.08225 68 3S -0.48015 0.98957 0.52903 1.10102 2.15053 69 3PX -0.47943 0.23760 0.19013 0.26715 0.60733 70 3PY -1.17812 -0.47906 -0.03046 0.27751 1.18197 71 3PZ 4.22957 0.22915 0.81412 1.04951 0.72974 72 4XX 0.05896 0.03394 0.00425 0.10269 -0.00432 73 4YY -0.06408 0.02845 0.01862 -0.13699 -0.06011 74 4ZZ 0.00116 -0.10547 -0.03156 0.01113 0.00824 75 4XY 0.00789 -0.03329 -0.02518 0.03924 -0.07348 76 4XZ 0.00421 0.05218 0.03456 -0.20727 0.14301 77 4YZ -0.01103 -0.04194 -0.02211 0.12175 -0.11759 78 6 C 1S -0.02867 -0.03725 -0.01173 -0.00010 0.02194 79 2S -0.47622 -0.80637 -0.23245 0.15709 0.68191 80 2PX -0.10113 -0.02694 -0.05379 0.00607 0.03617 81 2PY -0.13685 0.20229 -0.04129 -0.01045 -0.10477 82 2PZ 0.08109 -0.08403 0.00239 0.04290 0.07958 83 3S 3.94590 1.46161 0.87395 0.33116 -0.71163 84 3PX 0.97496 -0.04352 0.26037 -0.03610 -0.55503 85 3PY 1.43396 -0.52676 0.34117 -0.05623 -0.65081 86 3PZ 1.10810 0.12334 0.28107 0.22308 0.14112 87 4XX 0.01160 -0.00335 -0.01225 0.16557 -0.09701 88 4YY -0.03749 0.00246 0.01187 -0.15617 0.11007 89 4ZZ -0.01956 -0.06853 -0.02355 0.01208 0.06358 90 4XY -0.01171 -0.07701 -0.03132 0.09570 0.00640 91 4XZ 0.02997 -0.07732 -0.01601 0.11487 -0.11619 92 4YZ 0.12105 -0.00290 0.02541 -0.08490 0.06215 93 7 C 1S 0.01093 0.00304 0.00079 -0.00239 -0.00074 94 2S 0.39992 -0.11439 0.02962 -0.11938 -0.18950 95 2PX 0.02791 -0.06265 -0.00954 0.00077 -0.00021 96 2PY 0.04956 0.08613 0.02140 0.01726 -0.03333 97 2PZ 0.16064 -0.14091 0.02623 -0.04010 -0.07357 98 3S -0.21556 -0.64549 0.04208 -0.09457 -0.64578 99 3PX -0.11786 0.04936 0.04380 -0.04049 -0.18191 100 3PY -0.12206 -0.11229 0.04255 -0.10765 -0.27974 101 3PZ -0.77358 0.37853 -0.15373 -0.27761 -0.82139 102 4XX 0.00793 0.04354 0.02870 -0.17289 0.13339 103 4YY 0.02640 -0.08819 -0.02197 0.17788 -0.11553 104 4ZZ 0.00164 0.06411 0.00179 -0.01914 -0.05918 105 4XY 0.02854 -0.02710 0.01450 -0.12944 0.06190 106 4XZ -0.02297 -0.01378 -0.00757 0.04129 -0.05961 107 4YZ -0.02044 -0.00164 -0.00156 -0.00881 0.05418 108 8 C 1S 0.00171 0.00329 0.00019 -0.00101 -0.00896 109 2S 0.04652 0.13789 0.02620 0.04037 -0.09334 110 2PX -0.01154 0.03396 0.00285 -0.01751 -0.04942 111 2PY -0.01505 0.09961 0.01036 -0.02232 -0.08785 112 2PZ 0.05251 0.01728 0.01963 0.01276 -0.02475 113 3S -0.09840 0.08269 0.00837 0.07704 0.61607 114 3PX 0.07344 -0.15351 0.00051 0.34950 0.90839 115 3PY 0.09994 -0.19983 0.03069 0.58465 1.49474 116 3PZ -0.04201 -0.33382 -0.08462 0.07169 0.39514 117 4XX 0.00663 0.00211 0.00447 0.02989 -0.02174 118 4YY 0.02713 0.00470 0.00678 -0.02150 0.06950 119 4ZZ -0.02424 0.02230 -0.00459 0.00427 -0.04252 120 4XY 0.01691 0.02668 0.00526 0.04159 -0.03352 121 4XZ -0.02113 0.06135 0.02769 -0.19490 0.15411 122 4YZ -0.04340 -0.01376 -0.02289 0.12352 -0.06966 123 9 C 1S -0.01100 -0.00296 -0.00163 -0.00170 -0.00004 124 2S -0.48376 0.04175 -0.07682 -0.14285 -0.19515 125 2PX -0.06451 0.03895 -0.01261 -0.01710 -0.01042 126 2PY -0.11298 0.12730 -0.01002 -0.01293 -0.04800 127 2PZ 0.13542 -0.16525 0.01944 0.00740 0.04468 128 3S 0.47512 0.94050 -0.03306 -0.06965 -0.55894 129 3PX 0.18136 -0.15750 -0.03177 -0.20848 -0.35812 130 3PY 0.35831 -0.40084 -0.08670 -0.41255 -0.62738 131 3PZ -0.47308 0.93067 -0.05079 0.35220 0.53140 132 4XX 0.01115 -0.03426 -0.01692 0.13644 -0.10474 133 4YY -0.01108 0.03092 0.01230 -0.11592 0.13179 134 4ZZ -0.03765 0.01800 -0.00012 -0.03846 -0.06060 135 4XY -0.01375 0.02045 -0.01307 0.06702 -0.08946 136 4XZ -0.02062 -0.02995 -0.03271 0.15125 -0.08193 137 4YZ -0.02142 0.06086 0.01031 -0.08375 0.07845 138 10 C 1S 0.02657 0.00894 0.00522 0.00850 0.01229 139 2S 0.44191 0.17020 0.10851 0.27279 0.41832 140 2PX 0.01999 -0.06990 0.01678 0.00462 -0.04906 141 2PY 0.05010 -0.02266 0.04885 -0.04273 -0.11535 142 2PZ 0.16631 -0.02448 0.02634 -0.02502 -0.12798 143 3S -3.91777 -0.90104 -0.67150 -0.91314 -0.59127 144 3PX -0.90272 0.20360 -0.31847 -0.33076 -0.30128 145 3PY -1.52849 0.45019 -0.45818 -0.46577 -0.50096 146 3PZ 0.05523 -0.00507 -0.10286 -0.27626 -0.27032 147 4XX -0.00984 0.03960 0.02573 -0.18156 0.14974 148 4YY -0.03128 -0.03667 -0.03622 0.18273 -0.13129 149 4ZZ 0.08656 0.02696 0.03163 0.02666 0.02062 150 4XY -0.03034 0.03742 0.01389 -0.10134 0.11858 151 4XZ 0.05272 -0.01314 -0.01186 0.11396 0.00040 152 4YZ 0.04766 0.06800 0.03244 -0.02695 0.01069 153 11 H 1S 0.32920 0.01177 0.09214 0.18135 0.23144 154 2S 0.57281 0.04442 0.16247 0.26899 0.19831 155 12 H 1S 0.05527 -0.32302 -0.02265 -0.16427 -0.19623 156 2S 0.12079 -0.51514 -0.02720 -0.22897 -0.27394 157 13 H 1S 0.03225 -0.09903 -0.00030 0.17347 0.42501 158 2S 0.06065 -0.16434 -0.00395 0.25104 0.63091 159 14 H 1S -0.13111 0.10036 -0.02818 -0.08293 -0.19471 160 2S -0.20140 0.18172 -0.04578 -0.09904 -0.26120 161 15 H 1S -0.37093 -0.01427 -0.06213 0.05194 0.25855 162 2S -0.43645 -0.05767 -0.13461 0.07659 0.39608 163 16 C 1S -0.01568 -0.01379 -0.00148 0.01839 0.00541 164 2S -0.28523 -0.04631 -0.02559 0.44024 0.19764 165 2PX -0.09752 -0.08564 -0.02159 -0.28705 -0.21180 166 2PY -0.14635 -0.10791 0.01354 0.13351 -0.01072 167 2PZ -0.05950 -0.03757 0.00944 0.07744 -0.03368 168 3S 1.72831 1.93615 0.14234 -1.87515 -0.74309 169 3PX -0.46371 1.53568 0.48240 2.18318 0.67209 170 3PY 2.04990 -0.28890 -0.59604 -1.58008 0.61104 171 3PZ 1.07466 -0.25335 -0.30270 -0.89820 0.43663 172 4XX -0.04364 -0.03464 -0.00451 0.01272 0.00622 173 4YY 0.00258 0.07909 -0.14206 -0.00169 -0.02646 174 4ZZ 0.03662 -0.04023 0.14303 0.00445 0.02583 175 4XY 0.00853 0.03041 -0.11813 0.00475 0.00978 176 4XZ -0.07680 -0.02132 0.24584 0.00443 -0.01972 177 4YZ -0.01429 -0.02871 0.11956 0.03005 0.03932 178 17 C 1S -0.00615 -0.01874 -0.00015 -0.00405 -0.00826 179 2S 0.09900 -0.69274 -0.06428 -0.21556 -0.12432 180 2PX -0.01165 0.14956 0.00090 -0.11590 -0.08481 181 2PY 0.11857 0.40458 0.10688 0.04345 -0.12205 182 2PZ 0.00984 0.17668 0.02372 0.03177 0.01355 183 3S 1.04598 2.67851 0.10028 -0.19570 0.66140 184 3PX 0.45611 -1.70332 -0.38769 -1.03455 0.21450 185 3PY 0.22945 -2.51485 -0.74189 -0.28973 0.99370 186 3PZ 0.24054 -1.22478 -0.36162 -0.13846 0.37680 187 4XX -0.00190 -0.05146 0.00659 -0.03221 -0.04507 188 4YY 0.00818 -0.05821 0.19301 0.01535 0.02490 189 4ZZ 0.01128 0.04451 -0.20670 -0.01389 0.00250 190 4XY 0.05655 0.03339 -0.05763 -0.00884 -0.01784 191 4XZ 0.00686 0.00498 0.11740 -0.00562 -0.04037 192 4YZ 0.01121 0.04212 -0.14050 -0.00305 -0.00084 193 18 C 1S -0.00623 0.01584 0.00290 0.00311 0.00365 194 2S -0.18947 0.56118 0.09136 0.20107 0.13291 195 2PX -0.03999 -0.12722 -0.03741 -0.06295 0.00655 196 2PY -0.06475 0.01712 0.00022 0.07744 0.06727 197 2PZ -0.01798 0.02232 0.00320 0.04350 0.01774 198 3S -0.11415 -1.70703 -0.28024 0.51016 -0.02863 199 3PX 0.04702 1.78328 0.42115 0.21809 -0.37425 200 3PY -0.03127 1.02118 0.25751 0.52780 -0.33989 201 3PZ -0.09720 0.46261 0.11430 0.28223 -0.09571 202 4XX -0.02839 -0.02181 -0.01749 0.03106 0.03422 203 4YY -0.01575 0.09391 -0.01222 0.02831 0.00026 204 4ZZ 0.02370 0.00438 0.04467 -0.02972 -0.03201 205 4XY 0.00826 0.03072 0.15738 0.03339 -0.00788 206 4XZ 0.02735 0.08505 -0.25465 -0.00037 0.01480 207 4YZ -0.02694 0.07051 0.04298 0.04801 -0.00345 208 19 C 1S 0.00220 -0.00230 0.00050 0.00850 0.00187 209 2S 0.20083 -0.22456 -0.03299 0.10642 0.05119 210 2PX 0.01441 0.09785 0.01796 -0.04869 -0.03566 211 2PY 0.02537 -0.01123 0.00156 0.06490 0.04052 212 2PZ 0.00777 -0.01017 0.00066 0.03498 0.02695 213 3S -0.25973 -0.82490 -0.21608 -0.58299 0.23230 214 3PX -0.50583 0.56880 0.14551 0.89663 0.11052 215 3PY 0.15072 -0.23670 -0.04905 -0.63224 -0.22703 216 3PZ 0.14354 -0.12295 -0.03432 -0.36011 -0.16004 217 4XX 0.01225 -0.00218 0.00826 0.02023 0.02423 218 4YY 0.01621 -0.00268 -0.19075 -0.00306 0.01370 219 4ZZ -0.00650 -0.02665 0.17720 -0.01916 -0.03383 220 4XY 0.00196 0.01327 -0.09065 0.00836 0.01450 221 4XZ -0.01751 -0.03719 0.16882 0.01374 -0.00520 222 4YZ -0.02147 -0.06090 0.14203 0.03586 0.00597 223 20 C 1S -0.01585 -0.00920 0.00008 0.00312 0.00352 224 2S -0.42463 -0.12495 0.02317 0.11817 0.00072 225 2PX -0.00813 0.01595 -0.01217 -0.04218 0.03908 226 2PY -0.07791 -0.04468 -0.01131 -0.00178 0.01428 227 2PZ -0.04066 -0.02411 0.00413 0.00210 0.00626 228 3S 1.51067 1.09702 0.14261 0.31409 -0.50731 229 3PX 0.43663 -0.89703 -0.08047 -0.33435 0.08515 230 3PY 0.66324 -0.01893 0.00285 -0.12305 -0.21005 231 3PZ 0.30028 -0.00706 -0.01036 -0.06771 -0.08768 232 4XX -0.05831 0.02354 0.01086 0.02568 0.01478 233 4YY -0.03283 -0.05993 0.22243 0.02671 -0.01335 234 4ZZ 0.04516 0.03638 -0.22969 -0.03677 -0.00398 235 4XY -0.04558 -0.00792 -0.04782 0.02601 0.01961 236 4XZ -0.04982 -0.03087 0.06978 0.01722 0.01758 237 4YZ 0.00097 0.02008 -0.15969 0.02918 0.01810 238 21 C 1S 0.01211 0.01293 0.00156 0.00185 0.00434 239 2S 0.38619 0.23518 0.03313 -0.08315 0.05451 240 2PX 0.17332 0.03823 -0.00948 -0.07934 -0.08739 241 2PY -0.11194 -0.00898 0.01006 0.15073 0.10396 242 2PZ -0.07658 -0.00802 -0.00243 0.07901 0.05628 243 3S -1.79464 -2.25605 -0.27336 -0.53890 -0.37535 244 3PX -0.61201 0.33411 0.03763 0.24193 0.75370 245 3PY -0.38168 0.75168 0.20143 0.26014 -0.54967 246 3PZ -0.12399 0.42977 0.10825 0.14878 -0.34998 247 4XX -0.02853 -0.01600 -0.00698 0.00361 -0.00728 248 4YY 0.03247 0.00976 -0.00357 0.00200 0.03043 249 4ZZ 0.02197 0.00484 0.01017 -0.00943 -0.00572 250 4XY -0.03974 -0.05023 0.15687 0.00038 0.00370 251 4XZ 0.05202 0.04994 -0.30093 -0.01518 0.00275 252 4YZ 0.01930 -0.01426 -0.00362 0.01881 0.04388 253 22 H 1S 0.28423 -0.02122 -0.02383 -0.07858 0.08695 254 2S 0.43221 -0.08748 -0.05771 -0.06810 0.24948 255 23 H 1S -0.28430 0.13002 0.00506 0.05058 0.01729 256 2S -0.42644 0.16966 0.00730 0.07336 0.02209 257 24 H 1S 0.19053 -0.11831 -0.02986 -0.25852 -0.09161 258 2S 0.27320 -0.19586 -0.05332 -0.41869 -0.14468 259 25 H 1S -0.03257 0.38995 0.07803 0.11224 -0.03651 260 2S 0.01469 0.73577 0.15408 0.15864 -0.16099 261 26 H 1S 0.17825 -0.04428 -0.00200 -0.22810 -0.18340 262 2S -0.06539 -2.66404 -0.57660 -0.45077 0.64684 263 27 H 1S 0.05532 0.16133 0.05856 -0.16926 -0.22646 264 2S -0.08194 0.13074 0.07888 -0.24990 -0.43606 171 172 173 174 175 V V V V V Eigenvalues -- 1.27467 1.32645 1.38521 1.38648 1.39139 1 1 C 1S 0.05200 0.00146 -0.00712 0.00628 0.01111 2 2S 0.86493 -0.09059 -0.32962 -0.19407 0.25221 3 2PX -0.12744 -0.00616 -0.05041 -0.13361 0.00681 4 2PY 0.05263 0.02156 0.02391 0.14005 -0.00819 5 2PZ -0.11173 0.02667 0.08394 0.04164 0.04777 6 3S -4.91810 -0.06192 -0.24580 -1.79820 -0.96052 7 3PX -2.42619 -0.95783 -1.10447 -0.86245 0.51593 8 3PY -0.09084 -0.59248 -0.02263 0.05425 0.25473 9 3PZ 0.19790 0.18291 -0.15636 0.05115 0.20816 10 4XX 0.06788 -0.02011 -0.02388 -0.00218 -0.00624 11 4YY 0.04617 -0.30363 -0.00565 0.07936 -0.14084 12 4ZZ -0.04958 0.32658 0.01977 -0.07654 0.15760 13 4XY 0.15797 0.05920 0.06211 0.02541 0.00499 14 4XZ 0.06896 -0.06925 -0.05946 0.09932 -0.00277 15 4YZ 0.05494 0.19872 -0.00855 -0.05902 0.08994 16 2 C 1S 0.03313 0.00044 0.00457 0.01791 0.00041 17 2S 0.08160 -0.22369 -0.00460 0.27690 0.17003 18 2PX -0.14558 -0.03744 0.00682 -0.07006 -0.07603 19 2PY 0.06434 -0.09520 0.03917 0.03479 -0.06249 20 2PZ 0.03226 0.05751 0.00997 -0.00299 -0.05079 21 3S -1.57495 0.51848 -0.75451 -1.32095 0.66095 22 3PX 0.29363 -0.58081 -0.48955 0.27143 0.57042 23 3PY -0.26180 -0.13427 0.10992 0.18679 -0.28320 24 3PZ 0.62253 -0.71414 -0.03513 0.29896 -0.19358 25 4XX 0.06129 -0.04500 -0.02455 0.01342 -0.00091 26 4YY -0.03554 0.02801 0.05692 0.01738 -0.06044 27 4ZZ 0.00605 0.01469 -0.03154 -0.00437 0.08442 28 4XY -0.09456 -0.02471 -0.05983 -0.01326 0.05217 29 4XZ 0.01324 -0.04540 0.01616 -0.04499 -0.01959 30 4YZ -0.02433 0.02965 0.05767 0.00585 -0.05063 31 3 H 1S 0.04472 0.11629 -0.01425 -0.00163 0.07828 32 2S -0.03718 -0.07457 -0.04388 0.05317 0.12739 33 4 Br 1S 0.00389 0.00593 -0.00266 -0.00633 -0.00236 34 2S -0.02732 -0.03771 0.01404 0.03301 0.00818 35 3S 0.03558 0.04064 -0.00917 -0.01963 0.00616 36 4S 0.06275 0.10444 -0.04962 -0.12251 -0.05135 37 5S -0.77891 -0.26505 0.18927 -0.07253 -0.28973 38 6S 1.67185 0.07633 -0.24061 0.70619 0.86995 39 7PX -0.00585 -0.00702 0.00123 0.00060 -0.00312 40 7PY 0.00678 0.01020 -0.00097 -0.00449 0.00085 41 7PZ 0.00128 -0.00963 0.00037 0.00228 -0.00334 42 8PX 0.01991 0.02319 -0.00408 -0.00199 0.01022 43 8PY -0.02274 -0.03388 0.00335 0.01472 -0.00308 44 8PZ -0.00383 0.03194 -0.00138 -0.00753 0.01119 45 9PX -0.11652 -0.10058 0.02078 0.00817 -0.03835 46 9PY 0.13117 0.14691 -0.02681 -0.04732 0.03527 47 9PZ -0.01526 -0.14082 0.01552 0.02694 -0.06081 48 10PX 0.28093 0.16250 -0.04265 -0.01293 0.02085 49 10PY -0.60321 -0.03075 0.11622 -0.11665 -0.17489 50 10PZ 0.31871 0.12764 -0.07505 0.05731 0.17596 51 11XX -0.01923 -0.02349 0.00367 0.01048 -0.00289 52 11YY -0.02429 -0.01311 0.00137 -0.00029 -0.00284 53 11ZZ -0.00437 -0.01612 0.00368 0.00883 -0.00829 54 11XY 0.02987 0.00417 -0.00223 -0.00285 -0.00336 55 11XZ -0.02104 -0.01595 -0.00102 0.00183 0.00152 56 11YZ 0.02846 0.01238 -0.00642 0.00307 0.01467 57 12XX -0.23429 0.06445 -0.01364 -0.25229 -0.22633 58 12YY -0.12997 -0.04907 -0.00665 -0.14664 -0.20447 59 12ZZ -0.27899 0.01399 -0.00959 -0.23050 -0.18917 60 12XY -0.17334 -0.01794 0.01250 0.01283 0.03026 61 12XZ 0.11530 0.08690 0.00353 -0.01188 -0.01449 62 12YZ -0.22512 -0.02992 0.04401 -0.05083 -0.09496 63 5 C 1S -0.01337 0.02356 0.02345 -0.00263 -0.03326 64 2S -0.19199 0.51698 0.46623 0.00616 -0.54097 65 2PX -0.00952 0.13323 0.00112 -0.00634 0.08251 66 2PY -0.04480 0.11028 -0.07428 -0.09210 0.12829 67 2PZ 0.13390 -0.10551 0.01036 0.09984 -0.01838 68 3S 1.31576 -1.47813 -1.77043 0.33843 2.52155 69 3PX 0.30452 -0.66523 0.42341 0.30666 -1.14641 70 3PY 0.81746 -1.02296 0.66127 0.76800 -1.60431 71 3PZ -1.53854 0.88149 0.29842 -0.08379 0.35271 72 4XX 0.00747 0.04152 0.05992 -0.00735 -0.06800 73 4YY -0.04147 -0.05936 -0.03860 0.02006 0.04044 74 4ZZ 0.02383 0.05165 -0.00059 -0.00878 0.00707 75 4XY -0.01646 0.05019 0.07588 -0.01721 -0.09422 76 4XZ -0.06896 0.05206 0.00539 -0.04835 -0.03548 77 4YZ 0.02724 -0.00987 -0.01050 0.00869 0.00948 78 6 C 1S 0.02091 0.00357 -0.00615 -0.00603 0.00313 79 2S 0.43081 0.11287 -0.11968 -0.17105 0.03104 80 2PX 0.01006 0.09452 0.04438 -0.04899 -0.13133 81 2PY -0.02716 -0.01960 0.02917 0.00142 -0.07429 82 2PZ 0.03780 0.00422 -0.00324 -0.05195 -0.03162 83 3S -1.68269 0.30941 0.69455 0.84349 -0.08857 84 3PX -0.50048 0.24724 -0.13323 -0.41927 0.40538 85 3PY -0.74407 0.72879 -0.16209 -0.84503 0.43974 86 3PZ -0.72898 0.17711 0.76966 0.76735 -0.54748 87 4XX 0.05159 -0.01833 0.00460 -0.09087 -0.08043 88 4YY -0.03270 -0.02967 -0.02478 0.11101 0.12517 89 4ZZ 0.02071 0.04447 0.01792 -0.02693 -0.05152 90 4XY 0.06938 0.00499 -0.00903 -0.07091 -0.05416 91 4XZ 0.03426 -0.02494 -0.04248 0.05992 0.09741 92 4YZ -0.06731 0.06245 0.02056 -0.03645 -0.00407 93 7 C 1S -0.00155 -0.00128 -0.00236 0.01055 0.01167 94 2S -0.14546 0.05678 0.00285 0.23240 0.22205 95 2PX -0.00313 0.02573 -0.01659 -0.03130 0.02622 96 2PY -0.02340 0.01890 -0.06968 -0.03113 0.11665 97 2PZ -0.05473 0.01569 0.03108 0.08929 0.04458 98 3S -0.33535 0.38245 0.29395 -1.02038 -0.79329 99 3PX -0.15376 0.15238 0.12228 -0.25712 -0.31300 100 3PY -0.22588 0.14981 0.17759 -0.22725 -0.28939 101 3PZ -0.13157 0.17148 0.11553 -1.04113 -0.93882 102 4XX -0.07133 0.00307 0.01970 0.08843 0.06005 103 4YY 0.07744 -0.00671 -0.02511 -0.05528 -0.01857 104 4ZZ -0.02527 0.00233 0.00367 -0.02760 -0.03126 105 4XY -0.05845 0.01793 0.00902 0.04275 0.04574 106 4XZ 0.02888 -0.05722 -0.08708 0.10533 0.21222 107 4YZ 0.01374 0.01798 0.02049 -0.09726 -0.11178 108 8 C 1S -0.00540 0.00235 0.00776 -0.00130 -0.01208 109 2S -0.09817 0.01899 0.16052 -0.01746 -0.27366 110 2PX -0.02658 0.00677 0.04759 -0.00365 -0.08754 111 2PY -0.04939 -0.02060 0.04307 0.02121 -0.06843 112 2PZ -0.02504 0.02323 -0.01258 -0.08812 -0.03706 113 3S 0.35188 -0.14785 -0.61742 0.04663 0.87909 114 3PX 0.40098 -0.07693 -0.47868 0.05409 0.82894 115 3PY 0.66249 -0.08126 -0.78794 0.02049 1.27717 116 3PZ 0.32126 -0.10668 -0.22621 0.05544 0.31971 117 4XX 0.00923 -0.04474 -0.06815 0.09566 0.18139 118 4YY -0.00647 0.04088 0.05987 -0.07889 -0.15295 119 4ZZ -0.00527 -0.00097 0.01024 -0.01865 -0.03582 120 4XY 0.00178 -0.03010 -0.05840 0.03810 0.12286 121 4XZ -0.08129 0.01002 0.01403 0.00871 -0.00295 122 4YZ 0.07076 -0.01584 -0.02724 -0.04955 -0.00965 123 9 C 1S 0.00401 -0.00173 -0.00782 -0.01000 0.00322 124 2S 0.05186 -0.04611 -0.13954 -0.21531 0.00881 125 2PX 0.00164 0.00120 -0.02604 -0.03452 0.01275 126 2PY 0.00273 -0.01344 -0.06069 -0.01703 0.09118 127 2PZ -0.00076 -0.00962 -0.00169 0.08811 0.07987 128 3S -0.50126 0.42920 0.70714 0.69436 -0.23566 129 3PX -0.12279 0.07809 0.31196 0.36205 -0.20625 130 3PY -0.31308 0.10588 0.59342 0.72694 -0.31838 131 3PZ 0.35799 0.02446 -0.52541 -0.84051 0.10044 132 4XX 0.04458 -0.04121 -0.03298 0.11102 0.15580 133 4YY -0.02518 0.04663 0.02262 -0.09258 -0.12186 134 4ZZ -0.02601 -0.00951 0.00474 -0.02661 -0.03107 135 4XY 0.01041 -0.02289 -0.04717 0.04545 0.13050 136 4XZ 0.08348 0.02311 0.02194 -0.07004 -0.09983 137 4YZ -0.03657 0.00314 -0.01195 0.02139 0.04459 138 10 C 1S -0.00356 0.00223 -0.00437 0.00720 0.01989 139 2S 0.05232 0.06260 -0.10104 0.17096 0.34431 140 2PX 0.01494 0.01193 0.03139 0.00416 -0.07425 141 2PY -0.06305 -0.05671 0.02347 0.02554 -0.06375 142 2PZ -0.09796 0.03836 0.00693 -0.10092 -0.03584 143 3S 1.08384 -0.92412 0.28761 -0.45222 -1.95483 144 3PX 0.12041 0.02580 0.13919 0.19499 -0.10019 145 3PY 0.34103 0.07667 0.19777 0.22175 -0.25563 146 3PZ -0.14434 0.13073 -0.21252 0.83291 1.37454 147 4XX -0.04674 0.02269 0.01164 -0.05912 -0.08912 148 4YY 0.07427 -0.02246 -0.01803 0.07963 0.11423 149 4ZZ -0.02348 -0.01641 -0.00289 -0.01014 -0.00980 150 4XY -0.01726 0.02419 -0.01413 -0.05632 -0.02670 151 4XZ 0.02947 0.04585 0.04753 -0.05772 -0.10415 152 4YZ -0.04209 -0.02370 -0.06393 0.00237 0.10906 153 11 H 1S 0.00910 0.00832 -0.01257 -0.14649 -0.11027 154 2S -0.11736 0.08549 0.03991 -0.29028 -0.29029 155 12 H 1S -0.07087 -0.01655 0.15772 0.22948 -0.08533 156 2S -0.10652 -0.01282 0.26545 0.38650 -0.13030 157 13 H 1S 0.18380 -0.01405 -0.16156 0.01979 0.28634 158 2S 0.28047 -0.01595 -0.28091 0.02553 0.49130 159 14 H 1S -0.05706 0.04087 0.03400 -0.15985 -0.17588 160 2S -0.06484 0.07524 0.05412 -0.30328 -0.31153 161 15 H 1S 0.23032 -0.12259 0.08570 0.24622 -0.11674 162 2S 0.04199 -0.11765 0.22604 0.31957 -0.32354 163 16 C 1S -0.03408 0.01832 0.01942 0.02139 -0.00789 164 2S -0.45170 0.46422 0.43818 0.49721 -0.16014 165 2PX -0.11206 -0.13111 0.01231 0.18038 0.13538 166 2PY -0.45920 -0.16050 -0.15424 -0.18011 0.13530 167 2PZ -0.25674 -0.01389 -0.14465 -0.08689 0.04774 168 3S 2.54925 -2.27343 -1.85472 -2.05806 0.81211 169 3PX 0.56743 0.77619 -0.49667 -1.85210 -0.74736 170 3PY 5.33406 2.46150 2.44541 3.11647 -0.78950 171 3PZ 2.92337 1.02423 1.50069 1.75699 -0.44868 172 4XX -0.07011 0.02728 0.00905 0.02294 0.02054 173 4YY -0.00336 0.19208 0.04532 -0.04958 -0.00882 174 4ZZ 0.05930 -0.19408 -0.02393 0.06522 -0.01761 175 4XY 0.00484 -0.19012 0.01094 0.06668 -0.09304 176 4XZ 0.00973 0.29985 -0.01304 -0.06682 0.16170 177 4YZ -0.00268 -0.12554 -0.01662 0.03673 -0.02904 178 17 C 1S -0.02606 -0.01670 -0.01754 -0.03255 -0.00434 179 2S -0.18547 -0.19366 -0.23338 -0.52694 -0.13570 180 2PX 0.10795 -0.04863 -0.07293 -0.16936 -0.03801 181 2PY 0.01757 -0.04998 0.04330 0.06327 -0.05665 182 2PZ 0.05270 -0.07625 0.05257 0.04177 -0.00736 183 3S 4.20621 1.73298 1.75098 3.12891 0.27956 184 3PX 0.62884 0.33094 0.67922 2.37966 1.11809 185 3PY 1.64041 1.99642 1.33730 1.46284 -0.38136 186 3PZ 0.76145 1.17353 0.66254 0.68271 -0.16100 187 4XX -0.10573 -0.04729 -0.06430 -0.06043 0.01881 188 4YY 0.07453 -0.11713 -0.03439 0.07298 -0.07763 189 4ZZ 0.02930 0.16060 0.10172 -0.01799 0.05005 190 4XY -0.02019 -0.06707 0.11859 -0.01584 0.08932 191 4XZ -0.01782 0.10925 -0.18092 0.09844 -0.14136 192 4YZ -0.00740 0.09440 0.02312 -0.08208 0.01857 193 18 C 1S 0.00789 -0.00307 -0.00841 -0.00123 0.01071 194 2S 0.19048 -0.02368 -0.14484 0.00441 0.23044 195 2PX 0.01104 0.08532 0.11727 0.21123 0.03006 196 2PY 0.00021 0.01012 -0.08871 -0.02419 0.04052 197 2PZ -0.00925 -0.00321 0.04466 -0.06255 0.06241 198 3S -1.43944 0.57600 0.81308 -0.20429 -1.24639 199 3PX -0.22721 -0.93103 -0.35763 -0.21104 0.14306 200 3PY -0.80357 0.00432 0.68712 0.15194 -1.05425 201 3PZ -0.36300 -0.00198 0.41487 0.08358 -0.59347 202 4XX -0.00981 0.02113 -0.00381 0.00404 0.02423 203 4YY -0.01058 -0.11155 0.24580 -0.14531 0.11543 204 4ZZ 0.01739 0.08254 -0.24719 0.14321 -0.12874 205 4XY 0.01056 -0.05173 0.02344 0.08474 -0.06437 206 4XZ -0.02652 0.11545 0.01051 -0.00511 0.12813 207 4YZ -0.06618 0.02662 -0.23585 0.04587 -0.08966 208 19 C 1S -0.01120 0.00414 0.01379 0.01911 -0.00332 209 2S -0.17124 0.15333 0.33422 0.45054 -0.08109 210 2PX 0.08599 -0.07122 -0.09460 -0.18126 -0.03552 211 2PY -0.03559 0.05973 0.05789 0.05511 -0.09133 212 2PZ -0.01674 0.01126 0.08646 0.00964 -0.03572 213 3S 0.86438 0.06088 -1.02829 -1.52413 0.18246 214 3PX -1.13713 0.34037 1.19670 1.79529 -0.18236 215 3PY 0.51385 -0.58218 -1.03950 -1.40472 0.34127 216 3PZ 0.27623 -0.37313 -0.64065 -0.76543 0.13530 217 4XX 0.01410 -0.00065 0.00894 0.01853 0.02080 218 4YY -0.05076 -0.02905 0.12371 -0.09039 0.09332 219 4ZZ 0.04000 0.03958 -0.11945 0.09127 -0.11615 220 4XY -0.01911 0.10657 -0.10051 0.10219 -0.01475 221 4XZ 0.02810 -0.12121 0.26463 -0.06572 0.01513 222 4YZ -0.04423 0.01538 -0.09220 0.03274 -0.10696 223 20 C 1S -0.00717 -0.00369 -0.00854 -0.01959 -0.00759 224 2S -0.33557 -0.11717 -0.20080 -0.45232 -0.15593 225 2PX 0.12443 0.05148 0.10201 0.20345 0.03643 226 2PY -0.01579 -0.02047 -0.11417 -0.04951 0.03428 227 2PZ -0.01348 -0.02913 0.02446 -0.08483 0.08475 228 3S -0.28296 0.29474 0.62805 1.41422 0.64733 229 3PX 0.25733 -0.32260 -0.77792 -2.04156 -0.89892 230 3PY 0.00565 -0.12309 -0.21757 -0.58038 -0.23566 231 3PZ 0.01676 -0.00673 -0.10955 -0.28907 -0.04884 232 4XX -0.00442 -0.01701 -0.01339 -0.03105 0.01912 233 4YY -0.01893 0.02799 -0.00058 -0.00393 -0.05199 234 4ZZ -0.00047 -0.01425 0.01235 0.02574 0.02722 235 4XY -0.06060 0.05285 -0.14752 0.13092 -0.10953 236 4XZ -0.00065 -0.07832 0.32998 -0.15228 0.18234 237 4YZ -0.07491 -0.02583 -0.00616 -0.04938 0.00372 238 21 C 1S 0.02383 -0.00007 -0.00499 -0.00255 0.00704 239 2S 0.40282 -0.14425 -0.19663 -0.09445 0.22783 240 2PX 0.17207 0.05038 -0.02036 -0.13291 -0.07041 241 2PY -0.11952 0.05178 0.05847 0.04565 -0.08506 242 2PZ -0.05882 0.00196 0.07002 0.01270 -0.04533 243 3S -2.98807 -0.61863 -0.15613 -0.29059 -0.34727 244 3PX 1.45619 0.27492 0.15544 0.21975 -0.11474 245 3PY -0.78437 -0.53654 -1.02549 -0.74771 1.08442 246 3PZ -0.46892 -0.31508 -0.54481 -0.41659 0.56449 247 4XX -0.08029 -0.04108 -0.04072 -0.01575 0.02759 248 4YY 0.04503 0.17841 -0.17179 0.06786 -0.04664 249 4ZZ 0.05266 -0.14216 0.21232 -0.04388 0.02910 250 4XY -0.00765 0.06222 0.07493 -0.00402 0.09137 251 4XZ -0.04204 -0.10842 -0.06923 0.11218 -0.15458 252 4YZ 0.03784 -0.12153 0.12313 -0.07473 0.00335 253 22 H 1S 0.40025 0.13992 0.24163 0.18799 -0.23017 254 2S 0.50536 0.25815 0.44827 0.34436 -0.40474 255 23 H 1S -0.06613 0.05907 0.13919 0.38790 0.17079 256 2S -0.09492 0.10088 0.24798 0.68034 0.29754 257 24 H 1S 0.24005 -0.15431 -0.29465 -0.42295 0.06830 258 2S 0.42565 -0.23621 -0.51623 -0.73332 0.11819 259 25 H 1S -0.03116 -0.01074 0.14644 0.08861 -0.18810 260 2S -0.10738 -0.06211 0.23421 0.11274 -0.33247 261 26 H 1S -0.11746 -0.08124 0.05054 0.32917 0.23851 262 2S 0.36580 0.73590 0.48805 0.89596 0.14047 263 27 H 1S 0.51711 0.14523 0.07145 0.10410 -0.02312 264 2S 0.61509 0.18433 0.11707 0.13180 -0.08348 176 177 178 179 180 V V V V V Eigenvalues -- 1.41376 1.42413 1.43490 1.44203 1.44659 1 1 C 1S -0.00119 0.00502 -0.01314 -0.01761 -0.01031 2 2S -0.04359 -0.00641 -0.10478 -0.17226 -0.06753 3 2PX -0.07925 -0.04924 0.09762 0.04589 -0.00399 4 2PY 0.05044 0.03059 -0.04954 -0.03669 -0.06062 5 2PZ -0.00379 0.00929 0.00393 -0.01299 -0.02964 6 3S 0.04534 -0.38094 1.73641 1.73159 1.13505 7 3PX 0.21707 0.75971 0.20092 -0.74062 -0.13157 8 3PY 0.20293 0.02301 -0.68789 -0.68408 -0.32744 9 3PZ 0.21812 -0.14903 -0.37484 -0.48545 -0.23140 10 4XX -0.00865 0.01919 -0.02768 -0.00545 0.01968 11 4YY -0.00178 -0.02697 -0.04139 0.00273 0.05091 12 4ZZ 0.00493 0.00144 0.06883 0.00492 -0.07232 13 4XY 0.01212 -0.04168 -0.05671 0.00716 -0.00750 14 4XZ -0.04300 0.07975 0.00532 -0.02278 0.00644 15 4YZ -0.02529 0.00835 0.03106 0.01686 -0.01280 16 2 C 1S 0.02954 -0.00925 -0.01186 0.01006 0.01270 17 2S 0.60789 -0.00970 -0.09582 -0.08552 -0.10060 18 2PX 0.01105 0.03758 -0.05584 -0.07210 -0.02578 19 2PY -0.08395 -0.03584 -0.11745 0.07030 0.14853 20 2PZ -0.05332 -0.08234 0.05035 0.03765 0.03518 21 3S -0.40278 0.72355 0.83255 -0.94927 -1.34974 22 3PX -0.17011 0.23863 -0.33364 -0.44155 0.15109 23 3PY -0.37252 0.11717 0.12682 0.11142 0.25495 24 3PZ 0.04126 0.58431 -0.17521 0.03059 0.15861 25 4XX 0.00465 0.04099 -0.04641 -0.06438 -0.02515 26 4YY 0.02557 -0.02586 0.04111 0.09695 0.03306 27 4ZZ 0.02031 -0.02795 -0.00727 -0.03135 -0.00988 28 4XY 0.03116 0.05102 0.03391 -0.07942 -0.05148 29 4XZ 0.02209 0.02050 -0.04755 -0.02512 -0.02613 30 4YZ 0.02909 -0.01899 0.03741 0.03818 0.02117 31 3 H 1S 0.13267 -0.12375 -0.09583 0.00112 0.02629 32 2S 0.08591 -0.21964 -0.07242 -0.01646 0.01614 33 4 Br 1S -0.00481 -0.00396 0.00342 0.00608 0.00046 34 2S 0.02370 0.02083 -0.01869 -0.02968 -0.00091 35 3S -0.01044 -0.01259 0.01340 0.01156 -0.00376 36 4S -0.09490 -0.07796 0.06528 0.12413 0.01238 37 5S -0.25176 -0.04294 0.02024 0.18455 0.10627 38 6S 1.02532 0.43239 -0.39099 -0.87752 -0.24192 39 7PX 0.00088 0.00179 -0.00161 -0.00141 0.00057 40 7PY -0.00280 -0.00201 0.00391 -0.00087 -0.00206 41 7PZ 0.00135 0.00048 -0.00254 0.00054 0.00167 42 8PX -0.00285 -0.00584 0.00515 0.00451 -0.00193 43 8PY 0.00902 0.00648 -0.01310 0.00317 0.00702 44 8PZ -0.00427 -0.00161 0.00831 -0.00200 -0.00561 45 9PX 0.00660 0.01944 -0.01186 -0.01123 0.01133 46 9PY -0.01368 -0.01629 0.05995 -0.03439 -0.04209 47 9PZ -0.00134 0.00943 -0.02639 0.01935 0.02688 48 10PX 0.05015 -0.00023 -0.01585 0.00002 -0.02937 49 10PY -0.22520 -0.08389 0.04179 0.12513 0.04525 50 10PZ 0.19410 -0.01029 -0.09086 -0.05522 -0.00488 51 11XX 0.01080 0.00615 -0.00258 -0.00338 0.00396 52 11YY -0.00309 -0.00429 -0.01424 -0.00078 0.00344 53 11ZZ -0.00051 0.01106 0.00217 -0.00397 -0.00126 54 11XY 0.00421 0.00210 -0.00854 -0.00124 -0.00073 55 11XZ -0.00171 -0.00099 -0.00152 0.00024 0.00273 56 11YZ 0.01572 -0.00109 -0.00813 -0.00685 -0.00240 57 12XX -0.30804 -0.14850 0.09992 0.28244 0.05349 58 12YY -0.18207 -0.07067 0.13317 0.26491 0.06830 59 12ZZ -0.21849 -0.19153 0.05306 0.29832 0.09724 60 12XY -0.03833 -0.01864 0.05490 0.00840 0.00401 61 12XZ 0.02168 0.00856 0.00862 -0.00077 -0.01700 62 12YZ -0.13341 0.00024 0.07792 0.04000 -0.00118 63 5 C 1S -0.00762 -0.00306 -0.00097 0.02129 0.01909 64 2S -0.06280 -0.06856 -0.03069 0.39461 0.33820 65 2PX 0.14194 0.00201 0.05971 0.03462 -0.05300 66 2PY 0.10638 0.00028 0.09866 -0.08649 -0.21134 67 2PZ 0.00695 0.07823 0.20467 -0.01908 -0.05636 68 3S 0.81221 0.49003 0.42725 -1.46630 -1.48868 69 3PX -0.83270 -0.09491 -0.70300 0.51054 1.17909 70 3PY -1.05997 -0.06964 -1.28084 0.87182 2.02141 71 3PZ -0.90862 -0.50192 -0.14977 -0.01613 0.55634 72 4XX -0.02122 -0.04160 0.07952 0.09574 0.05391 73 4YY 0.03682 0.05584 -0.05183 -0.09347 -0.05634 74 4ZZ -0.01625 -0.01471 -0.02274 0.01060 0.01105 75 4XY -0.01028 -0.00576 0.07303 0.08259 0.06587 76 4XZ 0.03669 -0.03999 -0.14319 0.01300 -0.02131 77 4YZ 0.01803 0.02094 0.05365 0.00190 0.00956 78 6 C 1S 0.01831 -0.00457 -0.02115 0.00260 -0.00645 79 2S 0.39310 -0.15014 -0.45038 0.10696 -0.07424 80 2PX -0.03363 -0.03964 -0.01288 0.06637 0.05341 81 2PY -0.07823 0.00374 0.03507 0.03147 0.09529 82 2PZ 0.01218 -0.06946 -0.22701 0.02674 0.04760 83 3S -1.79640 0.07262 1.67686 -0.26730 0.59580 84 3PX 0.44423 -0.08896 -0.62494 -0.14555 -0.33100 85 3PY 0.86522 -0.32282 -1.06920 0.03607 -0.52066 86 3PZ -1.19445 0.20178 1.52067 0.28045 0.74885 87 4XX -0.10101 0.05067 0.01408 -0.15625 -0.12687 88 4YY 0.10784 -0.03141 0.00751 0.12123 0.09764 89 4ZZ 0.00191 -0.02465 -0.04074 0.03593 0.03539 90 4XY -0.04144 0.01961 -0.00266 -0.09872 -0.10814 91 4XZ 0.01593 0.01178 0.03852 -0.01900 -0.00583 92 4YZ 0.00793 -0.03480 -0.08014 0.01346 -0.01024 93 7 C 1S -0.00487 0.00388 0.02413 -0.01015 -0.01170 94 2S -0.09186 0.09092 0.54672 -0.18750 -0.24672 95 2PX 0.02504 0.01348 0.04021 -0.07245 -0.10909 96 2PY 0.10772 -0.01145 0.00495 -0.02925 -0.09383 97 2PZ -0.04924 0.04556 0.19094 -0.03001 -0.03701 98 3S 0.37317 -0.35078 -2.07591 0.83276 0.83025 99 3PX 0.04243 -0.10129 -0.43709 0.26110 0.25104 100 3PY 0.08397 -0.10931 -0.60710 0.27813 0.27696 101 3PZ 0.26765 -0.55599 -2.72731 0.72909 0.94626 102 4XX 0.08107 -0.03367 0.03836 0.16267 0.15242 103 4YY -0.04872 0.02973 -0.04164 -0.15179 -0.15239 104 4ZZ -0.03561 0.01045 0.02437 -0.01622 -0.00355 105 4XY 0.03666 -0.00931 0.06634 0.06475 0.03738 106 4XZ 0.13890 -0.05602 -0.12867 0.09157 0.07306 107 4YZ -0.04607 0.02724 0.01905 -0.07546 -0.07953 108 8 C 1S -0.01085 -0.00011 -0.00496 0.00868 0.01557 109 2S -0.24233 -0.01424 -0.11639 0.17432 0.31951 110 2PX -0.06917 0.00044 -0.00487 0.01462 0.03706 111 2PY -0.07706 0.00081 0.01276 0.04281 0.08497 112 2PZ 0.04181 -0.04997 -0.21350 0.03561 0.03047 113 3S 0.94462 -0.06320 0.41150 -0.68644 -1.32966 114 3PX 0.67961 0.02076 0.31307 -0.42724 -0.81149 115 3PY 1.03937 0.04688 0.51522 -0.75377 -1.38919 116 3PZ 0.34159 -0.01820 0.11354 -0.22670 -0.41773 117 4XX 0.10907 -0.03327 -0.02148 0.08988 0.08217 118 4YY -0.10332 0.04467 0.07319 -0.09709 -0.08766 119 4ZZ -0.01387 -0.01161 -0.05522 0.01103 0.01614 120 4XY 0.04676 -0.01327 -0.00219 0.03165 0.02501 121 4XZ 0.02621 0.00325 0.12443 0.08387 0.07596 122 4YZ 0.01682 -0.01015 -0.14334 -0.05191 -0.05668 123 9 C 1S 0.01180 -0.00505 -0.02089 -0.00222 -0.00784 124 2S 0.28238 -0.08869 -0.42004 -0.02321 -0.15359 125 2PX 0.03143 0.00916 -0.01116 -0.08067 -0.11708 126 2PY 0.11139 0.00661 0.04248 -0.01401 -0.07460 127 2PZ -0.04610 0.05413 0.19763 -0.04738 -0.05111 128 3S -0.88603 0.43018 2.02201 0.21299 0.54941 129 3PX -0.45055 0.15759 0.70985 0.06408 0.23828 130 3PY -0.78326 0.27644 1.34638 0.14633 0.45622 131 3PZ 1.13321 -0.51406 -1.61670 -0.04633 -0.50409 132 4XX 0.11359 -0.03995 -0.00533 0.15643 0.15070 133 4YY -0.09877 0.04245 0.04194 -0.17961 -0.18091 134 4ZZ -0.00565 -0.00320 -0.04598 0.02283 0.02773 135 4XY 0.08240 -0.01907 0.02131 0.07629 0.05632 136 4XZ -0.04757 -0.00101 -0.13209 -0.10247 -0.10310 137 4YZ 0.06181 -0.01761 0.03765 0.06665 0.05281 138 10 C 1S -0.00431 0.00375 0.02600 -0.01095 -0.01109 139 2S -0.05249 0.13783 0.60893 -0.15947 -0.19187 140 2PX -0.08474 0.03753 0.04130 0.02703 0.05018 141 2PY -0.10805 0.03981 0.00254 0.03728 0.08243 142 2PZ 0.02274 -0.05171 -0.19406 0.02397 0.01901 143 3S 0.39881 -0.29222 -2.72128 0.94029 1.03876 144 3PX 0.24543 0.09291 0.54855 0.02096 -0.14388 145 3PY 0.37246 0.11966 0.70031 0.08629 -0.18823 146 3PZ -0.09168 0.72195 3.06684 -0.84425 -1.14417 147 4XX -0.06330 0.01221 -0.04890 -0.13505 -0.13000 148 4YY 0.08118 -0.02046 0.06715 0.11957 0.10254 149 4ZZ -0.03005 0.01378 -0.00812 0.00564 0.02314 150 4XY -0.03774 0.02475 0.01253 -0.10033 -0.10653 151 4XZ -0.07838 0.00367 0.08713 -0.03547 -0.04033 152 4YZ 0.07359 -0.01804 -0.08051 -0.00256 -0.00633 153 11 H 1S -0.01810 -0.15394 -0.53266 0.10045 0.16989 154 2S -0.06096 -0.24609 -0.91517 0.22218 0.35066 155 12 H 1S -0.25001 0.09342 0.33488 0.02934 0.12992 156 2S -0.44513 0.17856 0.63107 0.05100 0.23082 157 13 H 1S 0.22834 0.00934 0.10016 -0.13902 -0.26472 158 2S 0.40576 0.01769 0.18796 -0.25623 -0.48688 159 14 H 1S 0.02888 -0.11259 -0.49152 0.12447 0.16948 160 2S 0.06970 -0.19439 -0.86756 0.23255 0.31172 161 15 H 1S -0.21679 0.08687 0.32256 0.03501 0.14013 162 2S -0.42756 0.08630 0.54513 0.17997 0.35022 163 16 C 1S 0.01262 0.00398 -0.00092 0.00441 0.00082 164 2S 0.18929 0.01036 -0.04560 0.13754 0.05347 165 2PX 0.03750 0.04070 -0.15239 -0.25393 -0.20932 166 2PY -0.09626 -0.05992 0.05368 -0.01895 -0.03067 167 2PZ -0.04433 -0.05072 0.03320 -0.01404 -0.00582 168 3S -1.05922 -0.29508 0.07017 -0.84636 -0.35376 169 3PX -1.62296 -0.96923 1.82200 2.51153 1.77956 170 3PY -0.42088 -0.64967 -1.17513 0.66124 0.24222 171 3PZ -0.24784 -0.26455 -0.71833 0.47052 -0.02254 172 4XX -0.00091 -0.00439 -0.01136 -0.00418 -0.01315 173 4YY 0.10727 -0.22260 0.08685 -0.00186 -0.05676 174 4ZZ -0.09771 0.22633 -0.08983 0.00050 0.05994 175 4XY 0.02479 -0.09049 0.02533 -0.04118 0.01515 176 4XZ -0.07712 0.19399 -0.04393 0.07289 -0.03008 177 4YZ -0.05563 0.19803 -0.06318 0.02372 0.07739 178 17 C 1S 0.02378 0.01512 0.00609 -0.00685 0.00049 179 2S 0.49890 0.29856 0.17642 -0.09879 -0.02031 180 2PX 0.07438 0.06265 0.05796 0.04224 0.09499 181 2PY 0.14090 0.09303 0.02937 -0.05594 -0.05725 182 2PZ 0.04939 0.11961 -0.02277 -0.07508 0.02830 183 3S -2.63427 -1.70522 -0.78653 1.17490 0.40089 184 3PX -1.56159 -1.22315 -1.44371 -0.61733 -1.08337 185 3PY -0.83910 -1.07882 -0.55280 1.11432 0.40245 186 3PZ -0.44343 -0.44520 -0.26029 0.57422 0.28405 187 4XX 0.01715 -0.01198 -0.03214 -0.00588 -0.01138 188 4YY -0.04788 0.20747 -0.05831 0.12138 -0.03045 189 4ZZ 0.06018 -0.18541 0.08155 -0.11864 0.03968 190 4XY -0.02880 0.06155 -0.07212 -0.13923 0.05409 191 4XZ 0.05283 -0.13045 0.03490 0.17680 -0.15333 192 4YZ 0.07874 -0.11880 0.07991 -0.06807 0.05244 193 18 C 1S -0.02494 -0.01473 0.00233 0.00793 0.00292 194 2S -0.60998 -0.35547 0.04864 0.18650 0.07628 195 2PX -0.05189 -0.04822 -0.10218 -0.03778 -0.05971 196 2PY -0.18896 -0.08677 0.01930 0.07417 0.04515 197 2PZ -0.07887 -0.10064 0.03285 0.01455 -0.00976 198 3S 2.24606 1.27733 0.14121 -0.30413 0.04005 199 3PX 0.32859 0.47490 0.19888 -0.59859 -0.29305 200 3PY 2.37333 1.69889 0.10143 -0.69207 -0.17532 201 3PZ 1.31163 0.78385 0.07546 -0.39406 -0.05266 202 4XX -0.07113 -0.03329 0.00903 0.01687 0.02124 203 4YY 0.05459 -0.04306 0.02493 -0.03591 -0.08313 204 4ZZ -0.00403 0.06753 -0.03400 0.01380 0.05543 205 4XY 0.00908 -0.10040 0.00261 0.09622 -0.15085 206 4XZ -0.08243 0.16258 -0.05574 -0.21055 0.24117 207 4YZ -0.02197 0.06650 0.01085 0.01629 0.07718 208 19 C 1S 0.00543 0.00402 -0.00691 -0.00902 -0.00786 209 2S 0.13070 0.05809 -0.21167 -0.16780 -0.15774 210 2PX 0.07653 0.07446 0.09890 0.02388 0.05440 211 2PY 0.15567 0.09501 -0.00861 -0.07322 0.05821 212 2PZ 0.08251 0.06182 -0.00849 0.08690 -0.09122 213 3S -0.32120 -0.36704 0.59311 1.01269 0.80788 214 3PX 0.55218 0.37223 -0.68205 -0.82334 -0.72781 215 3PY -0.30451 -0.19317 0.54306 0.31512 0.34511 216 3PZ -0.17758 -0.09992 0.30547 0.22075 0.17405 217 4XX -0.07397 -0.05102 0.00083 0.02781 -0.00654 218 4YY -0.01519 0.26400 -0.05740 0.21344 -0.12869 219 4ZZ 0.09301 -0.21314 0.04839 -0.24437 0.13123 220 4XY -0.04275 0.08324 -0.05107 -0.12853 0.15419 221 4XZ 0.07824 -0.18666 0.04896 0.21901 -0.30219 222 4YZ 0.10082 -0.14164 0.05937 -0.15771 0.10719 223 20 C 1S 0.01967 0.01341 0.00899 0.00441 0.00849 224 2S 0.47160 0.30829 0.20585 0.04364 0.13863 225 2PX -0.10505 -0.05726 -0.09287 -0.02808 -0.04223 226 2PY -0.14072 -0.12328 0.03120 0.03860 0.01234 227 2PZ -0.09906 -0.00101 0.00376 0.05210 0.03489 228 3S -1.82165 -1.29286 -0.51000 -0.29187 -0.76781 229 3PX 2.06400 1.35298 0.87054 0.39366 0.84250 230 3PY 0.81240 0.38138 0.32179 0.01044 0.08419 231 3PZ 0.35825 0.26525 0.13374 -0.03408 0.06727 232 4XX -0.05797 -0.02441 0.01990 0.02790 0.02391 233 4YY 0.12359 -0.15396 0.06001 -0.23573 0.14869 234 4ZZ -0.05145 0.18730 -0.07357 0.20480 -0.17455 235 4XY 0.03553 -0.00206 -0.01852 -0.02871 -0.05489 236 4XZ -0.00598 0.06449 -0.00632 0.02437 0.07107 237 4YZ -0.00791 0.17027 -0.01152 0.18093 -0.09072 238 21 C 1S -0.03225 -0.01950 0.00312 0.00952 0.00288 239 2S -0.65831 -0.38785 -0.02195 0.07016 -0.00966 240 2PX 0.09373 0.02741 0.11092 0.09292 0.07577 241 2PY 0.13363 0.13882 -0.00929 0.01679 0.00026 242 2PZ 0.09939 -0.00760 0.02804 -0.05622 0.05565 243 3S 3.43350 2.18503 -0.31660 -1.36050 -0.48733 244 3PX -1.10069 -0.48665 -0.04494 0.63036 0.47797 245 3PY -2.43159 -1.52288 0.37857 0.44360 -0.10620 246 3PZ -1.26049 -0.92513 0.22922 0.18437 -0.05070 247 4XX -0.03834 -0.02513 0.00195 -0.00331 -0.01474 248 4YY -0.04368 0.14142 -0.04785 0.13147 -0.12820 249 4ZZ 0.06450 -0.12518 0.03720 -0.13232 0.13857 250 4XY -0.01206 0.09213 -0.04546 -0.08350 0.06657 251 4XZ 0.07216 -0.14259 0.03514 0.07764 -0.16504 252 4YZ 0.01890 -0.10301 0.05419 -0.05386 0.14100 253 22 H 1S 0.38465 0.25611 -0.06809 -0.04702 0.02137 254 2S 0.76620 0.46787 -0.15688 -0.12094 0.04358 255 23 H 1S -0.34449 -0.21835 -0.18322 -0.07657 -0.14255 256 2S -0.65037 -0.40861 -0.31337 -0.12849 -0.25705 257 24 H 1S -0.11844 -0.07569 0.14823 0.11600 0.11125 258 2S -0.20824 -0.13504 0.28239 0.23053 0.21695 259 25 H 1S 0.43473 0.31750 0.02440 -0.14096 -0.03919 260 2S 0.80274 0.58904 0.03627 -0.27721 -0.07054 261 26 H 1S -0.28833 -0.18685 -0.30035 -0.19079 -0.20246 262 2S -0.29330 -0.55810 -0.57111 0.07126 -0.31699 263 27 H 1S -0.01998 0.01381 0.04380 0.04865 -0.01306 264 2S -0.13231 -0.01372 0.13417 0.23944 0.04349 181 182 183 184 185 V V V V V Eigenvalues -- 1.45559 1.46126 1.46407 1.48180 1.49485 1 1 C 1S 0.00139 0.02122 0.01167 0.01630 -0.01009 2 2S -0.00967 0.20726 0.02514 0.18347 -0.08527 3 2PX 0.00376 -0.07507 0.00394 -0.04897 0.02815 4 2PY 0.01174 -0.03686 0.05580 -0.01806 -0.02394 5 2PZ 0.00897 0.02540 0.02397 0.00968 -0.02056 6 3S -0.22612 -1.61330 -0.82030 -0.85504 0.98629 7 3PX -0.17543 1.57543 0.26195 1.08563 -0.36247 8 3PY 0.12407 0.27315 -0.15361 0.24916 -0.08455 9 3PZ 0.09803 0.25061 -0.13087 0.23885 -0.05245 10 4XX -0.00971 0.05779 0.02301 0.05985 -0.01877 11 4YY 0.01426 -0.12693 -0.01206 -0.10986 0.02169 12 4ZZ -0.00282 0.06833 -0.01392 0.04655 -0.00651 13 4XY 0.00779 -0.00372 0.01884 -0.00474 -0.01593 14 4XZ -0.00879 0.06055 0.02599 0.04863 -0.02372 15 4YZ -0.01266 0.08596 0.00973 0.07081 -0.00884 16 2 C 1S 0.00108 -0.01024 -0.00333 0.01600 -0.00014 17 2S 0.07501 -0.42367 -0.06034 0.08713 0.09025 18 2PX 0.00432 0.02065 -0.02146 -0.00048 0.01570 19 2PY -0.02297 0.10611 -0.00355 0.08362 0.00049 20 2PZ 0.00146 0.06162 -0.05467 0.00050 0.00120 21 3S 0.01218 0.03763 0.25224 -1.05546 -0.11867 22 3PX -0.10931 1.85688 0.50422 1.31039 -0.63146 23 3PY -0.08998 0.58287 0.04626 0.34139 -0.16359 24 3PZ -0.11411 -0.03977 0.37696 0.19860 -0.04481 25 4XX 0.00066 0.08764 0.06831 0.09951 -0.03360 26 4YY 0.00265 -0.21662 -0.11423 -0.20856 0.09725 27 4ZZ 0.00169 0.10701 0.03913 0.12009 -0.07089 28 4XY -0.00059 0.11394 0.08311 0.11272 -0.04969 29 4XZ 0.00609 -0.03201 -0.02510 -0.04943 -0.01566 30 4YZ -0.00013 -0.12055 -0.04577 -0.08948 0.07622 31 3 H 1S 0.02401 0.05971 -0.03433 0.11358 -0.04283 32 2S 0.04032 0.12305 -0.07580 0.13067 -0.02121 33 4 Br 1S -0.00089 0.00199 0.00065 -0.00654 -0.00602 34 2S 0.00416 -0.01222 -0.00355 0.03084 0.03070 35 3S -0.00114 0.01277 0.00249 -0.00881 -0.01620 36 4S -0.01817 0.03384 0.01253 -0.13550 -0.11951 37 5S -0.02143 -0.17691 -0.11720 -0.37658 0.05205 38 6S 0.11392 0.21173 0.25774 1.42281 0.35354 39 7PX 0.00008 -0.00240 -0.00034 -0.00181 0.00018 40 7PY 0.00046 0.00337 -0.00100 -0.00028 -0.00055 41 7PZ 0.00010 -0.00273 -0.00070 -0.00098 0.00105 42 8PX -0.00026 0.00791 0.00117 0.00593 -0.00061 43 8PY -0.00153 -0.01131 0.00325 0.00060 0.00181 44 8PZ -0.00031 0.00933 0.00249 0.00363 -0.00359 45 9PX 0.00149 -0.03120 -0.00778 -0.02347 0.00282 46 9PY 0.00869 0.05719 -0.00702 0.02679 -0.00898 47 9PZ -0.00001 -0.05427 -0.02053 -0.04122 0.02108 48 10PX -0.00182 -0.03641 0.01351 0.00175 0.02268 49 10PY -0.01406 -0.06983 -0.09085 -0.27936 0.02277 50 10PZ 0.00621 0.07553 0.09140 0.22345 -0.03885 51 11XX 0.00085 -0.00695 -0.00042 0.00726 0.00636 52 11YY -0.00050 0.00261 0.00090 0.00092 -0.00012 53 11ZZ -0.00016 -0.01094 -0.00328 -0.00535 0.00811 54 11XY -0.00046 -0.00551 -0.00101 -0.00297 0.00261 55 11XZ 0.00000 0.00442 0.00105 0.00370 -0.00257 56 11YZ 0.00040 0.00973 0.01094 0.02118 -0.00464 57 12XX -0.04521 -0.00685 -0.02831 -0.42572 -0.19207 58 12YY -0.03810 -0.07405 -0.01521 -0.34141 -0.15757 59 12ZZ -0.03724 -0.00399 -0.01488 -0.34424 -0.19453 60 12XY 0.00247 0.05242 0.00594 0.02301 -0.02213 61 12XZ 0.00065 -0.04588 -0.00829 -0.02968 0.02180 62 12YZ -0.00293 -0.04714 -0.07266 -0.15616 0.02599 63 5 C 1S -0.00277 -0.00129 -0.00370 -0.01457 0.00618 64 2S -0.05965 -0.06635 -0.03771 -0.26075 0.08069 65 2PX 0.00620 -0.11805 0.03070 -0.13031 0.01224 66 2PY 0.04842 -0.22994 0.01960 -0.11232 0.03254 67 2PZ 0.01356 -0.12496 -0.07350 -0.09206 0.04250 68 3S 0.18921 -0.14989 0.28779 0.84394 -0.45174 69 3PX -0.19761 1.13112 -0.06111 1.01554 -0.14156 70 3PY -0.38244 2.48508 0.31895 1.59523 -0.44513 71 3PZ -0.06146 2.01712 -0.20901 1.20985 -0.38195 72 4XX -0.00748 -0.20393 -0.06943 -0.18552 0.12335 73 4YY 0.01326 0.15085 0.00927 0.16013 -0.09524 74 4ZZ -0.00666 0.04472 0.05522 0.02902 -0.02520 75 4XY -0.02073 -0.12341 -0.01618 -0.15495 0.09068 76 4XZ 0.03479 0.03614 -0.34101 -0.12995 -0.00899 77 4YZ -0.02028 -0.02061 0.24431 0.08821 0.00840 78 6 C 1S 0.00027 -0.02165 0.01181 -0.01243 -0.00185 79 2S 0.01844 -0.36186 0.23866 -0.20541 -0.03735 80 2PX 0.00508 0.09408 -0.08335 -0.10969 -0.07397 81 2PY -0.02362 0.11757 0.01550 0.11631 0.02957 82 2PZ -0.00965 -0.00555 0.08608 0.03321 -0.00404 83 3S 0.04276 2.49567 -1.07903 1.44623 -0.01360 84 3PX 0.00235 -0.57136 0.33251 -0.28347 0.08686 85 3PY 0.02067 -1.40789 0.64540 -0.80200 0.07966 86 3PZ -0.06525 1.66392 -0.92821 0.60846 -0.10908 87 4XX 0.01565 0.08293 0.05021 -0.21547 -0.19801 88 4YY -0.01506 -0.12413 -0.03920 0.22999 0.22147 89 4ZZ -0.00240 0.03254 -0.01382 -0.01190 -0.01909 90 4XY 0.02059 0.01549 0.01967 -0.19331 -0.13512 91 4XZ -0.01319 0.06034 0.33308 0.17496 0.14146 92 4YZ 0.01154 -0.06426 -0.17537 -0.08714 -0.07742 93 7 C 1S 0.00421 0.00137 -0.00970 0.00180 0.00155 94 2S 0.08381 0.00359 -0.20788 -0.02294 0.03800 95 2PX 0.01709 -0.11397 0.06026 -0.05351 -0.10249 96 2PY 0.02554 -0.10416 -0.00568 -0.05466 0.08492 97 2PZ 0.01118 0.02533 -0.08083 -0.01283 0.01951 98 3S -0.39596 -0.54143 0.79790 -0.52414 -0.09204 99 3PX -0.08521 -0.03170 0.27495 -0.10521 0.00158 100 3PY -0.09915 -0.06309 0.19379 -0.10614 -0.09482 101 3PZ -0.34639 -0.14231 1.06978 0.02321 -0.17986 102 4XX -0.03819 -0.14953 0.02612 0.20047 0.11138 103 4YY 0.04152 0.14190 -0.03639 -0.21129 -0.07339 104 4ZZ -0.00316 0.00790 0.00379 0.01669 -0.03533 105 4XY -0.01439 -0.14057 0.02238 0.08926 0.03811 106 4XZ 0.00430 0.17984 -0.08740 -0.08217 0.39137 107 4YZ 0.00361 -0.15661 0.08155 0.01748 -0.24014 108 8 C 1S -0.00492 0.01294 -0.00133 0.00413 -0.00230 109 2S -0.09375 0.29374 -0.02612 0.09623 -0.05099 110 2PX -0.00670 -0.02359 -0.04861 0.12186 -0.03180 111 2PY -0.02075 0.14490 -0.00294 -0.04072 0.00804 112 2PZ -0.01126 -0.02094 0.10345 -0.00270 -0.00751 113 3S 0.47389 -1.11116 0.15019 -0.35245 0.26010 114 3PX 0.23622 -0.78123 0.03127 -0.19906 0.10314 115 3PY 0.40635 -1.19810 0.09874 -0.35375 0.16066 116 3PZ 0.13199 -0.46772 0.00150 -0.15698 0.12118 117 4XX -0.01445 0.25637 0.04643 -0.32462 0.10295 118 4YY 0.01451 -0.25682 -0.04089 0.34003 -0.10883 119 4ZZ -0.00229 0.01248 -0.00684 -0.00226 0.00509 120 4XY -0.00336 0.17182 0.00662 -0.19981 0.07370 121 4XZ -0.04980 -0.06915 0.34230 -0.10272 -0.11559 122 4YZ 0.02906 -0.02263 -0.16659 0.06854 0.06456 123 9 C 1S 0.00233 -0.01327 0.01306 -0.00293 0.00126 124 2S 0.04093 -0.35224 0.25999 -0.12432 0.04159 125 2PX 0.03351 -0.07871 -0.03410 -0.01438 0.10890 126 2PY 0.01104 -0.15227 0.04034 -0.09762 -0.03748 127 2PZ 0.01189 0.02508 -0.07610 0.00036 0.00516 128 3S -0.22253 0.77669 -1.25912 -0.10885 -0.07068 129 3PX -0.05277 0.47192 -0.52836 0.02058 -0.01757 130 3PY -0.11706 0.72918 -0.81503 0.13322 0.01701 131 3PZ 0.17045 -1.20774 0.88032 -0.37363 0.13060 132 4XX -0.03153 -0.05960 -0.14288 0.03752 -0.25392 133 4YY 0.04359 0.04903 0.10029 -0.00566 0.26830 134 4ZZ -0.01264 -0.00003 0.04638 -0.03152 -0.01053 135 4XY -0.01541 -0.05368 -0.06098 -0.01535 -0.17052 136 4XZ 0.04933 -0.11418 -0.25366 0.26107 0.21813 137 4YZ -0.02547 0.03108 0.17290 -0.18326 -0.12140 138 10 C 1S 0.00230 0.00394 -0.01330 0.00207 -0.00137 139 2S 0.04699 0.08467 -0.26477 0.02589 -0.02587 140 2PX -0.01825 0.07433 0.08888 0.00008 0.08985 141 2PY -0.02190 0.12463 -0.05134 0.05864 -0.07041 142 2PZ -0.01150 -0.04962 0.08498 -0.02600 0.00622 143 3S -0.18070 -0.50214 1.32635 -0.06569 0.13762 144 3PX 0.02685 -0.48707 -0.18476 -0.44288 0.08281 145 3PY 0.05948 -0.87041 -0.44924 -0.66779 0.28220 146 3PZ 0.21964 -0.33465 -1.28635 -0.44517 0.12232 147 4XX 0.03902 0.14892 0.02830 -0.10293 0.18140 148 4YY -0.03047 -0.17773 -0.02453 0.10508 -0.16389 149 4ZZ -0.00745 0.04101 -0.00822 0.01300 -0.01597 150 4XY 0.02942 0.10280 -0.00037 -0.07939 0.08977 151 4XZ -0.00317 -0.09651 0.22306 -0.02615 0.36929 152 4YZ 0.00894 0.05156 -0.11690 0.03961 -0.22842 153 11 H 1S -0.03410 0.15654 0.21794 0.15363 -0.07199 154 2S -0.07314 0.27557 0.37261 0.24308 -0.08456 155 12 H 1S -0.02858 0.25524 -0.19733 0.07420 -0.01370 156 2S -0.05841 0.46140 -0.37208 0.13721 -0.01751 157 13 H 1S 0.07148 -0.25814 0.00557 -0.08126 0.02343 158 2S 0.13583 -0.47270 0.01402 -0.13291 0.05394 159 14 H 1S -0.05054 0.01581 0.19336 0.03934 -0.03792 160 2S -0.09978 0.00124 0.33964 0.05009 -0.06594 161 15 H 1S -0.01414 0.31745 -0.18402 0.14008 -0.04567 162 2S -0.03190 0.63005 -0.34397 0.20407 -0.08535 163 16 C 1S 0.00031 -0.00277 -0.00012 -0.00537 0.00164 164 2S 0.01371 -0.07819 -0.01169 -0.11175 0.04322 165 2PX 0.04491 -0.00879 0.04195 0.03321 -0.04458 166 2PY -0.00555 -0.02594 -0.02074 0.04034 0.01684 167 2PZ -0.00358 -0.00998 -0.01631 0.02439 0.00801 168 3S 0.06422 0.04017 -0.11996 0.49088 -0.11004 169 3PX -0.43251 -0.63107 -0.31270 -0.73798 0.54087 170 3PY 0.16180 -0.45571 0.29087 -0.95826 -0.16251 171 3PZ 0.09379 -0.31227 0.18624 -0.57904 -0.09948 172 4XX 0.00378 0.00697 0.00132 -0.00452 -0.00535 173 4YY 0.02661 0.10771 0.00599 0.07817 -0.01994 174 4ZZ -0.02525 -0.11983 -0.00282 -0.08705 0.01854 175 4XY 0.01469 -0.01225 0.00448 -0.02833 -0.00832 176 4XZ -0.02881 0.02368 -0.00450 0.03332 -0.00382 177 4YZ -0.03096 -0.02924 0.00770 -0.01684 0.00587 178 17 C 1S -0.00118 0.00927 -0.00067 0.00636 -0.00114 179 2S -0.00483 0.05913 -0.06141 0.00335 -0.01322 180 2PX -0.03615 0.08600 -0.01670 0.03594 0.03040 181 2PY 0.05411 0.03358 0.01214 0.04508 0.00326 182 2PZ -0.08640 -0.04118 -0.00213 -0.00404 0.00507 183 3S -0.00153 -0.82850 0.23041 -0.61943 0.15012 184 3PX 0.33189 -0.73230 0.35170 -0.28424 -0.35590 185 3PY -0.00416 -0.48122 0.11182 -0.94135 -0.03006 186 3PZ 0.05233 -0.18170 0.04779 -0.47701 0.00804 187 4XX 0.01625 0.02060 0.02297 0.02757 -0.00624 188 4YY -0.05072 -0.06611 -0.00635 -0.05015 0.01468 189 4ZZ 0.03639 0.04104 -0.01252 0.01829 -0.00708 190 4XY -0.19656 -0.04457 0.00955 -0.01347 0.01013 191 4XZ 0.38421 0.07078 0.04317 0.07230 -0.03064 192 4YZ 0.03120 0.07967 0.00375 0.06770 -0.01200 193 18 C 1S -0.00115 -0.00570 -0.00156 -0.00090 0.00218 194 2S -0.02874 -0.13302 -0.02263 -0.02483 0.05327 195 2PX 0.01791 -0.02063 0.02266 -0.03198 -0.02258 196 2PY 0.04816 -0.04502 -0.00655 -0.01891 0.01551 197 2PZ -0.11988 0.00080 -0.01420 -0.00130 0.01217 198 3S 0.04639 0.46080 0.06196 -0.14295 -0.11385 199 3PX 0.02707 0.08239 0.00199 0.42397 -0.01390 200 3PY 0.06294 0.59862 0.03096 0.24734 -0.10022 201 3PZ 0.07539 0.30573 0.02124 0.12690 -0.06569 202 4XX -0.00474 -0.01091 -0.00526 -0.00398 0.00383 203 4YY -0.33945 0.03463 -0.01974 0.02502 0.00740 204 4ZZ 0.34669 -0.03452 0.02621 -0.02237 -0.00938 205 4XY 0.00252 0.01582 0.01395 0.02283 -0.00992 206 4XZ 0.03354 -0.06618 0.00044 -0.03213 0.01089 207 4YZ 0.25251 -0.00469 0.01789 0.01675 -0.00495 208 19 C 1S 0.00285 -0.00149 0.00327 -0.00165 -0.00312 209 2S 0.06230 -0.02649 0.08668 -0.04997 -0.07016 210 2PX -0.02201 0.04544 -0.03368 0.03448 0.01995 211 2PY 0.00020 0.04218 0.00111 0.00702 -0.00542 212 2PZ 0.00102 0.04760 0.00508 0.02087 -0.00773 213 3S -0.27870 0.15985 -0.34931 0.05523 0.29485 214 3PX 0.24245 -0.08128 0.29802 -0.01287 -0.24333 215 3PY -0.16211 0.00159 -0.21546 0.16132 0.18019 216 3PZ -0.09031 0.00423 -0.12385 0.08069 0.10700 217 4XX -0.00578 -0.01053 0.00470 0.00237 -0.00123 218 4YY 0.08705 0.02725 0.00920 0.01340 -0.00212 219 4ZZ -0.07943 -0.02099 -0.01273 -0.02158 0.00296 220 4XY 0.05133 -0.05945 0.00251 -0.04022 0.00484 221 4XZ -0.08916 0.09216 0.00380 0.05170 -0.01439 222 4YZ -0.07172 0.02414 -0.00754 0.01029 -0.00505 223 20 C 1S -0.00346 0.01053 -0.00353 0.00485 0.00171 224 2S -0.05731 0.18663 -0.07802 0.10761 0.04428 225 2PX 0.01565 -0.01564 0.03111 -0.01797 -0.02345 226 2PY -0.07051 -0.02698 -0.01379 -0.01256 0.01209 227 2PZ 0.10225 -0.01996 0.00275 -0.00891 0.00679 228 3S 0.33385 -1.24285 0.25844 -0.56262 -0.07940 229 3PX -0.28859 0.97233 -0.33728 0.43718 0.16543 230 3PY -0.02053 0.08151 -0.13728 0.14113 0.10685 231 3PZ -0.04869 0.00361 -0.07245 0.05908 0.05698 232 4XX 0.00741 0.00016 -0.00008 0.00451 0.00173 233 4YY -0.09378 0.00588 -0.01433 -0.00265 0.00207 234 4ZZ 0.08649 -0.00933 0.01205 -0.00560 -0.00242 235 4XY -0.20420 0.01446 -0.01002 0.00167 -0.00371 236 4XZ 0.38071 0.02270 0.03230 0.00964 -0.01209 237 4YZ 0.06815 0.03065 0.00369 0.02006 -0.00170 238 21 C 1S -0.00008 -0.00990 0.00023 -0.00676 0.00061 239 2S 0.00965 -0.16431 0.02274 -0.04642 -0.00113 240 2PX -0.01166 -0.03608 -0.04083 -0.04096 0.03758 241 2PY -0.05699 0.07424 -0.00478 0.02321 -0.00461 242 2PZ 0.08388 0.05417 0.00543 0.01609 -0.00884 243 3S -0.01223 1.42846 -0.08104 0.94733 -0.17916 244 3PX -0.12113 0.15450 0.11018 -0.19022 -0.07415 245 3PY 0.05659 -1.06559 -0.04607 -0.33971 0.17232 246 3PZ -0.03352 -0.57505 -0.03531 -0.16980 0.09934 247 4XX -0.00082 0.00166 0.00015 0.00786 -0.00411 248 4YY -0.31036 0.02068 -0.02071 0.01619 0.00701 249 4ZZ 0.31148 -0.02155 0.02137 -0.02594 -0.00400 250 4XY 0.02064 -0.00937 0.00384 -0.00491 -0.00237 251 4XZ -0.00939 0.04494 0.00566 0.01412 -0.01456 252 4YZ 0.21512 0.02998 0.01546 0.00463 -0.00833 253 22 H 1S 0.00231 0.13495 0.02278 0.01126 -0.03383 254 2S 0.00829 0.28640 0.00993 0.07669 -0.04138 255 23 H 1S 0.04350 -0.12095 0.06018 -0.05831 -0.03469 256 2S 0.07833 -0.24483 0.11144 -0.12515 -0.06465 257 24 H 1S -0.04241 -0.00697 -0.05776 0.01117 0.04778 258 2S -0.08242 -0.01517 -0.11458 0.01796 0.09529 259 25 H 1S 0.01678 0.10876 -0.00806 0.05698 -0.01734 260 2S 0.03114 0.19986 0.01062 0.12871 -0.02471 261 26 H 1S 0.05050 -0.05174 0.09860 0.02886 -0.05141 262 2S 0.15051 -0.39129 0.11234 -0.50185 -0.23489 263 27 H 1S 0.00009 -0.06309 0.07986 -0.04368 -0.01270 264 2S -0.02459 -0.19224 0.09718 -0.23005 -0.02046 186 187 188 189 190 V V V V V Eigenvalues -- 1.53128 1.54604 1.58914 1.67875 1.69164 1 1 C 1S -0.02356 0.01543 0.03258 0.00659 0.00567 2 2S -0.85345 0.20594 0.49758 -0.04402 0.06456 3 2PX 0.29907 -0.07944 -0.12979 0.06199 -0.11935 4 2PY 0.11221 -0.00505 -0.09780 -0.03161 0.09744 5 2PZ 0.15895 0.04588 -0.05633 -0.05325 0.04641 6 3S 2.93804 -3.00880 -3.45008 -1.09436 0.02317 7 3PX -1.21288 1.29561 1.63452 0.16559 0.37238 8 3PY -2.66032 0.77942 1.30559 0.55128 -1.29918 9 3PZ -1.98584 0.19264 0.85753 0.87800 -0.65789 10 4XX -0.02345 -0.00303 0.05077 0.02866 -0.32957 11 4YY 0.01206 0.00894 -0.06345 0.20989 0.18760 12 4ZZ 0.01106 -0.00238 -0.02664 -0.23050 0.16853 13 4XY -0.08602 0.00789 -0.05215 0.30737 -0.18234 14 4XZ 0.12789 0.06290 0.03562 -0.43329 -0.17624 15 4YZ 0.02069 -0.03470 0.12656 -0.15534 -0.01575 16 2 C 1S -0.03968 -0.10033 -0.10437 -0.02270 -0.02370 17 2S -0.44508 -1.41499 -1.30700 -0.50111 -0.15719 18 2PX -0.27982 0.04350 0.06077 -0.09278 0.12478 19 2PY -0.10822 -0.14834 0.07821 -0.05509 0.01496 20 2PZ -0.05309 0.01908 0.02588 0.19824 0.04975 21 3S 1.15263 6.18706 5.34666 1.61899 -0.00563 22 3PX -0.52809 0.31990 0.57307 0.75748 0.38416 23 3PY 0.39955 -0.04238 -0.73794 -0.07329 0.73179 24 3PZ 0.61352 -0.42603 -0.36490 -2.56735 -0.20081 25 4XX -0.00367 -0.02149 -0.01110 -0.02198 -0.23308 26 4YY -0.10716 0.04572 0.00847 -0.15531 -0.02681 27 4ZZ 0.03656 -0.06982 -0.09323 0.19092 0.29234 28 4XY 0.20867 0.03381 0.04361 -0.22079 0.14724 29 4XZ -0.01612 0.02800 -0.00565 0.38141 0.21240 30 4YZ -0.02036 -0.16503 0.09305 0.11957 -0.07933 31 3 H 1S -0.26757 -0.37737 -0.34008 0.34892 -0.04847 32 2S -0.41190 -0.28647 -0.32352 0.70840 0.09632 33 4 Br 1S -0.00941 0.04235 -0.03814 -0.00161 -0.00353 34 2S 0.05098 -0.21090 0.18690 0.00050 0.01454 35 3S -0.03453 0.09531 -0.07289 0.02164 0.00196 36 4S -0.18612 0.86063 -0.79534 -0.04629 -0.07630 37 5S 0.43160 1.01152 -0.34932 0.03245 0.06355 38 6S -0.32195 -5.89084 3.65973 -0.27687 0.04267 39 7PX -0.00250 0.00186 -0.00260 -0.00493 -0.00146 40 7PY -0.00361 0.00037 0.01886 0.01604 0.00546 41 7PZ -0.00288 -0.00681 -0.00838 -0.00824 -0.00433 42 8PX 0.00769 -0.00606 0.00895 0.01634 0.00489 43 8PY 0.01222 -0.00070 -0.06273 -0.05330 -0.01764 44 8PZ 0.00938 0.02193 0.02786 0.02777 0.01428 45 9PX 0.00049 0.02501 -0.05526 -0.05940 -0.02559 46 9PY -0.08371 -0.06412 0.26415 0.21639 0.04924 47 9PZ -0.01836 -0.03392 -0.10902 -0.13290 -0.05299 48 10PX -0.12170 -0.11539 0.09801 -0.10265 0.03153 49 10PY 0.36963 0.90412 -0.05498 0.32637 0.15655 50 10PZ -0.19826 -0.56613 -0.07202 -0.08812 -0.08213 51 11XX 0.01107 -0.06249 0.00615 -0.02384 -0.01720 52 11YY 0.02020 0.00496 0.01698 0.01136 0.01397 53 11ZZ 0.00689 -0.01771 0.02974 -0.02306 -0.00625 54 11XY -0.03059 -0.00496 0.01150 -0.00997 -0.00516 55 11XZ 0.00461 0.00733 -0.00857 0.00039 -0.00579 56 11YZ -0.01424 -0.04370 -0.00404 0.00166 -0.00957 57 12XX -0.12973 2.13550 -1.45855 -0.03022 -0.02979 58 12YY -0.20504 1.56417 -1.65261 -0.38849 -0.25561 59 12ZZ -0.14153 1.76919 -1.65305 -0.05971 -0.13326 60 12XY 0.19333 0.05338 -0.05238 0.12165 0.03774 61 12XZ -0.03420 -0.05795 0.04043 -0.03766 0.03175 62 12YZ 0.13546 0.40611 0.11335 0.09575 0.09597 63 5 C 1S 0.02532 -0.00169 0.00199 0.00520 0.00223 64 2S 0.49170 -0.14817 -0.32523 0.24899 -0.17528 65 2PX 0.26635 0.08234 -0.03210 0.14126 -0.07935 66 2PY 0.15563 0.08472 0.01020 0.14011 -0.07603 67 2PZ 0.10695 0.01040 -0.04408 -0.19605 -0.10075 68 3S -0.55073 -0.07019 0.46687 -1.48304 0.50496 69 3PX -1.28110 -1.26442 -0.93845 -1.18914 0.35533 70 3PY -1.16062 -1.95089 -1.71702 -1.52463 0.48541 71 3PZ -1.48627 -0.51820 -0.10778 4.11831 1.26182 72 4XX -0.28264 -0.09301 -0.01419 -0.18356 -0.02479 73 4YY 0.28243 -0.04151 -0.11246 0.11585 0.03437 74 4ZZ 0.00601 0.09748 0.08208 0.02907 0.01001 75 4XY -0.03840 0.00836 0.20224 -0.03151 0.03558 76 4XZ 0.04845 0.02085 0.01020 -0.05820 -0.03608 77 4YZ 0.02841 -0.01726 -0.02707 -0.02466 -0.06743 78 6 C 1S 0.01844 0.01015 0.00341 -0.02971 -0.00573 79 2S 0.36429 0.09818 0.06903 -0.24702 0.03450 80 2PX 0.03558 0.00711 0.06700 0.05577 0.03894 81 2PY -0.06108 -0.04807 0.06713 0.06893 0.03946 82 2PZ -0.03882 -0.09455 0.03859 0.04451 0.05372 83 3S -2.19743 -1.40993 -0.48490 3.74829 0.80745 84 3PX 0.47661 0.36465 0.07236 0.43472 -0.11743 85 3PY 0.96377 0.95450 0.35645 0.48168 -0.17028 86 3PZ -0.76482 -0.37485 -0.95941 1.75262 0.45357 87 4XX -0.08473 -0.16385 -0.12944 -0.05179 -0.01184 88 4YY 0.04283 0.11931 0.00615 -0.02846 0.02484 89 4ZZ 0.01589 -0.00152 0.09542 0.08285 -0.01604 90 4XY 0.00950 0.01478 0.16156 -0.04673 -0.00751 91 4XZ 0.05970 0.04571 -0.06231 0.11661 0.04818 92 4YZ -0.04186 0.02398 0.01195 -0.05098 -0.04021 93 7 C 1S -0.00896 -0.00446 -0.00386 0.01304 0.00041 94 2S -0.05643 -0.04128 -0.03958 0.31158 0.01148 95 2PX 0.03654 0.00448 0.02135 0.04283 -0.01648 96 2PY 0.07093 0.06182 0.02361 0.07167 -0.02657 97 2PZ 0.01455 0.01253 -0.02063 0.05533 0.00477 98 3S 1.03755 0.95240 0.39258 -0.98499 -0.17161 99 3PX 0.22034 0.19860 -0.07890 -0.12130 0.01983 100 3PY 0.31727 0.21670 -0.15792 -0.09638 -0.00042 101 3PZ 0.28584 0.07108 0.31717 -1.32339 -0.11268 102 4XX -0.02881 0.02701 -0.10117 -0.06219 0.00767 103 4YY 0.04089 -0.07341 -0.03539 -0.01825 -0.00576 104 4ZZ -0.01992 0.01906 0.09430 0.05919 -0.00396 105 4XY 0.01888 0.14737 0.13836 0.03857 0.00128 106 4XZ 0.04031 0.07396 0.00411 -0.02403 0.00888 107 4YZ -0.00543 -0.03038 0.00629 -0.07124 0.01013 108 8 C 1S -0.00191 0.00056 -0.00030 -0.00669 0.00146 109 2S -0.06457 0.00981 -0.00578 -0.11745 0.03374 110 2PX -0.01048 0.01742 -0.00124 -0.00246 0.00988 111 2PY -0.03822 -0.01765 -0.01435 0.00049 0.00954 112 2PZ 0.02483 0.02396 0.01705 -0.04136 -0.02524 113 3S 0.10960 -0.24131 -0.45376 0.78233 -0.15702 114 3PX 0.12156 -0.04184 -0.14990 0.24349 -0.07759 115 3PY 0.24608 -0.03977 -0.23964 0.40476 -0.09555 116 3PZ 0.02400 -0.17273 -0.09308 -0.07692 -0.09686 117 4XX -0.03058 -0.09486 -0.09098 -0.04335 -0.01767 118 4YY -0.00240 0.03105 -0.00495 0.03634 0.01266 119 4ZZ 0.01558 0.04075 0.05073 -0.00544 0.00367 120 4XY -0.00634 0.06203 0.13547 0.04826 -0.00905 121 4XZ -0.04216 -0.00377 0.02692 -0.03915 0.01069 122 4YZ 0.05107 0.01640 -0.01014 -0.08236 0.00688 123 9 C 1S 0.00306 0.00222 -0.00251 -0.00665 -0.00304 124 2S 0.18634 0.02467 -0.04782 -0.22575 -0.07224 125 2PX 0.08136 0.03110 -0.01931 -0.02934 -0.00952 126 2PY 0.08590 0.03134 0.01959 -0.06090 -0.01848 127 2PZ -0.00191 0.03766 0.02764 0.01494 0.01561 128 3S -0.02091 0.15680 0.19655 0.50787 -0.03000 129 3PX -0.16767 -0.17429 -0.06938 0.17648 0.00270 130 3PY -0.28815 -0.25145 -0.19010 0.37669 0.01590 131 3PZ 0.33065 -0.13226 -0.20164 -0.26044 -0.29035 132 4XX -0.06320 -0.05636 -0.03834 -0.02863 -0.00632 133 4YY 0.03453 -0.01148 -0.07450 0.06787 -0.00898 134 4ZZ 0.03029 0.05067 0.07359 -0.06616 0.01502 135 4XY -0.01402 0.09380 0.17296 0.07178 -0.01350 136 4XZ 0.04430 0.04219 -0.02351 0.00604 0.00103 137 4YZ -0.00587 -0.05219 -0.01908 0.02485 0.00073 138 10 C 1S -0.01107 0.00186 0.00371 0.02192 0.00356 139 2S -0.04159 0.03554 0.00651 0.06092 0.03700 140 2PX 0.00590 0.02837 0.05062 -0.10946 -0.00679 141 2PY 0.02677 0.07255 0.04091 -0.14209 -0.01859 142 2PZ 0.03569 0.05770 0.09612 0.06292 0.04346 143 3S 0.58021 -0.59686 -0.84500 -3.17416 -0.55369 144 3PX 0.44403 -0.09406 -0.34288 -0.21344 -0.30664 145 3PY 0.53784 -0.21493 -0.37983 -0.64200 -0.49713 146 3PZ 0.22615 0.63568 0.56637 1.09039 -0.07985 147 4XX 0.03647 -0.09093 -0.19203 -0.02846 -0.03625 148 4YY -0.10061 0.02576 0.06463 0.04539 -0.01775 149 4ZZ 0.03053 0.05207 0.09310 -0.05268 0.02607 150 4XY 0.05840 0.07208 0.09381 0.12993 0.01654 151 4XZ -0.18765 0.00913 0.06889 -0.00471 -0.02806 152 4YZ 0.06952 0.00659 -0.00591 0.09122 -0.01554 153 11 H 1S -0.14435 -0.09514 -0.09447 0.01807 0.06636 154 2S -0.18929 -0.14921 -0.08275 -0.07453 0.16385 155 12 H 1S -0.09406 -0.08916 -0.07548 0.06592 0.04983 156 2S -0.16290 -0.10061 -0.09032 0.08167 0.07182 157 13 H 1S 0.06267 -0.02012 -0.06926 0.02737 -0.02025 158 2S 0.09810 -0.04280 -0.13471 0.08485 -0.04428 159 14 H 1S 0.00440 -0.05195 -0.04250 -0.19304 -0.01011 160 2S 0.03009 -0.08715 0.00314 -0.36215 -0.01797 161 15 H 1S -0.15842 -0.17257 -0.16273 -0.10985 0.03100 162 2S -0.22319 0.00854 -0.49012 0.04903 0.15591 163 16 C 1S 0.02197 -0.00754 -0.01482 0.00070 0.00745 164 2S 0.41142 -0.24125 -0.24760 0.08415 0.16028 165 2PX -0.37783 0.12800 0.11438 -0.05137 -0.11159 166 2PY -0.08225 -0.07776 -0.03011 0.01684 -0.22449 167 2PZ -0.09320 -0.04134 -0.05512 0.05078 -0.11109 168 3S -3.02403 0.75924 1.10398 -0.37302 -0.62942 169 3PX 4.91494 -1.75494 -2.01829 -0.61115 2.18716 170 3PY 1.91557 0.39208 0.06855 0.48686 1.10014 171 3PZ 1.20329 0.34142 0.13359 0.17265 0.55677 172 4XX 0.01084 0.00200 -0.01583 -0.04575 0.20552 173 4YY -0.04472 -0.01138 0.02236 0.06895 -0.24324 174 4ZZ 0.02307 0.04056 -0.04341 -0.03136 0.06580 175 4XY 0.06833 0.07462 -0.00808 0.03380 -0.15570 176 4XZ -0.08997 -0.02497 -0.02627 0.00722 -0.09602 177 4YZ 0.12408 -0.00787 0.02597 0.06193 -0.24770 178 17 C 1S -0.02100 0.00631 0.00301 -0.00212 -0.00873 179 2S -0.17573 0.13418 0.05455 -0.09855 0.21793 180 2PX -0.08738 0.00102 -0.01428 0.03122 -0.00420 181 2PY -0.07196 -0.00108 -0.05236 -0.09807 0.21016 182 2PZ -0.02229 -0.00407 -0.03397 -0.05069 0.12784 183 3S 2.56396 -0.77236 -0.59361 0.42174 0.89247 184 3PX -0.39412 0.46704 0.55877 0.23544 -0.57960 185 3PY 2.39186 -0.07318 -0.12798 0.57600 0.53422 186 3PZ 1.23553 -0.05329 -0.11636 0.30151 0.25875 187 4XX -0.03361 -0.01137 -0.02007 -0.03462 0.11379 188 4YY 0.06032 -0.00451 -0.03530 0.11078 -0.12565 189 4ZZ -0.03972 0.00524 0.02658 -0.09859 0.08618 190 4XY 0.00618 -0.01570 -0.01256 0.02540 -0.02320 191 4XZ -0.06208 -0.03656 0.04098 -0.04820 -0.02078 192 4YZ 0.02338 -0.00980 0.02463 -0.03759 -0.25395 193 18 C 1S 0.00771 -0.00626 -0.00270 0.00273 0.00498 194 2S 0.19415 -0.17298 -0.03767 0.03053 0.23150 195 2PX 0.00165 0.06017 0.00924 -0.00419 0.03647 196 2PY 0.06807 -0.05506 0.00087 0.02130 0.06318 197 2PZ 0.04489 -0.02413 0.00181 -0.00761 0.02271 198 3S 0.09950 0.32816 -0.22812 -0.41539 0.08233 199 3PX -1.05844 -0.07916 -0.04202 -0.41464 -0.32867 200 3PY -0.82430 0.44960 -0.00885 -0.35039 -0.16428 201 3PZ -0.41080 0.23697 0.01711 -0.17961 -0.05837 202 4XX 0.05410 -0.01663 0.00507 0.02834 -0.15136 203 4YY -0.01165 0.00324 -0.01511 -0.05512 0.05305 204 4ZZ -0.06040 0.00813 0.00709 0.01333 0.14950 205 4XY 0.01287 -0.02563 0.00350 0.01456 -0.09949 206 4XZ 0.01260 -0.00123 -0.02237 -0.00965 -0.05868 207 4YZ 0.00953 -0.01937 -0.00727 0.00533 -0.05879 208 19 C 1S -0.00257 0.00442 -0.00112 -0.00658 0.00316 209 2S -0.03134 0.09887 -0.00519 -0.10121 0.12906 210 2PX -0.03752 -0.00451 0.01721 0.02169 -0.10371 211 2PY -0.01206 0.03661 0.02157 0.03017 -0.07392 212 2PZ -0.01234 0.01260 0.01923 0.01151 -0.03708 213 3S 0.50449 -0.37887 0.16880 0.95983 -0.36303 214 3PX -0.39714 0.24502 -0.12528 -0.50284 -0.07913 215 3PY -0.25787 -0.33352 -0.02271 0.15615 -0.03162 216 3PZ -0.13132 -0.18097 -0.02316 0.11059 -0.01956 217 4XX 0.06421 -0.02095 -0.00195 0.01861 -0.17124 218 4YY -0.03593 0.00397 -0.00115 0.00384 0.06241 219 4ZZ -0.03914 0.02151 0.00177 -0.02135 0.14836 220 4XY 0.01745 -0.00002 -0.01513 0.04172 -0.04898 221 4XZ -0.00504 -0.00844 0.02223 -0.03562 -0.03225 222 4YZ 0.04673 0.02633 0.01206 -0.00082 -0.06987 223 20 C 1S -0.00511 0.00408 0.00481 0.00793 -0.00199 224 2S -0.15280 0.01414 0.04702 0.08633 0.02951 225 2PX 0.00995 0.05609 0.03808 0.01721 -0.06683 226 2PY 0.05399 -0.02890 -0.00931 -0.01960 0.10408 227 2PZ 0.02842 -0.01919 -0.01546 -0.01236 0.05408 228 3S 0.83898 -0.83250 -1.01531 -1.03593 0.29644 229 3PX -0.38497 0.29277 0.47279 0.69941 -0.29640 230 3PY -0.32358 -0.32465 -0.18630 0.11565 -0.46514 231 3PZ -0.16470 -0.18505 -0.09574 0.06483 -0.23373 232 4XX 0.06301 -0.00670 0.00564 0.01147 -0.08235 233 4YY -0.00278 0.01680 -0.00922 -0.02392 0.02313 234 4ZZ -0.07254 -0.00966 -0.00243 -0.00683 0.11544 235 4XY -0.02021 0.03171 0.02577 -0.00970 0.11099 236 4XZ -0.01136 0.02839 0.00270 -0.02593 0.05307 237 4YZ 0.03234 -0.00595 0.00541 0.02560 -0.07158 238 21 C 1S 0.01922 -0.00542 -0.00700 -0.00806 0.01977 239 2S 0.06795 -0.07666 -0.00765 -0.13308 0.16701 240 2PX 0.13673 -0.10985 -0.11872 -0.01258 0.12282 241 2PY -0.01116 0.04269 0.03442 0.02454 -0.01225 242 2PZ 0.00713 0.04407 0.03700 0.01356 -0.00729 243 3S -3.18045 1.30508 1.41120 1.01976 -1.77762 244 3PX 1.22761 0.51452 0.33612 0.07750 0.80681 245 3PY 1.02611 -1.08874 -0.95472 -0.74214 0.55225 246 3PZ 0.48426 -0.63426 -0.57880 -0.42124 0.26673 247 4XX -0.00289 0.01595 0.00914 0.01104 -0.06801 248 4YY -0.01605 -0.03133 0.01836 0.02342 0.04724 249 4ZZ 0.00055 0.02928 -0.01478 -0.03148 0.07519 250 4XY -0.06115 0.02067 0.00388 -0.02413 0.15901 251 4XZ 0.01246 0.05093 0.04349 -0.04912 0.09516 252 4YZ 0.10869 0.04479 0.04390 0.00079 -0.03367 253 22 H 1S -0.06897 0.18719 0.08146 0.08729 -0.08709 254 2S -0.32171 0.23575 0.28039 0.22670 -0.16823 255 23 H 1S -0.00683 0.01519 -0.01146 -0.05808 0.05552 256 2S 0.05931 0.02544 -0.04618 -0.16963 0.15646 257 24 H 1S -0.01896 -0.07079 -0.00455 0.03548 0.05574 258 2S -0.00766 -0.13397 -0.00366 0.09451 0.08081 259 25 H 1S -0.19453 0.09498 0.04188 -0.02263 -0.06886 260 2S -0.38817 0.13209 -0.01252 -0.13129 -0.03873 261 26 H 1S -0.28218 0.10279 0.07093 0.06277 -0.20495 262 2S 0.52688 0.38043 0.35068 0.21058 -0.09411 263 27 H 1S 0.44325 -0.10234 -0.10518 -0.08484 0.20601 264 2S 1.05768 0.07525 -0.51292 -0.27678 0.50663 191 192 193 194 195 V V V V V Eigenvalues -- 1.73611 1.75552 1.79338 1.80496 1.81904 1 1 C 1S 0.00058 -0.00457 -0.00542 0.00477 -0.01161 2 2S -0.00081 0.21848 -0.13366 -0.06742 -0.20908 3 2PX 0.18384 -0.03849 0.00194 0.06511 -0.09572 4 2PY -0.03184 0.02308 0.05890 -0.05223 0.10546 5 2PZ 0.00422 -0.01309 0.01160 0.00107 0.04452 6 3S 0.04704 -1.38852 0.17717 -0.88000 0.00631 7 3PX -0.09661 -1.88003 -0.47030 0.71090 -0.86842 8 3PY 0.36585 0.30493 0.10658 0.88055 -0.18066 9 3PZ 0.11181 0.36448 0.11672 0.59809 0.25207 10 4XX -0.06255 -0.07839 0.03780 0.21437 -0.03221 11 4YY 0.04214 0.16548 0.13419 -0.04926 0.33168 12 4ZZ 0.08718 -0.12031 -0.20002 -0.18973 -0.31100 13 4XY 0.23870 -0.03286 0.02893 0.13232 -0.00552 14 4XZ 0.17951 -0.04882 0.01631 0.09295 0.01921 15 4YZ 0.01392 0.19241 0.04129 0.02957 -0.03681 16 2 C 1S -0.03412 0.03382 0.02206 -0.00629 0.04950 17 2S -0.05978 0.19529 0.05959 -0.60406 0.80746 18 2PX -0.10232 0.12470 0.02165 -0.09107 -0.02791 19 2PY -0.10844 0.16259 0.16113 0.13506 -0.03153 20 2PZ -0.02251 0.05605 0.00351 0.11269 -0.00556 21 3S 1.17581 -2.15852 -0.83520 1.32573 -2.77216 22 3PX -0.04857 -0.61519 -0.15775 0.84883 0.01488 23 3PY -0.14880 -0.33569 -0.52593 -0.54282 0.23523 24 3PZ 0.03804 -0.31277 0.28980 -0.71131 0.09067 25 4XX 0.03399 -0.10485 0.08981 0.20371 -0.02155 26 4YY 0.02633 0.04211 0.19647 0.01509 0.14987 27 4ZZ -0.05292 0.07476 -0.30191 -0.21032 -0.16266 28 4XY -0.32105 0.16745 0.04634 -0.10955 0.01727 29 4XZ -0.20452 0.07439 -0.15023 -0.04528 -0.18665 30 4YZ -0.08589 0.09323 0.10419 0.26296 0.08699 31 3 H 1S -0.19948 0.17986 0.13397 0.05434 0.20687 32 2S -0.07586 0.17634 0.03942 0.20975 0.19254 33 4 Br 1S -0.01025 0.00532 0.00342 0.00324 0.00585 34 2S 0.05075 -0.02781 -0.01292 -0.01497 -0.02752 35 3S -0.02125 0.01557 -0.00641 0.00473 0.00692 36 4S -0.21571 0.11151 0.07913 0.06292 0.12806 37 5S 0.03045 -0.12626 0.07864 -0.13098 -0.13405 38 6S 0.73351 -0.06411 -0.32897 -0.03585 -0.08844 39 7PX -0.00082 -0.00025 0.00093 -0.00079 0.00130 40 7PY 0.00645 -0.00268 -0.00851 0.00128 -0.00769 41 7PZ -0.00248 0.00331 0.00482 0.00088 0.00642 42 8PX 0.00258 0.00091 -0.00305 0.00257 -0.00439 43 8PY -0.02103 0.00871 0.02822 -0.00513 0.02511 44 8PZ 0.00780 -0.01069 -0.01592 -0.00243 -0.02114 45 9PX -0.00063 -0.01002 0.00849 -0.00252 0.01918 46 9PY 0.06757 -0.02224 -0.12087 0.05870 -0.07188 47 9PZ -0.00632 0.02491 0.05792 -0.01325 0.07180 48 10PX -0.05868 0.06785 0.04609 -0.09017 -0.00235 49 10PY 0.02992 -0.13021 -0.01000 -0.05725 -0.21883 50 10PZ -0.12418 0.15269 0.12498 0.06297 0.10312 51 11XX 0.00233 -0.00054 0.00811 0.00985 0.00957 52 11YY 0.00171 -0.00443 0.00691 -0.01056 -0.01493 53 11ZZ 0.01239 -0.01127 0.00011 0.00164 0.00340 54 11XY -0.00367 0.00716 0.00790 -0.00556 -0.00077 55 11XZ 0.00341 -0.00084 0.00234 0.00542 0.00550 56 11YZ -0.01238 0.01303 0.00870 0.01259 0.00930 57 12XX -0.36326 0.10971 0.16943 0.00740 0.12333 58 12YY -0.38033 0.16670 0.21369 0.08803 0.33923 59 12ZZ -0.43231 0.21361 0.25851 0.07048 0.19897 60 12XY 0.03386 -0.05381 -0.06084 0.05768 -0.00762 61 12XZ -0.03158 0.01550 -0.00248 -0.04706 -0.02318 62 12YZ 0.09818 -0.11602 -0.10151 -0.06394 -0.11966 63 5 C 1S -0.00753 0.00645 0.00503 0.01158 -0.02043 64 2S 0.14459 -0.05361 -0.05643 0.20475 -0.35722 65 2PX 0.07575 -0.10666 -0.10320 -0.00128 -0.02035 66 2PY 0.18495 -0.09882 -0.16806 0.00551 -0.00162 67 2PZ 0.11514 -0.10978 0.27849 -0.23979 -0.07248 68 3S 0.08703 -1.18540 -0.37747 -1.47456 1.80598 69 3PX -0.67269 0.80534 0.32123 -0.22123 0.10083 70 3PY -0.95683 0.91435 0.94163 0.12551 0.45152 71 3PZ -1.02302 1.13240 -1.52977 1.69642 -0.11637 72 4XX -0.02599 0.05521 -0.06632 0.01993 -0.17128 73 4YY -0.12329 0.07734 0.04666 0.27197 0.00377 74 4ZZ 0.16697 -0.14313 0.01399 -0.28466 0.10550 75 4XY -0.21534 0.15438 0.02873 0.05348 0.06944 76 4XZ -0.04863 0.02520 0.16209 -0.05021 -0.06853 77 4YZ -0.04513 0.02671 0.29687 0.01457 -0.07744 78 6 C 1S 0.00938 -0.01651 0.00351 -0.01519 0.00069 79 2S -0.06206 -0.14519 0.08118 -0.04966 -0.20388 80 2PX -0.07188 0.01248 -0.07286 0.07848 -0.00789 81 2PY -0.04868 0.04045 -0.10254 0.12014 0.08858 82 2PZ -0.05958 0.04775 -0.12873 0.11950 -0.00706 83 3S -1.28060 2.26609 -0.66462 2.34825 -0.58135 84 3PX 0.32515 -0.32631 -0.16833 -0.08213 0.08406 85 3PY 0.37405 -0.60019 -0.34919 -0.33640 -0.15042 86 3PZ -0.56882 0.88089 -0.16285 0.77696 -0.38378 87 4XX 0.01219 0.04174 -0.10305 0.08138 -0.07617 88 4YY -0.00252 0.01626 -0.14342 0.11806 0.05786 89 4ZZ -0.02646 -0.01676 0.26027 -0.14150 -0.04848 90 4XY 0.00905 -0.00927 -0.06254 -0.00222 0.18063 91 4XZ 0.12814 -0.07667 0.04874 -0.04351 0.11672 92 4YZ 0.07996 -0.07601 -0.08941 -0.21105 0.03855 93 7 C 1S -0.00337 0.01275 -0.00238 0.01263 -0.01403 94 2S -0.22587 0.30351 -0.02065 0.45434 -0.30437 95 2PX -0.02780 0.02190 0.09345 0.01114 -0.05171 96 2PY -0.04449 0.02235 0.13488 -0.01894 -0.09881 97 2PZ -0.03743 0.03610 -0.08221 0.09992 -0.02892 98 3S 1.08340 -1.95555 -0.36479 -1.78636 1.02503 99 3PX 0.13359 -0.23848 -0.20088 -0.20173 0.06195 100 3PY 0.20774 -0.27572 -0.28863 -0.15586 0.13819 101 3PZ 0.65536 -1.20722 0.03323 -1.33200 0.68844 102 4XX -0.03784 0.01559 -0.08479 0.03748 -0.12185 103 4YY 0.04012 -0.02153 -0.09264 0.00800 0.12057 104 4ZZ 0.00131 -0.00063 0.15388 -0.03616 -0.04476 105 4XY 0.01603 -0.03060 -0.06946 -0.04333 0.18745 106 4XZ -0.02564 0.01218 -0.10566 0.10791 0.04107 107 4YZ -0.01197 0.03356 -0.19807 0.17405 0.04582 108 8 C 1S 0.00737 -0.01433 -0.00715 -0.01200 0.00155 109 2S 0.04998 -0.16042 -0.04098 -0.06094 -0.05744 110 2PX -0.00474 0.00243 -0.01628 0.02114 -0.01773 111 2PY -0.00811 0.00244 -0.04631 0.04247 -0.01811 112 2PZ 0.02151 -0.01762 0.19875 -0.11355 -0.11017 113 3S -0.69299 1.70914 0.49708 1.43216 -1.02694 114 3PX -0.30686 0.61668 0.19142 0.53773 -0.40018 115 3PY -0.50379 1.00495 0.33268 0.87293 -0.67597 116 3PZ -0.08515 0.22771 -0.05258 0.28030 0.02012 117 4XX -0.05725 0.03769 -0.00374 0.06473 -0.21165 118 4YY 0.02343 0.01589 0.12690 0.00747 -0.07375 119 4ZZ 0.03106 -0.03177 -0.12798 -0.03009 0.20263 120 4XY 0.02298 -0.02617 0.05684 -0.08759 0.07568 121 4XZ -0.01506 0.01460 -0.13662 0.08633 0.04192 122 4YZ -0.01084 0.02638 -0.20316 0.17061 0.06819 123 9 C 1S -0.00143 0.01004 0.00257 0.00892 -0.01796 124 2S -0.12368 0.22735 0.18739 0.22631 -0.38863 125 2PX -0.02182 0.02698 -0.03065 0.06109 0.00619 126 2PY -0.04645 0.03673 -0.05682 0.09472 -0.02030 127 2PZ -0.02787 0.02209 -0.12145 0.09382 0.08770 128 3S 0.98934 -1.88772 -0.71357 -1.43172 1.60475 129 3PX 0.23013 -0.44860 -0.13745 -0.39181 0.36243 130 3PY 0.41943 -0.78275 -0.24174 -0.66676 0.71268 131 3PZ -0.08449 0.61047 0.62024 0.31703 -0.64861 132 4XX -0.03328 0.01026 0.03248 0.01155 -0.19008 133 4YY 0.03810 -0.02159 0.19819 -0.11385 -0.05119 134 4ZZ -0.00694 0.00798 -0.23741 0.11474 0.18372 135 4XY 0.03309 -0.02742 0.13702 -0.13036 0.05078 136 4XZ 0.01280 -0.01912 -0.04944 -0.05941 0.06668 137 4YZ 0.02732 -0.04147 -0.04262 -0.08129 0.09428 138 10 C 1S 0.00577 -0.00829 -0.01328 -0.00159 0.00133 139 2S -0.04004 -0.09407 -0.09627 0.06701 0.02345 140 2PX -0.03494 -0.00059 0.11845 -0.04620 -0.05252 141 2PY -0.02215 0.00371 0.20479 -0.07533 -0.06705 142 2PZ -0.01363 0.03215 -0.05644 0.00750 -0.02623 143 3S -0.47465 1.19418 1.74954 0.16386 -0.91460 144 3PX 0.39128 -0.44572 0.09378 -0.27561 0.40211 145 3PY 0.52796 -0.63547 0.05724 -0.56561 0.46394 146 3PZ 0.36867 -0.84511 -0.46815 -0.20586 0.54814 147 4XX 0.07399 -0.03630 0.03733 0.00090 -0.08127 148 4YY 0.05619 -0.05441 -0.01009 -0.13943 -0.00797 149 4ZZ -0.13522 0.12158 -0.01155 0.21186 0.01538 150 4XY 0.04840 -0.04475 0.04623 -0.10293 0.16542 151 4XZ -0.06988 0.05911 0.06640 -0.09323 -0.16646 152 4YZ 0.01054 0.01481 0.31140 0.01945 -0.09873 153 11 H 1S 0.07129 -0.01568 -0.12966 -0.09657 -0.00034 154 2S -0.19901 0.28804 -0.01512 0.13173 -0.21029 155 12 H 1S 0.00877 -0.08940 -0.11173 -0.10175 0.10670 156 2S 0.05630 -0.21900 -0.15666 -0.13989 0.19725 157 13 H 1S -0.06802 0.08913 0.01492 0.06075 -0.05085 158 2S -0.14270 0.27645 0.07953 0.27085 -0.21531 159 14 H 1S 0.06288 -0.10623 -0.01152 -0.17874 0.07203 160 2S 0.15210 -0.27601 -0.00940 -0.30024 0.12716 161 15 H 1S 0.08529 -0.05387 -0.05916 -0.15603 0.05691 162 2S -0.27348 0.25433 0.19468 0.11936 -0.11199 163 16 C 1S 0.00934 -0.01621 -0.00425 0.00274 0.00941 164 2S 0.25234 -0.52698 0.04355 0.21437 0.24541 165 2PX -0.26042 -0.04195 -0.05564 -0.06055 0.04508 166 2PY 0.02859 -0.26978 -0.07565 0.01502 -0.08318 167 2PZ 0.00106 -0.13118 -0.04624 0.00746 -0.05338 168 3S -1.17496 1.91838 0.11843 -0.91363 -1.95257 169 3PX -0.10829 -0.03920 0.08783 -1.31701 -0.91638 170 3PY 0.02089 2.65185 0.70921 -0.12083 1.94472 171 3PZ 0.10414 1.34520 0.21702 -0.16671 0.58410 172 4XX 0.14766 0.27496 0.04131 -0.06997 0.08772 173 4YY -0.11933 -0.08609 -0.01390 0.04648 0.01359 174 4ZZ 0.00933 -0.27857 -0.02916 0.04229 -0.15227 175 4XY 0.20617 0.11539 -0.08779 -0.01574 -0.12438 176 4XZ 0.07869 0.08025 -0.01554 0.02049 0.00640 177 4YZ -0.07967 0.11870 -0.05461 -0.03733 -0.00773 178 17 C 1S -0.00634 -0.02263 -0.00603 0.00278 -0.02846 179 2S -0.27486 -0.23566 0.03615 -0.08566 -0.27790 180 2PX 0.04400 -0.10881 -0.08472 -0.05183 0.01003 181 2PY 0.07232 0.12195 0.04126 -0.07300 0.04166 182 2PZ 0.03119 0.06922 0.00114 -0.05449 0.00626 183 3S 1.24885 1.95149 0.70238 0.41649 3.30913 184 3PX 0.30286 0.78347 0.56181 1.04237 1.31087 185 3PY 0.04773 0.52346 0.12449 0.12705 0.56747 186 3PZ 0.01597 0.28046 0.16526 0.11524 0.46679 187 4XX 0.03786 0.06333 0.06100 0.02096 0.11805 188 4YY -0.06431 -0.01080 -0.11371 -0.12282 -0.16342 189 4ZZ 0.02604 -0.13390 0.05574 0.10478 0.08876 190 4XY -0.20480 -0.09214 0.01471 -0.05509 0.04309 191 4XZ -0.12291 -0.04547 0.03207 0.00662 0.14324 192 4YZ -0.07554 0.13223 -0.06268 -0.08972 0.08071 193 18 C 1S 0.01300 -0.00758 0.00464 0.01353 0.01419 194 2S 0.17089 -0.12147 0.19462 0.31343 0.31402 195 2PX 0.12677 0.09678 0.02989 0.08051 -0.01065 196 2PY 0.00653 -0.03633 0.03149 0.06234 -0.00601 197 2PZ 0.00628 -0.02443 0.02793 0.03891 0.00452 198 3S -1.31481 -0.11659 -0.70044 -1.63067 -2.47604 199 3PX -0.33902 -0.07581 -0.08785 -0.37998 -0.21624 200 3PY -0.71666 -0.14324 -0.46516 -0.90599 -1.46331 201 3PZ -0.38656 -0.07535 -0.29265 -0.49943 -0.81841 202 4XX -0.00939 0.11794 -0.09084 -0.11082 -0.05872 203 4YY -0.00974 -0.02324 0.06597 0.02386 0.07805 204 4ZZ -0.00650 -0.16638 0.04570 0.11508 -0.05031 205 4XY -0.19449 -0.08912 -0.05772 -0.13055 0.03672 206 4XZ -0.10444 -0.05459 0.00563 -0.04556 0.08907 207 4YZ -0.00176 0.13421 0.00125 -0.07993 0.08827 208 19 C 1S -0.00949 -0.00272 -0.00238 -0.00684 -0.02192 209 2S -0.25140 -0.14424 0.04311 -0.03678 -0.25034 210 2PX -0.05945 -0.05054 -0.05193 -0.05482 0.02286 211 2PY -0.10637 -0.13169 -0.03358 -0.00839 -0.01571 212 2PZ -0.05578 -0.07139 -0.02004 -0.00337 -0.01121 213 3S 1.59425 -0.33748 0.29765 1.54247 2.44107 214 3PX -0.70495 0.34798 -0.14322 -0.78542 -1.11710 215 3PY 0.71405 -0.20594 0.12476 0.55858 0.78548 216 3PZ 0.40451 -0.11950 0.07533 0.31854 0.42981 217 4XX -0.18788 -0.02160 -0.06552 -0.17195 0.09141 218 4YY 0.14941 0.10062 0.05997 0.10639 0.01913 219 4ZZ 0.05224 -0.16808 0.02944 0.13059 -0.08623 220 4XY 0.00546 0.05612 -0.08553 -0.09247 -0.11313 221 4XZ 0.01188 0.02649 -0.02110 -0.01710 0.00538 222 4YZ 0.09521 0.22213 -0.02371 -0.04137 -0.03189 223 20 C 1S 0.01392 -0.01928 0.00123 0.02039 0.00991 224 2S 0.10222 -0.44895 0.04250 0.28493 0.25128 225 2PX -0.03732 0.09151 -0.00398 -0.02383 0.01231 226 2PY 0.08230 0.05253 0.03716 0.05444 -0.03495 227 2PZ 0.04467 0.03053 0.03187 0.03278 -0.00031 228 3S -1.31368 0.91670 -0.23355 -1.92787 -2.26805 229 3PX 0.89644 -0.86472 0.10348 1.29057 1.36071 230 3PY 0.29366 -0.42580 -0.06512 0.19089 0.50878 231 3PZ 0.14469 -0.22520 -0.06600 0.06515 0.20022 232 4XX -0.16149 -0.08899 0.01015 -0.02593 0.08490 233 4YY 0.12132 0.13816 0.00616 0.00101 -0.00907 234 4ZZ 0.01518 -0.12565 0.00172 0.04339 -0.10598 235 4XY 0.08944 0.02396 0.07520 0.13103 -0.00018 236 4XZ 0.05102 0.01907 0.06474 0.08102 0.03690 237 4YZ 0.09255 0.22266 -0.04619 -0.06799 -0.03126 238 21 C 1S -0.00502 0.00430 0.00072 -0.01206 -0.01784 239 2S -0.23146 -0.10568 0.11168 0.00676 -0.26396 240 2PX 0.19613 0.16883 0.02847 -0.01665 0.05528 241 2PY -0.02068 0.00172 -0.01547 -0.01859 0.04655 242 2PZ -0.00959 -0.00943 -0.02068 -0.01401 -0.00069 243 3S 1.18601 -1.43294 -0.23899 2.01991 1.85483 244 3PX -0.51614 0.52317 0.21625 -0.15797 -0.03337 245 3PY -0.61454 0.00499 -0.04656 -1.02202 -1.37814 246 3PZ -0.35553 0.04025 0.06183 -0.51007 -0.52549 247 4XX 0.17917 0.28192 -0.04784 -0.06433 -0.05504 248 4YY -0.14173 -0.09777 0.09609 0.06741 0.20969 249 4ZZ -0.03205 -0.28312 -0.02825 0.06690 -0.14598 250 4XY 0.12044 0.12037 0.10740 0.09502 0.09874 251 4XZ 0.08569 0.00920 -0.03096 0.01628 -0.17770 252 4YZ -0.06953 0.11364 -0.01424 -0.06996 -0.01426 253 22 H 1S 0.15510 0.09962 -0.06344 0.03806 0.01605 254 2S 0.17598 0.05909 0.04967 0.31189 0.38715 255 23 H 1S -0.02301 0.17277 -0.05049 -0.15984 -0.17230 256 2S -0.23647 0.21653 0.00887 -0.26709 -0.32563 257 24 H 1S 0.12335 -0.05584 -0.02701 0.06583 -0.01402 258 2S 0.24701 -0.17829 0.05850 0.25028 0.30849 259 25 H 1S -0.01548 -0.01596 -0.09044 -0.03973 -0.24874 260 2S -0.18433 -0.08296 -0.13564 -0.25539 -0.36005 261 26 H 1S 0.19272 0.07120 -0.06817 0.11151 -0.01436 262 2S -0.29981 0.14858 0.31444 0.51491 0.09303 263 27 H 1S -0.27140 -0.02854 -0.09632 -0.21661 -0.07915 264 2S -0.10791 0.21160 -0.01776 -0.41543 0.08896 196 197 198 199 200 V V V V V Eigenvalues -- 1.83818 1.86673 1.87148 1.88657 1.89417 1 1 C 1S 0.00042 0.00080 -0.00926 -0.01313 0.00017 2 2S -0.18051 0.02290 0.01220 -0.32379 0.29342 3 2PX -0.06653 0.21594 -0.09578 0.02821 0.08244 4 2PY 0.10418 -0.07031 0.00971 0.05478 -0.08574 5 2PZ 0.06978 -0.04915 0.02483 0.05053 -0.04572 6 3S -1.95476 1.78217 0.02593 2.23415 1.62820 7 3PX -1.28293 -0.62776 -0.01692 -0.05177 -0.12603 8 3PY 1.08925 -0.44050 0.17793 -0.60267 -0.31806 9 3PZ 0.36174 -0.12876 -0.14633 -0.60788 -0.34582 10 4XX 0.12160 0.15109 -0.07027 0.15930 -0.13761 11 4YY -0.25153 -0.02949 -0.19229 -0.21225 -0.05900 12 4ZZ 0.06404 -0.17103 0.24164 0.01252 0.24857 13 4XY 0.01977 0.01581 0.02134 -0.00164 0.14838 14 4XZ -0.03455 -0.03332 -0.06730 -0.02324 0.03425 15 4YZ 0.34033 -0.09408 0.18939 0.16245 0.08116 16 2 C 1S 0.00263 0.00882 0.03560 0.04248 0.03707 17 2S 0.07374 0.17507 0.56323 0.31070 0.40447 18 2PX -0.05731 -0.18293 -0.02029 -0.05099 0.08534 19 2PY -0.06046 -0.13741 0.03153 0.10482 0.14916 20 2PZ -0.05888 -0.01079 -0.04433 -0.03310 0.00368 21 3S 0.33722 0.12598 -0.67733 -3.05862 -3.36867 22 3PX -0.68862 -0.38887 0.19889 0.23347 0.39252 23 3PY -0.70692 -0.16465 -0.44598 0.45744 0.57074 24 3PZ -0.15010 -0.38300 -0.00332 0.69051 0.57648 25 4XX 0.12264 0.15860 -0.07668 0.16971 -0.11784 26 4YY -0.15651 -0.18955 0.20283 -0.08031 0.15159 27 4ZZ 0.03090 -0.01137 -0.16200 -0.12198 -0.01570 28 4XY -0.09097 -0.01710 -0.09751 0.01318 -0.14259 29 4XZ 0.08082 0.01326 0.03549 -0.02039 -0.09727 30 4YZ 0.05695 0.04515 0.25531 0.17957 0.04803 31 3 H 1S 0.00009 0.08425 0.15158 0.09284 0.04979 32 2S -0.02532 0.05466 0.21250 0.01056 0.08027 33 4 Br 1S 0.00332 0.00044 0.00553 0.00677 0.00032 34 2S -0.01828 -0.00130 -0.02636 -0.03157 -0.00266 35 3S 0.01234 -0.00157 0.00753 0.00708 0.00334 36 4S 0.07016 0.00832 0.12164 0.14910 0.00922 37 5S -0.05777 -0.07391 -0.11839 -0.08632 -0.11345 38 6S -0.09315 0.07104 -0.07925 -0.23832 0.37124 39 7PX 0.00101 -0.00221 -0.00053 0.00110 -0.00113 40 7PY -0.00128 -0.00035 -0.00841 -0.01002 -0.00296 41 7PZ 0.00099 0.00027 0.00476 0.00611 0.00298 42 8PX -0.00328 0.00727 0.00174 -0.00370 0.00369 43 8PY 0.00398 0.00080 0.02745 0.03262 0.00992 44 8PZ -0.00307 -0.00056 -0.01555 -0.01992 -0.01007 45 9PX 0.01436 -0.02484 -0.00465 0.01984 -0.01350 46 9PY -0.00140 0.01514 -0.08275 -0.09963 -0.03699 47 9PZ 0.00218 -0.01480 0.04366 0.06047 0.04453 48 10PX -0.01969 -0.00704 -0.00920 -0.02923 0.02054 49 10PY -0.08525 -0.01243 -0.18897 -0.22613 -0.21299 50 10PZ 0.07839 0.03240 0.17165 0.14309 0.09467 51 11XX 0.00313 0.00562 0.00969 0.01684 0.00411 52 11YY -0.00920 0.00001 -0.01188 -0.01708 -0.01275 53 11ZZ -0.00864 -0.00156 -0.00130 -0.00036 0.00240 54 11XY 0.00430 -0.00348 0.00369 0.00062 0.00513 55 11XZ -0.00325 0.00148 0.00259 -0.00059 0.00188 56 11YZ 0.00968 0.00848 0.01673 0.01597 0.00453 57 12XX 0.04159 -0.04556 0.10832 0.13474 -0.08175 58 12YY 0.13607 -0.00681 0.30779 0.42629 0.09257 59 12ZZ 0.13309 0.00569 0.22206 0.27905 -0.03189 60 12XY -0.02459 0.03396 -0.01475 -0.00954 -0.03459 61 12XZ 0.01677 -0.01401 -0.01665 0.00447 -0.01296 62 12YZ -0.06773 -0.04450 -0.15689 -0.16008 -0.08374 63 5 C 1S 0.00087 -0.02460 -0.04773 0.02452 0.02158 64 2S 0.08170 -0.20666 -0.74237 0.16991 0.47412 65 2PX 0.06572 0.12794 -0.04260 -0.05113 -0.10616 66 2PY 0.11835 0.12264 -0.01860 -0.07136 -0.14047 67 2PZ 0.00445 -0.01038 -0.06544 -0.04855 -0.07709 68 3S 0.04341 3.73430 6.56375 -3.64953 -4.67788 69 3PX -0.67323 -1.64125 -1.96619 2.20602 2.46905 70 3PY -1.49457 -2.79286 -2.51218 3.39734 4.33265 71 3PZ -0.00668 -0.41141 -0.33641 1.07126 1.22363 72 4XX 0.10578 0.02946 -0.00329 -0.12933 -0.13837 73 4YY -0.09494 -0.01630 0.12046 0.01027 0.00671 74 4ZZ 0.00132 0.01281 -0.06110 0.03200 0.03729 75 4XY -0.08706 -0.05986 0.02460 0.11795 0.08748 76 4XZ -0.02320 -0.04184 0.00442 -0.02330 0.01501 77 4YZ -0.04730 -0.03613 0.04019 -0.00778 0.00245 78 6 C 1S 0.01010 0.02619 0.03742 -0.03631 -0.04446 79 2S 0.06856 0.47027 0.74320 -0.70842 -0.63314 80 2PX -0.02155 0.01052 -0.00064 0.01182 -0.00063 81 2PY -0.03546 -0.01963 -0.00851 0.07540 0.03090 82 2PZ 0.02579 0.00228 0.05119 0.00250 -0.07350 83 3S -0.74736 -4.19386 -5.95933 5.04392 5.58539 84 3PX 0.36177 0.97871 1.45126 -1.06462 -1.14261 85 3PY 0.77591 1.95906 2.43585 -2.08134 -2.42501 86 3PZ -0.28260 -1.74928 -2.64875 2.34723 2.79888 87 4XX 0.08083 -0.04687 -0.09978 -0.00473 -0.05780 88 4YY -0.03044 -0.01383 0.00994 0.00166 0.06522 89 4ZZ -0.03715 0.00806 -0.01376 0.04430 0.02513 90 4XY -0.05421 0.01640 0.05867 0.02678 0.05515 91 4XZ -0.06122 -0.10592 0.15081 0.00402 0.09978 92 4YZ 0.12453 0.04579 -0.16217 0.10627 -0.14852 93 7 C 1S 0.00032 -0.03325 -0.05140 0.02963 0.02481 94 2S -0.00510 -0.53570 -0.72783 0.32825 0.43942 95 2PX 0.03335 -0.03942 -0.00545 0.00334 -0.06329 96 2PY 0.04290 -0.01250 -0.04267 0.04197 -0.09712 97 2PZ 0.01779 -0.03876 -0.05546 0.01243 0.00286 98 3S 0.73583 4.75127 6.48679 -4.63887 -5.01451 99 3PX 0.13798 0.60784 0.76036 -0.52544 -0.51829 100 3PY 0.22045 0.68596 1.00184 -0.67170 -0.57331 101 3PZ 0.25595 2.59230 3.83198 -2.66204 -3.15953 102 4XX 0.03438 0.02575 -0.07583 -0.00817 -0.14773 103 4YY 0.01129 -0.04864 0.04332 0.07303 -0.03633 104 4ZZ -0.04443 0.08912 0.09053 -0.15675 0.11755 105 4XY 0.01772 0.01485 -0.00869 0.13388 0.04012 106 4XZ -0.03351 0.03607 0.05165 -0.07068 0.06761 107 4YZ -0.03782 0.02726 0.04746 -0.11332 0.07425 108 8 C 1S 0.00487 0.03052 0.03789 -0.03088 -0.04153 109 2S 0.03089 0.47825 0.70185 -0.66778 -0.58451 110 2PX 0.00664 0.00395 0.01231 -0.02891 -0.04785 111 2PY -0.00153 0.01664 0.02038 -0.03476 -0.05324 112 2PZ 0.01609 -0.04411 -0.00540 -0.03026 -0.05197 113 3S -0.52242 -4.45065 -6.35825 4.43663 5.24815 114 3PX -0.11793 -1.52260 -2.12819 1.54059 1.50890 115 3PY -0.19123 -2.50018 -3.42024 2.48576 2.45984 116 3PZ -0.18650 -0.67434 -1.06570 0.69992 0.77620 117 4XX 0.01039 -0.01658 -0.15821 -0.05620 -0.05185 118 4YY -0.04434 -0.02543 0.06928 -0.15368 0.14340 119 4ZZ 0.02554 -0.01204 -0.00786 0.20695 -0.03480 120 4XY -0.01244 0.09934 0.07217 -0.06048 0.13301 121 4XZ -0.02476 0.02093 0.01869 -0.05513 0.06128 122 4YZ -0.05369 0.02182 0.04805 -0.10004 0.11934 123 9 C 1S -0.00199 -0.03518 -0.05082 0.02717 0.02589 124 2S -0.08571 -0.57945 -0.79655 0.30266 0.43112 125 2PX 0.00203 -0.03464 -0.03094 0.00646 -0.04393 126 2PY 0.00445 -0.04163 -0.07609 0.01981 -0.08010 127 2PZ 0.00633 0.01359 0.06361 0.01373 -0.02112 128 3S 0.69806 4.94058 6.42064 -4.58250 -4.99510 129 3PX 0.14113 1.11973 1.32406 -0.93693 -1.04009 130 3PY 0.24004 1.97190 2.45919 -1.69842 -1.85154 131 3PZ -0.35424 -2.10491 -3.07905 1.80126 2.39463 132 4XX 0.02895 0.00772 -0.06582 -0.07872 -0.14740 133 4YY 0.00988 0.00405 0.05397 -0.04514 -0.02953 134 4ZZ -0.03206 0.03866 0.07060 0.01527 0.08800 135 4XY 0.02276 0.00379 0.01336 0.07273 0.07215 136 4XZ 0.03786 0.01456 -0.07822 0.14337 -0.07142 137 4YZ 0.03050 -0.01297 -0.05750 0.19586 -0.07702 138 10 C 1S 0.01265 0.03024 0.03913 -0.03339 -0.04516 139 2S 0.06055 0.50940 0.70896 -0.67204 -0.59619 140 2PX 0.00762 -0.02029 -0.01358 0.03505 -0.03490 141 2PY 0.00556 -0.05798 -0.00441 0.06326 -0.03465 142 2PZ 0.00837 -0.04704 -0.04690 0.03361 0.02625 143 3S -1.16478 -4.88716 -6.28669 4.85245 5.55506 144 3PX -0.03805 0.58429 0.63178 -0.64010 -0.46541 145 3PY 0.05029 0.93304 0.58673 -0.88095 -0.80880 146 3PZ 0.70964 2.93351 3.79110 -3.03589 -3.65582 147 4XX 0.00496 -0.05213 -0.06828 -0.04020 -0.00407 148 4YY 0.06647 0.03829 -0.09885 0.07880 -0.02924 149 4ZZ -0.06791 -0.06492 0.08314 -0.01190 0.07621 150 4XY -0.00140 0.03449 0.10745 0.11494 0.07238 151 4XZ 0.07892 0.04286 -0.12024 -0.04125 -0.11646 152 4YZ -0.05557 -0.08963 0.10700 -0.07576 0.07679 153 11 H 1S 0.01154 -0.16634 -0.31818 0.28222 0.23285 154 2S -0.18634 -0.72555 -0.86259 0.70368 0.87951 155 12 H 1S 0.06612 0.19118 0.19260 0.01795 -0.33553 156 2S 0.09357 0.68430 0.94479 -0.59937 -0.69486 157 13 H 1S 0.04021 -0.28252 -0.37254 0.39865 -0.02159 158 2S -0.04859 -0.67303 -0.93542 0.63231 0.64951 159 14 H 1S 0.05534 0.07661 0.17978 -0.01097 -0.35574 160 2S 0.04414 0.59339 0.89511 -0.65173 -0.70541 161 15 H 1S 0.01005 -0.20089 -0.34205 0.29191 0.20978 162 2S -0.26204 -0.63475 -0.85014 0.73820 0.90813 163 16 C 1S -0.00210 -0.05090 0.00411 -0.01423 -0.02375 164 2S 0.14371 -0.67188 -0.00325 -0.36985 -0.11199 165 2PX 0.19424 -0.14594 -0.03628 -0.15276 -0.10529 166 2PY -0.21027 -0.01005 -0.01522 0.04377 0.07202 167 2PZ -0.09524 -0.01373 0.03431 0.05327 0.07395 168 3S -1.64165 6.54178 -0.33631 2.28375 3.06593 169 3PX -3.17166 3.77738 -0.09537 2.26651 2.98747 170 3PY 2.52191 -2.43600 0.15814 -1.62012 -1.90717 171 3PZ 1.93679 -1.53706 0.50396 -0.68573 -0.88298 172 4XX 0.08764 -0.08415 0.02617 0.01155 -0.01075 173 4YY -0.07889 0.08833 -0.02880 0.01430 -0.02433 174 4ZZ -0.08474 0.06633 -0.01240 -0.01240 0.11713 175 4XY -0.09708 -0.04011 -0.02812 -0.13538 0.10038 176 4XZ -0.11680 -0.01123 -0.01291 -0.06240 0.08717 177 4YZ 0.13864 -0.00162 0.01783 0.07149 -0.12572 178 17 C 1S -0.03725 0.04545 -0.00219 0.01940 0.02766 179 2S -0.40014 0.62894 -0.03245 0.14035 0.57804 180 2PX -0.06363 -0.07521 -0.02637 -0.05323 0.14275 181 2PY -0.03026 0.00009 0.00284 0.08136 -0.03494 182 2PZ 0.01414 -0.00003 0.01639 0.06193 -0.02079 183 3S 4.22767 -6.76807 0.55290 -2.15321 -4.57038 184 3PX 2.71517 -4.27986 0.41050 -1.87293 -3.27139 185 3PY 0.88450 -1.45785 0.28647 -0.99398 -0.47427 186 3PZ 0.17125 -0.62094 -0.06037 -0.59599 -0.24779 187 4XX 0.21863 0.13706 -0.00681 -0.00398 -0.02209 188 4YY 0.02840 -0.14033 0.16198 0.09497 0.06700 189 4ZZ -0.22612 -0.12511 -0.13730 -0.11108 -0.09544 190 4XY 0.15952 0.01562 0.08234 0.08905 -0.02547 191 4XZ -0.05869 0.04668 -0.10249 -0.02832 -0.10989 192 4YZ -0.12638 0.09150 -0.10811 -0.03631 -0.09831 193 18 C 1S 0.01319 -0.05752 0.00705 -0.01014 -0.03336 194 2S 0.43571 -0.75877 0.02915 -0.10322 -0.57005 195 2PX 0.09499 0.06218 -0.07586 -0.06043 0.02996 196 2PY -0.02491 -0.04222 0.02288 0.10019 -0.09634 197 2PZ -0.02825 -0.02357 0.00091 0.04701 -0.05732 198 3S -3.70464 7.38584 -0.53175 2.12850 4.96972 199 3PX -0.36550 0.63502 0.04984 0.65150 -0.01916 200 3PY -2.14307 4.03953 -0.36992 1.39784 2.54788 201 3PZ -1.09735 2.16086 -0.16495 0.74841 1.36893 202 4XX -0.17605 -0.08452 0.05688 0.07462 -0.08913 203 4YY 0.17470 0.14551 -0.07340 -0.09221 0.14479 204 4ZZ -0.03945 0.04474 0.00664 0.07389 -0.00730 205 4XY 0.04713 -0.12414 0.05180 -0.07020 0.10131 206 4XZ -0.05201 -0.04786 -0.06399 -0.08146 0.00431 207 4YZ 0.20040 0.09766 -0.04982 -0.16689 0.10703 208 19 C 1S -0.03493 0.04406 0.00112 0.02674 0.02025 209 2S -0.29550 0.82667 -0.06803 0.27932 0.47498 210 2PX 0.01036 -0.11010 -0.02497 -0.06813 0.02388 211 2PY -0.05597 -0.04815 0.00039 0.00361 0.03015 212 2PZ -0.02546 -0.02498 0.00480 0.00439 0.01623 213 3S 3.53888 -7.18524 0.35215 -2.86872 -3.92420 214 3PX -1.37832 3.80603 -0.33485 1.09460 2.14427 215 3PY 1.06031 -2.41505 0.22482 -0.62761 -1.72192 216 3PZ 0.63062 -1.41038 0.16882 -0.33846 -0.94493 217 4XX 0.06616 -0.14302 -0.01901 -0.24443 0.18422 218 4YY -0.01569 0.12379 -0.08519 0.03357 -0.11843 219 4ZZ -0.00573 -0.08276 0.09843 0.16709 -0.10730 220 4XY -0.23119 -0.11297 0.19033 0.20696 -0.13695 221 4XZ -0.20664 -0.03782 0.00942 0.05833 -0.15627 222 4YZ 0.14005 0.14181 -0.02032 -0.04322 0.08389 223 20 C 1S 0.01203 -0.05410 0.00668 -0.00831 -0.03676 224 2S 0.31187 -0.92793 0.06641 -0.21038 -0.48625 225 2PX 0.08822 0.08343 -0.05148 -0.09802 0.07649 226 2PY -0.01102 0.08120 0.00119 0.11534 -0.05526 227 2PZ -0.02445 0.04705 -0.01289 0.05896 -0.03809 228 3S -3.33739 7.86296 -0.72600 2.41701 4.87145 229 3PX 2.04767 -4.74846 0.24913 -1.49147 -2.75775 230 3PY 0.69632 -1.34812 -0.04331 -0.73034 -0.55724 231 3PZ 0.37061 -0.63504 -0.00282 -0.35309 -0.23315 232 4XX 0.19741 0.01196 -0.13800 -0.21989 0.22957 233 4YY -0.15362 0.05335 0.00380 0.08400 -0.13610 234 4ZZ -0.09121 0.01081 0.12078 0.17894 -0.02516 235 4XY 0.19549 0.14468 -0.10860 0.00202 0.03978 236 4XZ 0.06698 0.08391 -0.07956 -0.01227 -0.00589 237 4YZ 0.05716 0.00124 0.04137 -0.00482 -0.00665 238 21 C 1S -0.03533 0.04450 0.00061 0.02047 0.02981 239 2S -0.29197 0.99224 -0.09889 0.38738 0.41619 240 2PX 0.08302 0.01405 -0.06359 -0.04860 0.09151 241 2PY 0.00130 -0.15249 0.01446 -0.04763 -0.00406 242 2PZ 0.01766 -0.08956 0.02153 -0.02588 -0.00334 243 3S 3.47165 -7.68036 0.42283 -2.86869 -4.67153 244 3PX -0.31481 0.34899 0.21830 0.41633 0.07687 245 3PY -2.12154 4.37694 -0.25001 1.81841 2.71287 246 3PZ -1.37018 2.45265 -0.33655 0.88573 1.38197 247 4XX -0.09116 0.00409 0.06765 0.01345 -0.03854 248 4YY 0.00894 -0.00013 -0.19164 -0.10841 -0.08063 249 4ZZ 0.10639 -0.09091 0.12553 0.09386 0.03462 250 4XY -0.03574 0.06861 -0.10917 0.03274 -0.10528 251 4XZ 0.21701 -0.04423 0.16541 0.14366 0.06849 252 4YZ 0.27018 -0.04508 0.06215 0.02341 0.10557 253 22 H 1S -0.00134 -0.34226 0.09874 -0.15393 -0.23747 254 2S 0.70683 -1.10056 0.05355 -0.46473 -0.70302 255 23 H 1S -0.39906 0.24973 0.17251 0.28302 -0.00646 256 2S -0.46036 1.12181 -0.05581 0.35413 0.63649 257 24 H 1S -0.19302 -0.41621 0.20050 0.21729 -0.45005 258 2S 0.39146 -1.04438 0.08801 -0.28302 -0.62857 259 25 H 1S -0.40356 0.20060 0.03703 0.31508 -0.01289 260 2S -0.51319 1.06138 -0.11838 0.39710 0.64347 261 26 H 1S 0.02080 -0.45352 -0.00431 -0.17058 -0.19704 262 2S 0.69769 -1.05079 0.26863 -0.85508 -0.86316 263 27 H 1S -0.10158 0.15152 -0.07645 0.00898 -0.11366 264 2S -0.11956 0.01651 0.01723 0.08017 0.06479 201 202 203 204 205 V V V V V Eigenvalues -- 1.91574 1.92148 1.93438 1.95902 1.99076 1 1 C 1S 0.00861 0.00089 0.00004 -0.00307 -0.00512 2 2S 0.38360 0.17506 0.06722 0.00818 -0.02926 3 2PX 0.05364 0.03801 -0.00381 0.02094 0.05143 4 2PY -0.16596 0.00964 0.02591 -0.00593 0.02026 5 2PZ -0.10201 0.00240 0.01908 -0.01504 -0.01691 6 3S -0.18322 -0.29786 -0.69116 0.52258 0.78715 7 3PX 0.53092 -0.15242 0.51435 0.10336 0.07844 8 3PY 0.11235 0.58615 0.73480 -0.21825 -0.40822 9 3PZ 0.04374 0.39044 0.44120 -0.12201 -0.46066 10 4XX -0.03314 -0.09108 -0.06475 0.00947 0.00090 11 4YY -0.08595 0.13797 0.15914 0.00994 -0.06116 12 4ZZ 0.18207 -0.09162 -0.16372 -0.01486 0.09610 13 4XY 0.01359 0.02325 0.08604 -0.00410 -0.10614 14 4XZ 0.04512 0.01317 0.12384 0.07704 0.31324 15 4YZ -0.16916 0.19829 0.28374 0.00603 0.04521 16 2 C 1S 0.00149 -0.02477 -0.05073 0.00812 0.01899 17 2S -0.20739 -0.27597 -0.63826 0.13290 0.38331 18 2PX 0.08668 0.00438 -0.00057 -0.03266 -0.00894 19 2PY 0.15063 0.01051 -0.01796 -0.03105 0.02335 20 2PZ 0.05202 0.03973 0.04863 0.03725 -0.05236 21 3S 0.42470 1.85887 3.09665 -0.44950 -1.39759 22 3PX 0.28543 -0.34504 -0.01658 0.09922 0.10594 23 3PY -0.17389 -0.95010 -0.87752 0.15072 0.26100 24 3PZ -0.05224 -0.64016 -0.64092 0.07264 0.66252 25 4XX -0.11273 -0.06508 0.04332 0.00028 0.03654 26 4YY 0.12635 0.11741 0.00923 -0.09686 -0.21732 27 4ZZ -0.01131 -0.02575 -0.00436 0.09010 0.13334 28 4XY 0.05563 -0.11087 -0.18503 -0.05787 -0.07932 29 4XZ 0.06787 -0.04137 -0.02610 0.06691 0.18646 30 4YZ 0.10005 0.03756 0.01091 0.16053 0.35762 31 3 H 1S -0.00700 -0.03192 -0.14061 -0.04786 -0.19764 32 2S 0.06913 0.13928 0.03073 0.00718 -0.02458 33 4 Br 1S -0.00079 -0.00192 -0.00226 0.00119 0.00740 34 2S 0.00540 0.00721 0.00839 -0.00472 -0.03013 35 3S -0.00566 0.00366 0.00487 -0.00080 -0.00559 36 4S -0.01871 -0.04480 -0.05401 0.02447 0.16603 37 5S -0.08858 -0.04602 0.02294 -0.12031 -0.01051 38 6S 0.27217 0.25338 0.06973 0.16097 -0.53347 39 7PX -0.00112 -0.00078 0.00032 0.00101 0.00259 40 7PY 0.00005 0.00517 0.00839 -0.00081 -0.01374 41 7PZ 0.00056 -0.00157 -0.00328 0.00219 0.00683 42 8PX 0.00375 0.00257 -0.00101 -0.00327 -0.00843 43 8PY -0.00030 -0.01709 -0.02781 0.00228 0.04473 44 8PZ -0.00183 0.00512 0.01081 -0.00703 -0.02212 45 9PX -0.01868 -0.00856 0.00613 0.01144 0.02905 46 9PY 0.00870 0.06422 0.10462 0.01480 -0.13706 47 9PZ 0.00499 -0.01668 -0.03541 0.01665 0.06220 48 10PX 0.03345 -0.00016 -0.04470 -0.01625 -0.01268 49 10PY -0.05263 0.03067 0.10341 -0.11544 -0.16967 50 10PZ 0.02777 0.00845 -0.06868 0.01889 0.10175 51 11XX 0.00305 -0.00453 -0.00719 0.00796 0.02023 52 11YY 0.00176 0.00056 -0.00002 -0.00628 -0.00843 53 11ZZ 0.00443 -0.00470 -0.00348 0.00262 0.01042 54 11XY 0.00229 0.00066 0.00016 -0.00021 0.00359 55 11XZ -0.00013 -0.00012 0.00013 -0.00237 -0.00203 56 11YZ 0.00113 -0.00236 -0.00655 0.00497 0.01767 57 12XX -0.06217 -0.10174 -0.07674 -0.03918 0.25173 58 12YY -0.05648 -0.17441 -0.19954 0.06113 0.51106 59 12ZZ -0.06653 -0.09033 -0.11175 -0.00250 0.33018 60 12XY -0.01225 0.00418 0.01476 0.00153 -0.02880 61 12XZ 0.00194 0.00010 -0.00775 0.01301 0.01647 62 12YZ -0.01197 0.03232 0.08650 -0.04047 -0.15831 63 5 C 1S -0.00909 -0.00472 0.01319 -0.00165 -0.00357 64 2S -0.55095 -0.15863 0.25063 0.02702 -0.03277 65 2PX -0.04230 0.07351 0.11010 0.00025 -0.00384 66 2PY 0.00455 0.14980 0.15739 -0.03055 -0.00615 67 2PZ -0.03020 0.02270 -0.01627 0.15508 -0.21272 68 3S 2.09802 1.37053 -1.03213 0.13128 0.36473 69 3PX -0.34472 -1.58559 -1.17986 0.08615 0.36483 70 3PY -0.37551 -2.22650 -1.57453 0.17862 0.37768 71 3PZ 0.21428 -0.41647 -0.05278 -0.05916 1.46814 72 4XX -0.03074 0.01565 0.02072 0.00235 0.01863 73 4YY 0.15843 0.01542 0.00343 0.02600 0.12602 74 4ZZ -0.08229 -0.00648 -0.02178 -0.05061 -0.16319 75 4XY 0.20867 -0.03361 -0.08256 0.01340 0.06179 76 4XZ 0.03357 0.00627 -0.01043 -0.06709 -0.17520 77 4YZ 0.05393 0.00605 -0.01415 -0.10766 -0.22316 78 6 C 1S 0.00794 0.01595 0.00821 0.00551 -0.00621 79 2S 0.06330 0.20735 0.08772 0.22724 0.32048 80 2PX 0.04430 0.02214 0.03139 -0.00718 -0.08741 81 2PY 0.10051 0.02753 0.01305 -0.04231 -0.14725 82 2PZ 0.09849 0.04005 0.00282 0.23414 0.14065 83 3S -0.68943 -2.04540 -0.24475 -0.46815 0.34708 84 3PX 0.12314 0.59709 0.22369 -0.07192 0.44495 85 3PY 0.11315 0.93132 0.37938 -0.13322 0.75780 86 3PZ -0.78587 -1.19233 -0.16422 0.00472 0.27932 87 4XX -0.01366 -0.00026 0.03879 0.16729 0.09006 88 4YY -0.01971 -0.00632 0.01492 -0.05739 0.04861 89 4ZZ 0.04261 -0.00824 -0.01819 -0.13773 -0.07625 90 4XY -0.01897 -0.06160 -0.08316 -0.20516 -0.03128 91 4XZ 0.08618 0.13932 0.03752 0.18598 -0.09846 92 4YZ -0.04948 -0.01307 -0.05870 0.36889 -0.03115 93 7 C 1S 0.00118 -0.00344 0.00826 0.00772 -0.00374 94 2S -0.10782 -0.14757 0.12909 0.11763 -0.24107 95 2PX 0.07550 0.03192 0.03835 -0.02757 0.02253 96 2PY 0.12591 0.05941 0.06434 -0.05805 0.05665 97 2PZ 0.01607 0.03964 0.04516 0.14440 -0.18871 98 3S 0.66816 1.87135 0.05443 -0.58257 0.76435 99 3PX -0.06864 0.17052 -0.00072 0.21662 0.11143 100 3PY -0.19150 0.16829 -0.01534 0.36210 0.18398 101 3PZ 0.92601 1.29139 -0.13369 0.06487 0.07498 102 4XX 0.12280 0.11124 0.07262 0.16986 -0.14795 103 4YY 0.14533 0.11741 0.02105 0.15491 -0.20783 104 4ZZ -0.26161 -0.17363 -0.06476 -0.35864 0.32468 105 4XY -0.02907 -0.08445 -0.07427 -0.05582 -0.02757 106 4XZ -0.10170 -0.05554 -0.00718 -0.15547 -0.00742 107 4YZ -0.14092 -0.05457 -0.00734 -0.19240 -0.05639 108 8 C 1S 0.01805 0.02419 0.00856 -0.00095 -0.00499 109 2S 0.13158 0.25376 0.07364 -0.03166 -0.08380 110 2PX 0.04309 0.02852 0.02667 -0.03569 -0.02488 111 2PY 0.06915 0.05463 0.04883 -0.06971 -0.04061 112 2PZ 0.02292 0.01771 -0.01590 0.19573 -0.02610 113 3S -1.73549 -2.25965 -0.18905 0.00119 0.10430 114 3PX -0.25656 -0.57599 0.02802 0.03375 0.01164 115 3PY -0.38771 -0.91296 0.06390 0.09983 0.01550 116 3PZ -0.17922 -0.28726 -0.01425 -0.69768 -0.20591 117 4XX -0.02471 0.01423 0.06506 -0.01204 -0.01007 118 4YY -0.21815 -0.09649 -0.04429 0.02430 0.11998 119 4ZZ 0.19140 0.06991 0.00365 -0.01789 -0.12901 120 4XY -0.31596 -0.22151 -0.15470 0.05421 0.17349 121 4XZ -0.11258 -0.04761 -0.02943 0.00774 -0.13641 122 4YZ -0.17319 -0.04519 -0.02996 0.00717 -0.23070 123 9 C 1S -0.00162 -0.00244 0.00795 -0.01268 -0.00763 124 2S -0.12427 -0.13556 0.08453 -0.17611 0.09330 125 2PX 0.06369 0.04611 0.03081 -0.02180 -0.02547 126 2PY 0.10041 0.07005 0.05367 -0.04207 -0.02742 127 2PZ 0.04282 0.02194 -0.01535 0.14745 -0.18221 128 3S 0.66980 1.76502 -0.01180 0.83304 -0.52381 129 3PX 0.08930 0.30871 -0.02486 -0.13446 -0.00578 130 3PY 0.20841 0.59738 -0.03894 -0.21116 -0.01430 131 3PZ -1.00533 -1.05512 -0.14887 -0.16646 -0.04653 132 4XX 0.07524 0.08212 0.08120 -0.15598 0.04562 133 4YY 0.00015 -0.00389 -0.00769 0.05699 0.11806 134 4ZZ -0.07292 -0.03067 -0.05447 0.13366 -0.15598 135 4XY -0.08439 -0.11485 -0.08445 0.20436 0.08033 136 4XZ 0.12708 0.03221 0.02932 -0.19361 0.10727 137 4YZ 0.25077 0.12359 0.08926 -0.34479 0.16187 138 10 C 1S 0.01069 0.02060 0.00702 -0.00761 0.00106 139 2S 0.02686 0.21051 0.05739 -0.19408 -0.31392 140 2PX 0.06718 0.00217 0.01824 -0.04462 0.04345 141 2PY 0.12046 0.03001 0.02132 -0.09042 0.05434 142 2PZ 0.02191 -0.01198 -0.01131 0.20281 0.15823 143 3S -1.04616 -2.27794 -0.63834 0.38719 -0.13607 144 3PX -0.21050 0.20481 0.00841 0.12992 -0.46761 145 3PY -0.47154 0.09499 -0.07932 0.21195 -0.68470 146 3PZ 0.78422 1.55978 0.52946 0.05466 -0.47909 147 4XX -0.04141 0.06703 0.05678 -0.24500 -0.10744 148 4YY -0.03641 -0.02464 0.01148 -0.17092 0.03683 149 4ZZ 0.06854 -0.03070 -0.04992 0.42621 -0.01187 150 4XY 0.05917 -0.01486 -0.01869 0.08231 0.10823 151 4XZ -0.06978 -0.09830 -0.06747 0.12328 -0.03717 152 4YZ 0.00622 0.00370 -0.01109 0.15351 -0.13376 153 11 H 1S -0.07462 -0.06246 0.01670 -0.44017 0.16818 154 2S -0.10618 -0.38740 -0.16237 0.03852 0.17861 155 12 H 1S 0.36363 0.22178 0.11898 -0.45708 0.19790 156 2S 0.18912 0.25890 0.00558 0.03903 0.01918 157 13 H 1S 0.40632 0.15715 0.14026 -0.05918 -0.08637 158 2S -0.14241 -0.25213 0.01986 -0.01209 -0.00063 159 14 H 1S 0.36316 0.26376 0.02123 0.42213 -0.25577 160 2S 0.17223 0.27706 -0.05565 0.00119 0.03741 161 15 H 1S -0.07440 -0.09320 -0.04231 0.48627 -0.12306 162 2S -0.16458 -0.42035 -0.13535 -0.08495 -0.10386 163 16 C 1S 0.01036 -0.02977 -0.03052 -0.00186 0.01347 164 2S 0.23392 -0.45914 -0.41894 0.00247 0.15695 165 2PX -0.02784 0.06140 -0.16112 -0.03396 -0.01427 166 2PY 0.02561 0.10692 -0.07094 0.01930 0.04886 167 2PZ 0.01821 0.04854 -0.05818 -0.00316 -0.00615 168 3S -0.51114 3.58962 3.00398 0.29848 -1.12765 169 3PX 0.10624 0.78499 1.05999 0.70022 0.29046 170 3PY -0.76809 -0.87895 -0.15180 -0.39583 -0.22827 171 3PZ -0.41644 -0.50744 -0.15724 -0.29065 -0.22781 172 4XX -0.19370 0.13488 0.23533 0.00467 0.03457 173 4YY 0.04524 -0.06409 -0.13109 -0.04623 -0.19339 174 4ZZ 0.16858 -0.04525 -0.06439 0.05693 0.16704 175 4XY 0.19352 -0.02192 -0.03145 0.03534 0.11354 176 4XZ 0.12509 -0.01421 -0.04584 -0.00350 0.00296 177 4YZ -0.11143 -0.01849 0.02046 0.00731 0.00391 178 17 C 1S 0.00358 0.02358 0.00968 0.00625 0.00246 179 2S -0.06154 0.49052 0.45221 0.08276 0.08348 180 2PX 0.01701 0.18388 0.13124 0.03468 0.06934 181 2PY -0.08583 0.12771 -0.07257 -0.01644 0.02736 182 2PZ -0.04621 0.05370 -0.04995 0.01259 0.03252 183 3S -0.52740 -3.28876 -2.21357 -0.77796 0.04793 184 3PX -0.34848 -1.79328 -1.89893 -0.63100 0.16132 185 3PY -0.04969 -0.72691 -0.28872 -0.10382 0.04860 186 3PZ -0.02291 -0.31762 -0.03719 -0.02965 0.11298 187 4XX 0.03522 -0.31463 0.25066 0.01169 -0.09402 188 4YY -0.01786 0.09960 -0.18904 -0.06697 -0.11914 189 4ZZ -0.02548 0.16399 -0.04018 0.05808 0.24235 190 4XY -0.03114 -0.13723 0.12399 -0.05297 -0.14322 191 4XZ -0.01938 -0.05304 0.09931 0.04750 0.08566 192 4YZ 0.01918 -0.02257 -0.00258 0.03505 0.06744 193 18 C 1S -0.00754 -0.01310 -0.01517 -0.00376 0.00732 194 2S -0.08678 -0.23748 -0.41108 -0.09969 0.01543 195 2PX 0.06882 0.04295 -0.17769 -0.01261 0.00134 196 2PY -0.06741 0.05232 -0.13002 -0.01996 -0.01748 197 2PZ -0.03823 0.03062 -0.05576 -0.01279 0.00162 198 3S 0.54119 2.44916 2.92500 0.83725 -0.41848 199 3PX -0.14072 0.05250 0.36826 0.03338 -0.14446 200 3PY 0.09054 1.88025 1.25169 0.42296 -0.22274 201 3PZ 0.05790 1.00296 0.65062 0.24381 -0.10614 202 4XX -0.09123 0.13666 -0.17966 -0.01501 0.03444 203 4YY 0.16181 -0.21623 0.21102 0.02517 -0.03879 204 4ZZ -0.05488 0.09413 0.00919 -0.00403 -0.01064 205 4XY 0.00017 0.01208 0.19715 -0.00618 0.00223 206 4XZ -0.00668 0.01129 0.14585 0.03274 0.10558 207 4YZ 0.19291 -0.26550 0.15575 -0.00065 -0.04854 208 19 C 1S -0.00626 0.01810 0.01885 0.00475 -0.00230 209 2S -0.08113 0.31775 0.35019 0.09438 -0.07560 210 2PX 0.01958 0.10787 -0.08298 -0.00855 0.03941 211 2PY -0.07932 0.13895 0.00256 0.01537 0.01805 212 2PZ -0.04247 0.07262 0.00178 0.00803 0.00492 213 3S 0.34119 -2.90411 -2.36286 -0.66870 0.50588 214 3PX 0.27021 1.00082 1.11260 0.31977 -0.30509 215 3PY 0.12890 -1.46471 -0.73149 -0.23660 0.06838 216 3PZ 0.06410 -0.81788 -0.43980 -0.16529 -0.02613 217 4XX 0.06009 0.05573 0.20764 0.02767 0.09512 218 4YY 0.04067 -0.05915 -0.20840 -0.01036 -0.01487 219 4ZZ -0.08178 -0.04709 -0.01965 -0.01971 -0.06857 220 4XY -0.19322 -0.00157 0.04635 -0.01010 -0.05258 221 4XZ -0.10874 0.00250 0.06234 0.03128 0.09394 222 4YZ 0.13024 -0.01745 -0.20423 -0.03286 -0.05322 223 20 C 1S 0.00073 -0.02974 -0.00826 -0.00325 0.00069 224 2S -0.02640 -0.39679 0.06116 -0.03597 0.08382 225 2PX 0.05222 0.08555 -0.12574 -0.01136 -0.03049 226 2PY -0.05637 0.06615 -0.17059 -0.01258 -0.01062 227 2PZ -0.03420 0.03426 -0.09106 -0.00752 -0.00485 228 3S 0.19503 3.26629 0.97493 0.65198 -0.18340 229 3PX -0.14419 -1.49345 -1.14252 -0.38435 0.25185 230 3PY 0.37084 -0.82846 -0.52478 -0.10123 0.13246 231 3PZ 0.20853 -0.41775 -0.25285 -0.03055 0.09710 232 4XX 0.01389 0.34989 -0.19982 0.00882 0.05959 233 4YY -0.00273 -0.13365 0.06419 0.00685 0.02203 234 4ZZ -0.02125 -0.14820 0.19058 0.00012 -0.06691 235 4XY 0.05777 0.12679 -0.27089 -0.02004 0.00685 236 4XZ 0.02657 0.05630 -0.14598 -0.03164 -0.05381 237 4YZ 0.02545 0.00958 -0.13430 -0.03460 -0.03075 238 21 C 1S 0.00418 0.00890 0.01732 0.00569 -0.00034 239 2S 0.13585 0.10935 0.05770 0.04491 -0.12823 240 2PX 0.01657 0.10265 -0.08991 0.00311 0.03588 241 2PY -0.10507 0.12453 0.10537 0.01347 0.04533 242 2PZ -0.05798 0.06772 0.06257 0.00527 0.01497 243 3S -0.22533 -2.16157 -1.94879 -0.72741 0.38789 244 3PX -0.45344 0.26705 0.96670 0.07039 -0.23488 245 3PY 0.18376 1.45284 0.42043 0.40537 -0.06241 246 3PZ 0.10136 0.79031 0.22566 0.24273 0.02221 247 4XX 0.07392 -0.13774 0.12169 -0.00586 -0.00532 248 4YY -0.15904 0.25516 -0.11480 0.01196 0.04076 249 4ZZ 0.08658 -0.16385 -0.10116 -0.02065 -0.03394 250 4XY -0.09254 0.10684 0.04526 0.00717 0.06038 251 4XZ -0.03199 0.04400 -0.01170 -0.03501 -0.03026 252 4YZ -0.19836 0.35106 -0.07303 -0.02119 -0.01060 253 22 H 1S 0.22360 -0.51165 0.14248 -0.02455 -0.03485 254 2S -0.11888 -0.29397 -0.12195 -0.12253 -0.02323 255 23 H 1S -0.05934 -0.21871 0.46366 0.03598 -0.06539 256 2S -0.01098 0.43782 0.29382 0.08538 -0.06615 257 24 H 1S -0.26013 -0.13200 -0.03192 -0.02418 -0.01111 258 2S 0.00319 -0.41357 -0.31935 -0.09272 0.06379 259 25 H 1S -0.22403 0.46967 -0.23034 0.00914 0.01598 260 2S 0.05181 0.46700 0.33944 0.10998 -0.07860 261 26 H 1S 0.01684 0.23038 -0.42805 -0.05209 0.17312 262 2S -0.22421 -0.59184 -0.28011 -0.13517 0.03414 263 27 H 1S 0.08694 -0.23301 -0.42750 -0.01939 -0.00575 264 2S -0.08116 -0.14095 -0.14982 0.04772 0.16778 206 207 208 209 210 V V V V V Eigenvalues -- 1.99691 2.02147 2.04584 2.07632 2.09180 1 1 C 1S -0.00913 -0.00515 0.00076 -0.01422 0.00984 2 2S -0.20568 0.09106 0.03859 0.03771 0.08576 3 2PX 0.15553 -0.17851 0.10240 -0.06794 -0.10551 4 2PY -0.02255 0.00368 -0.05634 -0.04533 0.02953 5 2PZ 0.01042 -0.01399 0.00160 0.01512 0.05800 6 3S 1.72795 -0.66685 -0.11077 1.17036 -1.24961 7 3PX 0.09476 -0.05514 0.43337 0.16536 0.28592 8 3PY -0.77373 0.49496 0.00498 -0.59107 0.35832 9 3PZ -0.45125 0.26748 0.05121 -0.33556 0.28212 10 4XX 0.03239 0.01706 0.02220 -0.01630 0.00823 11 4YY 0.06071 -0.04168 0.06395 0.07147 0.08172 12 4ZZ -0.03749 -0.02842 -0.07334 -0.03809 -0.13050 13 4XY 0.10740 -0.16783 0.14238 0.10427 0.06432 14 4XZ -0.08057 0.01760 -0.11069 -0.05288 -0.10682 15 4YZ 0.03392 0.05181 -0.01918 -0.04163 0.00279 16 2 C 1S 0.01481 -0.01595 -0.00675 0.00683 -0.02113 17 2S 0.20310 -0.20934 -0.16136 0.19056 -0.18367 18 2PX -0.02682 -0.02523 0.01532 -0.00736 -0.03772 19 2PY -0.01429 -0.03342 0.03190 -0.03567 -0.05967 20 2PZ -0.01288 -0.00652 0.02326 -0.00303 0.02047 21 3S -0.97563 1.33527 0.73113 -0.62668 1.25622 22 3PX 0.01637 -0.32309 0.15525 -0.18824 0.18764 23 3PY 0.49109 -0.62814 0.00246 0.50917 -0.13477 24 3PZ 0.25004 -0.36401 -0.01290 0.37141 0.01141 25 4XX 0.12060 -0.20700 0.12830 -0.20408 -0.00794 26 4YY -0.17657 0.26572 -0.11819 0.00299 -0.07241 27 4ZZ 0.01557 -0.01643 -0.00661 0.17009 0.09973 28 4XY 0.18310 -0.11523 0.20163 0.15616 -0.00000 29 4XZ -0.05919 0.09097 -0.17971 -0.21550 -0.35935 30 4YZ 0.03709 -0.01332 0.14220 -0.02838 0.06207 31 3 H 1S 0.01743 0.00010 -0.10916 -0.17265 -0.28177 32 2S -0.04764 0.02602 -0.02867 -0.10430 -0.01523 33 4 Br 1S 0.00186 -0.00142 0.00150 -0.00001 0.00048 34 2S -0.00758 0.00479 -0.00472 -0.00105 -0.00450 35 3S -0.00154 0.00385 -0.00498 0.00323 0.00827 36 4S 0.04218 -0.03112 0.03216 -0.00011 0.00581 37 5S 0.00776 0.09247 -0.02307 -0.01022 -0.15480 38 6S -0.19044 -0.08022 -0.12926 0.02513 0.28000 39 7PX -0.00114 0.00118 -0.00108 -0.00049 -0.00061 40 7PY -0.00364 0.00302 -0.00192 0.00040 0.00334 41 7PZ 0.00142 -0.00215 0.00088 0.00040 -0.00017 42 8PX 0.00366 -0.00385 0.00353 0.00147 0.00200 43 8PY 0.01182 -0.00962 0.00590 -0.00131 -0.01154 44 8PZ -0.00444 0.00677 -0.00251 -0.00144 0.00073 45 9PX -0.00952 0.01294 -0.01426 -0.00200 -0.00938 46 9PY -0.03466 0.01567 -0.00363 0.00850 0.07135 47 9PZ 0.00443 -0.01024 -0.00812 0.01288 -0.00783 48 10PX -0.00393 0.00202 0.01448 0.01650 0.01294 49 10PY -0.02340 0.11745 -0.00077 -0.05089 -0.10803 50 10PZ 0.01717 -0.03236 0.01824 -0.06839 -0.02693 51 11XX 0.00657 -0.00877 0.00534 -0.00111 -0.00216 52 11YY -0.00148 0.00375 0.00212 -0.00851 -0.01335 53 11ZZ 0.00048 -0.00439 0.00450 0.00391 0.00413 54 11XY -0.00331 0.00214 -0.00070 -0.00314 -0.00226 55 11XZ 0.00204 -0.00230 0.00213 0.00137 -0.00067 56 11YZ 0.00812 -0.01094 0.01057 -0.00356 0.00192 57 12XX 0.05630 0.00783 0.05472 -0.01133 -0.06369 58 12YY 0.13201 -0.10596 0.06707 0.04753 -0.01729 59 12ZZ 0.09144 -0.01696 0.05202 -0.05504 -0.11548 60 12XY 0.02090 -0.01477 0.00599 0.00893 0.01301 61 12XZ -0.01206 0.01706 -0.01241 -0.00196 0.00252 62 12YZ -0.05566 0.07975 -0.05392 0.02334 0.00438 63 5 C 1S -0.01117 0.01712 0.00019 -0.01620 -0.01090 64 2S -0.14367 -0.04059 -0.57449 -0.15864 0.07692 65 2PX 0.01791 0.08277 0.07098 -0.01930 0.07252 66 2PY -0.03985 0.14824 0.14478 0.01370 0.10919 67 2PZ 0.02310 0.03237 0.03240 -0.01400 -0.02359 68 3S 1.28427 -1.24101 1.16419 1.09547 -0.11157 69 3PX 0.22840 -0.78575 -0.24305 0.17820 -0.47168 70 3PY 0.00003 -0.65184 -0.75345 0.07080 -0.46057 71 3PZ -0.08701 -0.22041 -0.11677 -0.31668 -0.25224 72 4XX -0.08746 0.03661 -0.05067 0.02950 -0.01378 73 4YY 0.05214 -0.16460 0.04978 -0.02622 -0.09194 74 4ZZ 0.02768 0.02892 -0.03556 0.00937 0.06400 75 4XY 0.01100 0.02867 0.04688 0.11865 0.11910 76 4XZ -0.00694 0.03310 -0.05244 -0.12660 -0.20009 77 4YZ 0.07485 -0.12671 0.07446 -0.12382 -0.18320 78 6 C 1S 0.00088 0.00259 0.00536 -0.00055 -0.00513 79 2S 0.06439 0.18146 0.24985 0.07238 0.05876 80 2PX 0.00895 -0.06014 -0.09151 -0.03529 -0.00788 81 2PY -0.00059 -0.14859 -0.13415 -0.03300 -0.02608 82 2PZ -0.02182 0.00505 0.02711 0.02925 0.02388 83 3S -0.79727 -0.04070 -0.87109 -0.61245 -0.12629 84 3PX 0.01460 0.22367 0.19010 -0.08910 -0.14884 85 3PY 0.31224 0.09900 0.53521 -0.06806 -0.19923 86 3PZ -0.27020 0.24155 -0.21845 -0.45918 -0.31161 87 4XX -0.07025 0.02144 0.01240 0.05349 0.04744 88 4YY -0.04405 -0.10161 -0.23437 0.07997 0.10357 89 4ZZ 0.05972 0.11994 0.25552 -0.12822 -0.15332 90 4XY 0.06228 -0.22715 -0.17543 0.10514 0.12200 91 4XZ -0.16766 0.32771 -0.07632 -0.01390 0.04101 92 4YZ 0.10569 -0.00053 0.18974 0.06794 0.07479 93 7 C 1S -0.00962 0.00669 -0.00491 -0.00174 0.00708 94 2S -0.11263 0.21278 0.09854 -0.23637 -0.10318 95 2PX -0.02884 0.02778 0.03892 -0.03664 -0.05359 96 2PY -0.02295 0.01324 0.06919 -0.05345 -0.08301 97 2PZ 0.01348 0.07514 0.08295 -0.11331 -0.08032 98 3S 0.90866 -0.51520 0.44193 0.45290 -0.09351 99 3PX 0.14427 -0.08149 -0.00967 0.02128 -0.03433 100 3PY 0.15014 -0.07532 -0.06733 -0.04977 -0.14662 101 3PZ 0.58491 -0.49342 0.21934 0.44810 0.06657 102 4XX 0.05685 -0.08633 0.04707 -0.03714 -0.01007 103 4YY -0.02735 -0.00826 -0.13020 -0.06378 -0.06930 104 4ZZ -0.01364 0.12651 0.12946 0.07178 0.04434 105 4XY 0.04280 -0.16269 -0.06123 0.00934 -0.03113 106 4XZ -0.02042 -0.06963 -0.16873 0.04887 0.09991 107 4YZ 0.02296 -0.20230 -0.27715 -0.01989 -0.00098 108 8 C 1S 0.00441 0.00099 0.00347 0.00595 0.01333 109 2S 0.08856 -0.30249 -0.34541 0.15173 0.26755 110 2PX 0.00004 -0.10412 -0.12486 0.02332 0.05293 111 2PY -0.00886 -0.15426 -0.22065 0.03861 0.09548 112 2PZ 0.00375 -0.03411 -0.05994 0.06488 0.09485 113 3S -0.87340 0.98112 -0.06376 -0.52485 -0.24924 114 3PX -0.28434 0.20740 0.00993 -0.17924 -0.10152 115 3PY -0.53351 0.46298 -0.02162 -0.26241 -0.08891 116 3PZ -0.11902 0.09504 -0.00212 -0.12061 -0.12965 117 4XX 0.05185 -0.09892 -0.03344 0.03826 0.12831 118 4YY -0.07977 0.24959 0.03756 0.08614 0.14318 119 4ZZ 0.00755 -0.16327 -0.08826 -0.10735 -0.20468 120 4XY 0.07096 0.07699 0.21244 -0.03143 -0.15441 121 4XZ 0.04186 0.00644 0.03511 -0.09653 -0.13118 122 4YZ 0.04345 0.07258 0.05810 -0.13442 -0.12950 123 9 C 1S -0.00722 0.00736 -0.00303 0.00155 0.01189 124 2S -0.14296 0.29167 0.13893 0.16216 0.33799 125 2PX -0.01764 0.04445 0.06412 0.03017 0.03347 126 2PY -0.02116 0.06562 0.10800 0.04542 0.05206 127 2PZ 0.02841 -0.10520 -0.05017 -0.10061 -0.16121 128 3S 0.94399 -0.68677 0.32722 0.12567 -0.46136 129 3PX 0.19666 -0.18429 -0.00059 0.01731 -0.15375 130 3PY 0.35406 -0.34951 0.02320 0.07229 -0.23572 131 3PZ -0.40000 0.44467 -0.22897 0.03280 0.29058 132 4XX -0.00670 -0.00358 -0.01558 0.06315 0.11651 133 4YY -0.03089 -0.11651 -0.20761 0.13898 0.17600 134 4ZZ 0.04363 0.16932 0.27831 -0.15075 -0.22273 135 4XY -0.00126 -0.15777 -0.20315 -0.04908 -0.09363 136 4XZ 0.02198 -0.07452 0.08464 -0.00929 -0.06859 137 4YZ -0.07336 0.06719 0.03326 0.01649 0.00329 138 10 C 1S 0.00241 0.00020 0.00863 0.00044 -0.00369 139 2S 0.12854 0.06911 0.28698 -0.12689 -0.26077 140 2PX -0.01628 -0.06274 -0.06373 -0.00074 -0.00944 141 2PY -0.02959 -0.10530 -0.09781 -0.01297 -0.04705 142 2PZ -0.03108 -0.02989 -0.11010 0.11842 0.18056 143 3S -0.72217 0.18335 -0.98183 0.04903 0.45553 144 3PX 0.04572 0.22389 0.09701 0.08736 0.07552 145 3PY 0.22077 0.12964 0.24928 0.08971 -0.07077 146 3PZ 0.42567 -0.23606 0.50045 -0.00663 -0.17049 147 4XX -0.04325 0.11475 0.04140 -0.08257 -0.08803 148 4YY 0.03091 -0.06878 -0.03482 -0.08726 -0.12505 149 4ZZ 0.00159 -0.02335 0.03306 0.11939 0.17129 150 4XY -0.01959 -0.06166 -0.13295 -0.00148 0.04272 151 4XZ 0.12075 -0.31253 -0.14120 -0.06938 -0.16678 152 4YZ -0.04959 -0.16804 -0.31597 0.01369 0.04846 153 11 H 1S -0.04562 0.15866 0.09355 -0.09705 -0.11158 154 2S -0.08353 0.00482 -0.13031 0.02123 0.03023 155 12 H 1S -0.01211 -0.01860 0.07682 0.04910 0.01796 156 2S 0.13407 -0.14068 0.03411 -0.00434 -0.10834 157 13 H 1S -0.07676 -0.17123 -0.18286 0.00522 0.05547 158 2S -0.13963 0.14246 0.02114 -0.08466 -0.05252 159 14 H 1S 0.05721 -0.05302 0.04959 -0.02825 -0.05952 160 2S 0.14577 -0.11861 0.03681 0.11113 0.01147 161 15 H 1S -0.04640 0.16867 0.06552 0.05857 0.10128 162 2S -0.04607 -0.00015 -0.10860 -0.08715 -0.09023 163 16 C 1S 0.01565 -0.00531 0.00486 -0.02356 0.01007 164 2S -0.22682 -0.33371 0.22464 -0.33159 0.13507 165 2PX -0.25003 0.02205 0.04865 -0.10586 0.12072 166 2PY 0.09803 0.06032 -0.07374 0.14012 -0.04752 167 2PZ 0.07615 0.01346 -0.01817 0.09594 -0.01467 168 3S -0.60863 0.56989 -0.41025 0.36736 -0.07990 169 3PX 1.56224 -0.52428 -0.33588 1.22793 -0.96358 170 3PY -0.80269 0.35615 -0.34398 -0.81302 0.52513 171 3PZ -0.42291 0.18260 -0.13062 -0.44588 0.33297 172 4XX 0.08334 -0.11437 0.03817 0.08698 -0.08905 173 4YY -0.04120 0.06505 0.03546 0.22068 0.15891 174 4ZZ -0.10067 -0.01567 -0.03434 -0.34404 -0.03944 175 4XY 0.11152 -0.07693 0.07186 0.20806 -0.21634 176 4XZ 0.08754 -0.06698 0.08714 0.13975 -0.12987 177 4YZ -0.09775 0.22237 -0.23104 0.21356 -0.25233 178 17 C 1S 0.00902 -0.00201 0.00132 -0.00939 0.00283 179 2S 0.37156 -0.08272 0.03722 -0.27776 0.09452 180 2PX 0.22547 0.00337 -0.05478 -0.04086 0.01952 181 2PY -0.05062 -0.13268 0.09609 -0.18692 0.08535 182 2PZ -0.02673 -0.07326 0.05309 -0.09775 0.03559 183 3S -0.63849 0.12893 -0.05173 0.03030 -0.08934 184 3PX -0.45073 0.09381 0.37290 -0.14554 -0.11887 185 3PY 0.18911 0.39855 -0.41079 -0.15203 0.29863 186 3PZ 0.03051 0.27977 -0.33867 -0.17410 0.00583 187 4XX -0.40313 -0.09294 0.05984 0.03407 0.01219 188 4YY 0.28560 0.06928 -0.00164 0.16443 0.08147 189 4ZZ 0.18800 0.01430 -0.07032 -0.23669 -0.07931 190 4XY 0.06046 0.18974 -0.12582 0.01219 0.17397 191 4XZ -0.00298 0.15893 -0.16881 -0.08830 -0.10768 192 4YZ -0.08088 0.18179 -0.18540 0.14179 -0.13481 193 18 C 1S 0.00961 -0.00356 0.00282 0.01051 -0.01297 194 2S 0.19854 0.18877 -0.11898 0.20541 -0.16564 195 2PX 0.00265 0.03758 -0.03024 0.23053 -0.15012 196 2PY 0.08612 0.11208 -0.08529 0.05962 -0.01874 197 2PZ 0.03474 0.06975 -0.05996 0.01200 -0.01630 198 3S -0.07521 -0.01616 -0.40559 0.14389 0.24775 199 3PX -0.00170 -0.07641 0.11949 0.16980 -0.09525 200 3PY -0.25397 -0.12885 -0.09547 0.01447 0.15448 201 3PZ -0.11892 -0.08421 -0.04143 0.01319 0.13710 202 4XX 0.02705 0.02919 -0.03358 -0.19531 0.15920 203 4YY -0.03156 -0.00983 0.03357 0.07070 -0.11649 204 4ZZ 0.06956 0.04382 -0.04892 0.17678 -0.06594 205 4XY 0.36902 0.06308 -0.06099 -0.04018 0.12180 206 4XZ 0.14779 0.08924 -0.13199 -0.10680 -0.09052 207 4YZ -0.09665 -0.07196 0.08977 -0.09129 0.09732 208 19 C 1S 0.00822 0.00214 -0.00347 0.03240 -0.02128 209 2S -0.30652 -0.14840 0.07935 0.55766 -0.37043 210 2PX 0.18981 0.06676 -0.05609 -0.14687 0.12292 211 2PY -0.12567 -0.08671 0.05720 0.12025 -0.07407 212 2PZ -0.06960 -0.05242 0.03941 0.07646 -0.03185 213 3S 0.48329 0.20784 0.19090 -1.09283 0.56940 214 3PX -0.18897 0.02123 -0.14649 0.67086 -0.35558 215 3PY 0.02124 0.11816 0.09424 -0.42174 0.22376 216 3PZ 0.04399 0.03920 0.11137 -0.18172 0.21406 217 4XX 0.19026 -0.11990 0.07336 -0.21328 0.07677 218 4YY -0.14365 0.11057 -0.08773 -0.05943 -0.02391 219 4ZZ -0.06135 -0.02332 0.05559 0.37342 -0.13511 220 4XY -0.22468 -0.16728 0.14526 -0.13225 0.16149 221 4XZ -0.18767 -0.03708 -0.02523 -0.15674 -0.02713 222 4YZ -0.01417 0.08541 -0.04011 -0.27476 0.28582 223 20 C 1S 0.00329 0.00374 0.00231 0.01442 -0.00530 224 2S 0.32963 -0.00139 0.05655 0.14734 -0.07847 225 2PX -0.19174 0.01901 -0.01031 0.03209 -0.02336 226 2PY -0.07688 0.00690 -0.00978 -0.17377 0.14122 227 2PZ -0.03651 0.00144 -0.00348 -0.09461 0.07426 228 3S 0.08065 -0.29584 -0.40318 0.14749 -0.25756 229 3PX 0.17569 0.15278 0.18457 0.02352 0.04742 230 3PY 0.12257 -0.13704 0.20027 -0.06180 0.02283 231 3PZ 0.04503 -0.05724 0.05813 -0.09918 -0.12031 232 4XX -0.17379 -0.15129 0.10009 0.06642 -0.07801 233 4YY 0.11414 0.11891 -0.11032 -0.17517 0.05471 234 4ZZ 0.16585 0.02912 0.00383 0.14599 -0.00059 235 4XY 0.16185 0.20645 -0.18423 -0.00099 -0.06169 236 4XZ 0.12312 0.08805 -0.03231 0.09847 0.18189 237 4YZ -0.00114 0.02739 -0.00754 -0.20492 0.16274 238 21 C 1S 0.01107 -0.00166 -0.00079 -0.00374 0.00615 239 2S 0.11165 0.22512 -0.16691 -0.12507 0.20679 240 2PX 0.18640 0.01209 -0.05712 0.22119 -0.16762 241 2PY -0.07602 -0.14040 0.09977 0.02463 -0.06123 242 2PZ -0.04746 -0.07501 0.05691 0.00914 -0.01833 243 3S -0.76694 0.03703 0.63531 -0.33522 0.19684 244 3PX -0.37725 0.10753 -0.07877 0.25450 0.03325 245 3PY 0.47793 -0.19724 -0.23723 0.16226 -0.21072 246 3PZ 0.26096 -0.11411 -0.12516 0.11619 -0.02576 247 4XX 0.19232 0.08065 -0.05473 0.10623 -0.13099 248 4YY -0.18862 -0.08087 0.03871 -0.00689 0.12665 249 4ZZ 0.02927 0.05022 -0.01426 -0.12141 0.04291 250 4XY 0.29409 0.04577 -0.05638 -0.09302 0.04039 251 4XZ 0.18082 0.01699 -0.00523 -0.04261 0.04145 252 4YZ -0.17812 -0.12738 0.04925 0.05599 -0.15838 253 22 H 1S 0.09766 0.15684 -0.03655 0.00078 0.02883 254 2S -0.14108 0.06721 0.03511 -0.08235 0.06490 255 23 H 1S 0.01290 -0.00226 0.00344 -0.04578 0.03648 256 2S -0.05937 -0.01542 -0.05507 -0.01621 0.00483 257 24 H 1S -0.26779 -0.11749 0.10237 -0.01899 0.01662 258 2S 0.07671 0.01431 0.05044 -0.21842 0.12458 259 25 H 1S -0.04948 0.01876 -0.04249 0.00708 0.02371 260 2S -0.08131 -0.03904 -0.00937 0.00364 0.05783 261 26 H 1S 0.21266 -0.08471 0.09211 -0.05118 -0.07171 262 2S -0.08018 0.23671 0.00650 -0.15943 0.08729 263 27 H 1S -0.01951 0.00119 -0.05371 0.00919 -0.03967 264 2S 0.14763 -0.12682 -0.03334 0.18382 -0.11819 211 212 213 214 215 V V V V V Eigenvalues -- 2.10596 2.11230 2.11932 2.13937 2.15534 1 1 C 1S 0.00012 0.00347 -0.00330 -0.00608 0.00500 2 2S -0.00058 -0.06717 0.03266 -0.08966 0.17204 3 2PX -0.00696 0.00619 -0.07079 -0.02845 -0.05513 4 2PY -0.00223 0.01030 0.04104 0.03833 -0.01507 5 2PZ 0.01343 0.01218 -0.00853 0.02085 0.00376 6 3S -0.08017 -0.52197 -0.03214 0.43470 -0.57145 7 3PX 0.25527 -1.08198 -0.10299 -0.00665 0.44840 8 3PY 0.07744 -0.07367 -0.16445 -0.21992 -0.10735 9 3PZ 0.15563 0.04221 -0.21599 -0.18669 -0.00277 10 4XX -0.02560 0.11176 -0.00326 -0.01828 -0.00255 11 4YY 0.13486 -0.07178 -0.02595 0.07530 0.08943 12 4ZZ -0.10573 -0.04215 0.02713 -0.02808 -0.12278 13 4XY 0.07528 -0.02991 0.00508 0.06352 -0.05702 14 4XZ -0.04053 -0.03733 -0.00541 0.03837 -0.06440 15 4YZ -0.02025 -0.10792 0.03389 0.04812 -0.10369 16 2 C 1S -0.00285 0.00904 -0.00545 0.00366 -0.03120 17 2S -0.01230 -0.08683 0.07368 0.21165 -0.27166 18 2PX 0.01740 -0.09743 0.00214 0.00774 -0.01796 19 2PY -0.02083 0.00873 0.01030 -0.00775 -0.04158 20 2PZ 0.01874 0.02352 -0.04520 -0.03014 0.00560 21 3S 0.33851 -0.53363 0.18324 -0.26147 1.43978 22 3PX 0.09110 -0.14281 -0.35800 -0.23951 -0.05135 23 3PY 0.06195 -0.02500 -0.14776 0.04382 -0.15030 24 3PZ -0.14016 -0.34308 0.48310 0.46138 0.29284 25 4XX -0.00356 0.00137 -0.08134 -0.04004 -0.04237 26 4YY 0.00629 0.06715 -0.11793 -0.04273 -0.11965 27 4ZZ -0.00016 -0.05139 0.16823 0.03087 0.18083 28 4XY 0.02294 -0.02011 0.02302 0.06034 0.13597 29 4XZ -0.08795 0.04299 -0.06061 -0.10852 -0.24738 30 4YZ -0.05707 -0.07120 0.21115 0.10143 0.12529 31 3 H 1S 0.00135 0.14454 -0.27333 -0.13566 -0.36767 32 2S 0.02188 0.07644 -0.07649 -0.09908 -0.12156 33 4 Br 1S -0.00065 -0.00109 0.00225 0.00208 -0.00020 34 2S 0.00200 0.00432 -0.00806 -0.00812 0.00310 35 3S 0.00264 0.00129 -0.00570 -0.00281 -0.00662 36 4S -0.01569 -0.02502 0.05392 0.04816 -0.00526 37 5S -0.01878 0.02256 0.04730 0.00984 -0.04623 38 6S 0.06779 0.02000 -0.25475 -0.15329 0.09342 39 7PX -0.00056 -0.00132 0.00081 0.00112 0.00050 40 7PY 0.00262 0.00204 -0.00574 -0.00523 0.00073 41 7PZ -0.00094 -0.00127 0.00313 0.00320 0.00064 42 8PX 0.00180 0.00430 -0.00252 -0.00371 -0.00154 43 8PY -0.00865 -0.00659 0.01884 0.01711 -0.00266 44 8PZ 0.00310 0.00410 -0.01011 -0.01050 -0.00185 45 9PX -0.00601 -0.01324 -0.00067 0.01428 -0.00348 46 9PY 0.03509 0.01638 -0.06834 -0.05693 0.01937 47 9PZ -0.01017 -0.01213 0.03047 0.03867 -0.00097 48 10PX -0.00101 -0.01781 0.07420 0.01656 0.06634 49 10PY 0.00605 0.06328 -0.03154 -0.06885 -0.01084 50 10PZ -0.03181 -0.01371 0.03465 0.00534 -0.01645 51 11XX -0.00338 -0.00359 0.00593 0.00592 0.00131 52 11YY -0.00213 0.00349 0.00239 -0.00321 0.00396 53 11ZZ 0.00023 -0.00388 0.00406 0.00541 0.00619 54 11XY -0.00103 -0.00397 0.00832 0.00174 0.00209 55 11XZ 0.00194 0.00131 -0.00547 -0.00120 -0.00437 56 11YZ -0.00205 -0.00359 0.00772 0.00361 0.00335 57 12XX -0.02951 -0.03442 0.12383 0.08537 0.00163 58 12YY -0.05380 -0.08883 0.17537 0.17654 -0.03603 59 12ZZ -0.05992 -0.02650 0.13702 0.09235 -0.04747 60 12XY 0.00860 0.03233 -0.06380 -0.02198 -0.02643 61 12XZ -0.01214 -0.01350 0.04203 0.01478 0.03428 62 12YZ 0.02437 0.02927 -0.06322 -0.04167 -0.00613 63 5 C 1S -0.01070 -0.00146 -0.01174 -0.02479 0.03180 64 2S -0.10965 -0.01627 -0.15309 -0.38209 0.55544 65 2PX 0.04279 -0.00492 0.02464 0.04147 -0.04420 66 2PY 0.05297 0.00235 0.06143 0.10491 -0.10364 67 2PZ 0.01400 0.00322 -0.00128 -0.02169 -0.08389 68 3S 0.44489 0.01378 0.35555 1.09368 -1.01397 69 3PX -0.18906 -0.11212 -0.19652 -0.07177 -0.15036 70 3PY -0.31591 -0.08162 -0.33104 -0.33950 0.04760 71 3PZ -0.11730 0.30280 -0.62763 -0.85451 -0.73311 72 4XX -0.09686 0.03092 -0.00299 -0.26850 0.40812 73 4YY 0.01149 -0.02445 -0.25474 -0.00251 -0.12812 74 4ZZ 0.06679 -0.01117 0.22877 0.23693 -0.23039 75 4XY 0.05899 0.05042 0.11604 0.08149 -0.16635 76 4XZ -0.10283 0.05375 -0.12388 0.15919 0.02062 77 4YZ 0.00490 -0.06698 0.18614 -0.10908 0.04778 78 6 C 1S -0.00322 -0.00583 0.01239 0.00853 0.02967 79 2S -0.04444 -0.05897 0.05537 0.02206 0.44146 80 2PX -0.03046 0.01501 -0.08400 -0.09955 0.04220 81 2PY -0.00480 0.01717 -0.10011 -0.14812 -0.02108 82 2PZ -0.03128 0.01431 -0.17525 -0.17736 0.13571 83 3S -0.14416 0.25018 -0.62633 -0.78529 -1.11894 84 3PX -0.06579 0.06261 -0.00970 0.17037 0.19350 85 3PY -0.01438 -0.05520 0.37628 -0.02991 0.32818 86 3PZ -0.17759 0.07048 -0.20686 -0.52162 -0.51402 87 4XX 0.04154 -0.05116 0.15707 -0.25230 0.10432 88 4YY -0.04801 0.06315 -0.30410 0.21376 0.10240 89 4ZZ 0.00532 -0.01666 0.13262 0.04603 -0.17722 90 4XY 0.10495 0.03254 0.00253 -0.19431 -0.31898 91 4XZ -0.06686 0.12365 -0.20071 0.05830 -0.04134 92 4YZ 0.08014 -0.01750 -0.05668 -0.07660 -0.17906 93 7 C 1S 0.00098 -0.00373 0.01919 0.02023 0.00387 94 2S -0.03195 -0.08978 0.45056 0.31023 0.05086 95 2PX -0.02398 -0.01927 0.05273 -0.03608 0.10786 96 2PY -0.04756 -0.03323 0.03158 -0.01343 0.20629 97 2PZ -0.00500 -0.03527 0.20644 0.14504 -0.05526 98 3S 0.17946 0.12491 -0.20837 -0.08523 -0.03647 99 3PX -0.00917 -0.02363 0.15527 -0.27765 0.11528 100 3PY -0.09967 -0.00952 -0.06120 0.00077 0.17680 101 3PZ 0.17065 0.11941 -0.36676 -0.08572 -0.08198 102 4XX 0.06391 -0.09525 0.36491 0.04541 -0.06985 103 4YY -0.07993 0.05224 -0.14705 0.02730 0.09962 104 4ZZ 0.01654 0.02138 -0.10823 0.01523 -0.01855 105 4XY 0.00772 0.02099 -0.21519 -0.35866 -0.09227 106 4XZ 0.05837 -0.01060 0.29406 -0.26866 0.04875 107 4YZ -0.02942 -0.01004 -0.02931 0.30765 0.03218 108 8 C 1S 0.00898 0.00091 0.01256 0.02095 -0.02391 109 2S 0.13966 0.02118 0.19865 0.31026 -0.28998 110 2PX 0.02184 -0.00452 0.04516 0.06906 -0.04689 111 2PY 0.03052 -0.00224 0.09359 0.10649 -0.02888 112 2PZ 0.02974 0.04158 -0.13723 -0.10433 -0.13373 113 3S -0.42651 -0.08553 -0.35074 -0.73283 0.61455 114 3PX -0.12510 -0.06279 -0.18405 -0.23607 0.15522 115 3PY -0.24848 -0.03716 -0.19773 -0.46317 0.49344 116 3PZ -0.04457 0.00878 -0.09191 -0.14921 0.05857 117 4XX 0.10224 -0.04031 0.03057 0.28529 -0.36274 118 4YY 0.01559 0.06318 0.07654 -0.05784 0.03987 119 4ZZ -0.10060 -0.02349 -0.06646 -0.17704 0.28337 120 4XY -0.04391 -0.02420 -0.18594 -0.07531 0.06412 121 4XZ 0.02494 -0.05034 0.20550 -0.16767 -0.14936 122 4YZ -0.04813 -0.01189 0.15368 0.23971 0.04080 123 9 C 1S 0.00416 0.00368 -0.00747 -0.00529 -0.02186 124 2S 0.10392 0.08595 -0.27520 -0.09909 -0.30626 125 2PX 0.00382 0.02720 -0.12191 -0.06179 0.01944 126 2PY 0.02257 0.03762 -0.19225 -0.16380 -0.02425 127 2PZ -0.06426 -0.02000 -0.00398 -0.11489 0.16294 128 3S 0.16738 0.02160 0.21443 0.34313 0.27782 129 3PX -0.02962 0.04927 -0.11259 0.18307 0.22931 130 3PY 0.07475 -0.00974 0.09223 -0.03736 0.15916 131 3PZ -0.03272 0.05232 -0.33984 -0.26326 -0.07929 132 4XX 0.00603 0.09899 -0.34472 0.21426 -0.18592 133 4YY 0.09146 -0.03758 0.18821 -0.25494 -0.00421 134 4ZZ -0.06247 -0.03565 0.08571 0.01828 0.10642 135 4XY -0.12014 -0.02608 -0.01737 0.22071 0.32164 136 4XZ 0.04160 -0.07501 0.07057 -0.11147 -0.10599 137 4YZ -0.05048 0.01718 -0.02576 0.07816 0.25155 138 10 C 1S -0.00129 0.00480 -0.01761 -0.02110 0.00042 139 2S -0.00666 0.04471 -0.15501 -0.26103 -0.01157 140 2PX -0.01747 -0.02778 0.04750 -0.03059 0.16014 141 2PY -0.05700 -0.03729 0.01967 -0.00255 0.23060 142 2PZ 0.03888 0.01084 0.01116 0.09073 -0.05584 143 3S -0.22307 -0.32313 0.37590 0.44569 0.37252 144 3PX 0.10227 0.02288 -0.01415 -0.23093 0.09936 145 3PY 0.08132 0.04395 -0.36447 0.09436 0.16511 146 3PZ 0.18838 0.14660 -0.21888 -0.20485 -0.16358 147 4XX -0.09803 0.04257 -0.13281 0.04118 0.16995 148 4YY 0.01177 -0.08051 0.27418 -0.03742 -0.06388 149 4ZZ 0.06244 0.03905 -0.17036 -0.06365 -0.11501 150 4XY -0.01626 -0.03035 0.22560 0.37985 0.04519 151 4XZ -0.07037 0.01154 -0.28209 0.27388 -0.04140 152 4YZ 0.00910 -0.01014 0.18633 -0.25252 0.08633 153 11 H 1S -0.06149 -0.03706 0.15585 0.04977 0.07097 154 2S -0.04072 -0.01232 0.02578 0.03181 -0.03302 155 12 H 1S 0.02307 0.00897 -0.03577 0.00449 -0.00429 156 2S 0.00263 -0.01616 0.08098 0.05315 0.08012 157 13 H 1S -0.00572 -0.00345 -0.02767 -0.04042 0.04875 158 2S -0.07397 -0.01576 -0.07230 -0.14494 0.15508 159 14 H 1S -0.00577 -0.00465 0.00944 -0.01019 -0.00637 160 2S 0.03317 0.03312 -0.11214 -0.05544 -0.00259 161 15 H 1S 0.00198 0.00172 -0.12739 -0.06164 -0.02901 162 2S -0.02759 0.01162 -0.03896 -0.08669 -0.15682 163 16 C 1S 0.00324 -0.00673 0.00161 0.00300 0.00245 164 2S 0.06351 -0.05775 0.00447 0.08307 -0.04749 165 2PX 0.00773 0.01384 0.05569 0.03385 0.03963 166 2PY -0.00420 -0.00490 0.03370 0.04318 -0.02157 167 2PZ 0.00249 -0.00453 0.01274 0.02286 -0.02085 168 3S -0.15131 0.42954 -0.49939 -0.58791 -0.22900 169 3PX -0.31979 0.37615 -0.13315 -0.08862 -0.10602 170 3PY -0.21859 1.47022 0.38597 0.00276 0.10222 171 3PZ -0.14457 0.78485 0.25715 0.00771 -0.02188 172 4XX -0.03947 0.16157 0.01827 -0.00817 -0.02497 173 4YY -0.08575 -0.13944 -0.05359 0.02282 0.12489 174 4ZZ 0.13855 -0.04228 0.02425 -0.01535 -0.09904 175 4XY -0.17430 -0.05795 0.06635 0.00282 -0.03403 176 4XZ 0.26292 0.05526 -0.07688 0.01536 0.04736 177 4YZ 0.06409 0.01434 0.04923 -0.00799 -0.06804 178 17 C 1S 0.00826 -0.03515 -0.01265 -0.00705 0.00436 179 2S 0.08638 -0.35457 -0.16595 -0.07559 0.03013 180 2PX 0.02470 -0.12328 -0.08030 -0.09319 0.05201 181 2PY -0.02151 0.12518 0.01743 0.03024 -0.04648 182 2PZ 0.02425 0.07502 0.03130 0.01549 -0.04957 183 3S -0.21378 1.47498 0.81501 0.60645 -0.25768 184 3PX -0.08424 0.59820 0.65182 0.50900 -0.02666 185 3PY -0.24023 0.48337 0.24194 -0.05606 0.24143 186 3PZ 0.14718 0.34127 0.06495 -0.02018 0.23150 187 4XX 0.01164 0.06915 -0.00539 -0.00896 -0.00248 188 4YY -0.02735 0.06065 0.02764 0.02969 0.08097 189 4ZZ 0.03412 -0.19363 -0.04263 -0.04080 -0.06145 190 4XY -0.12189 -0.32671 -0.04544 0.02024 -0.05537 191 4XZ 0.44171 -0.03571 -0.00639 0.04458 0.06802 192 4YZ -0.07473 0.24319 0.10269 0.00369 -0.04601 193 18 C 1S 0.00650 -0.03068 -0.00390 0.00230 0.00100 194 2S 0.12765 -0.50293 -0.02293 0.10790 -0.03766 195 2PX -0.05933 0.11971 0.04913 0.01265 -0.00266 196 2PY 0.07334 -0.20508 -0.02105 0.03399 -0.00304 197 2PZ -0.00222 -0.12466 -0.01683 0.01046 -0.02506 198 3S -0.23921 0.45058 -0.46242 -0.66264 0.15935 199 3PX -0.03063 0.08902 0.01885 0.06277 -0.17911 200 3PY 0.00188 0.36006 -0.27610 -0.34066 0.10872 201 3PZ -0.32891 0.09465 -0.08419 -0.22807 -0.12338 202 4XX -0.05567 0.31862 0.08728 0.01344 -0.00216 203 4YY 0.39559 0.01953 -0.07012 0.04219 0.13999 204 4ZZ -0.31030 -0.47764 -0.04827 -0.05625 -0.13645 205 4XY -0.00764 -0.01523 -0.05556 -0.03561 0.10247 206 4XZ -0.00544 -0.01989 0.02812 -0.04477 -0.11185 207 4YZ -0.33997 0.17187 0.07372 -0.01468 -0.15642 208 19 C 1S -0.00366 -0.00172 0.00026 0.00020 -0.00240 209 2S -0.05753 -0.01877 -0.00799 -0.00698 -0.04325 210 2PX -0.03014 0.17497 0.03396 -0.01179 0.01769 211 2PY -0.05796 0.17479 0.05660 0.01256 -0.01928 212 2PZ -0.02062 0.09197 0.02177 0.00937 0.00769 213 3S 0.17061 0.07130 0.37792 0.37610 0.11869 214 3PX -0.10897 0.00698 -0.15475 -0.16053 -0.07075 215 3PY 0.04014 0.04308 0.20367 0.20915 -0.12727 216 3PZ 0.12422 0.04114 0.03361 0.14215 0.10033 217 4XX -0.04468 0.14819 -0.01206 -0.06979 0.02866 218 4YY 0.13299 -0.07880 0.05285 0.05090 -0.02706 219 4ZZ -0.09387 -0.08216 -0.02444 0.04127 -0.01196 220 4XY 0.15171 0.06599 -0.04147 0.02998 0.11446 221 4XZ -0.24434 -0.04907 0.06634 -0.04259 -0.23765 222 4YZ -0.01961 -0.09427 -0.06821 -0.02205 0.03463 223 20 C 1S -0.00716 0.02654 0.01105 0.00471 0.00018 224 2S -0.13644 0.48135 0.14935 0.03277 0.00809 225 2PX 0.06720 -0.24972 -0.04051 0.01437 -0.00211 226 2PY -0.00472 0.05427 0.00785 0.00613 -0.01160 227 2PZ 0.03068 0.04748 0.00974 0.01130 0.01493 228 3S 0.00063 -0.55035 -0.60991 -0.44692 -0.12140 229 3PX -0.03474 0.39282 0.37133 0.25460 0.06405 230 3PY -0.10981 0.12907 0.08889 0.10451 -0.03356 231 3PZ 0.15485 0.13252 0.08407 0.05364 -0.08244 232 4XX -0.00360 -0.06710 -0.00156 0.01404 -0.01480 233 4YY -0.01713 -0.11143 0.01109 -0.02718 -0.04644 234 4ZZ -0.01991 0.30502 0.00762 -0.00505 0.06534 235 4XY 0.17737 0.16354 0.05325 0.01347 0.00328 236 4XZ -0.38254 -0.04611 -0.00576 -0.01530 0.02025 237 4YZ 0.14907 -0.36271 -0.14136 -0.01300 0.06344 238 21 C 1S -0.00642 0.02456 0.00469 0.00004 0.00163 239 2S -0.05681 0.27859 0.03916 -0.01372 0.02061 240 2PX -0.07370 0.19476 0.04773 0.00134 -0.02786 241 2PY 0.04020 -0.08668 -0.03119 -0.00588 -0.00415 242 2PZ -0.02622 -0.06418 -0.01379 -0.00676 -0.00628 243 3S 0.36307 -0.91621 0.25593 0.35647 0.11095 244 3PX -0.07616 0.25427 0.08758 0.00982 0.09953 245 3PY -0.06230 0.38766 -0.15989 -0.14777 -0.14051 246 3PZ -0.30370 0.12645 -0.08606 -0.08674 -0.05446 247 4XX 0.04660 -0.28241 -0.07801 -0.03345 0.00535 248 4YY -0.37750 0.04857 0.05426 -0.01095 -0.04650 249 4ZZ 0.32028 0.29337 0.05223 0.05650 0.05191 250 4XY -0.04962 0.27193 0.03835 -0.04353 0.04363 251 4XZ -0.05051 0.14653 -0.01757 -0.04299 -0.05585 252 4YZ 0.26584 0.02940 -0.04511 -0.00371 -0.01438 253 22 H 1S 0.04770 -0.17819 0.00029 0.02432 0.04892 254 2S 0.03767 -0.02301 0.02468 0.00779 0.01662 255 23 H 1S -0.00627 0.01580 -0.03054 -0.03129 0.00612 256 2S 0.01878 -0.12112 -0.09204 -0.06812 -0.00117 257 24 H 1S 0.01881 -0.00103 0.02666 0.05119 -0.03441 258 2S 0.03781 0.00092 0.04908 0.06148 0.00399 259 25 H 1S 0.00272 -0.02765 -0.00487 -0.01821 0.01144 260 2S -0.03847 0.11805 -0.06542 -0.08866 -0.01635 261 26 H 1S -0.03379 0.12162 0.05119 -0.00284 0.00175 262 2S -0.05359 0.12736 0.25741 0.06656 0.24977 263 27 H 1S -0.07928 0.18724 0.03954 -0.06514 0.09394 264 2S -0.05713 0.09990 0.12729 0.11642 0.02609 216 217 218 219 220 V V V V V Eigenvalues -- 2.17697 2.18975 2.22978 2.24127 2.25615 1 1 C 1S 0.00066 -0.00720 0.01737 -0.00096 0.01430 2 2S -0.05663 0.08885 0.00902 0.05618 0.27642 3 2PX 0.01405 -0.22830 0.05790 0.02779 0.03683 4 2PY 0.00082 0.04188 -0.01321 -0.00819 -0.05368 5 2PZ 0.01102 0.03795 0.01985 -0.03265 -0.03919 6 3S -0.10842 -0.32712 -0.91538 -0.05716 -1.44168 7 3PX -0.41135 0.16465 -0.54021 0.24400 0.34274 8 3PY 0.14076 0.12500 0.50278 0.07851 0.43107 9 3PZ 0.15289 0.02712 0.35181 -0.06135 0.33364 10 4XX -0.01250 -0.26140 0.09827 -0.01223 0.08380 11 4YY 0.12130 0.21725 -0.18678 -0.11867 -0.10264 12 4ZZ -0.09544 0.03455 0.08710 0.11177 -0.06055 13 4XY -0.11505 0.20816 -0.03017 -0.20729 -0.31441 14 4XZ 0.23626 0.08403 -0.04235 0.08975 -0.27468 15 4YZ -0.07150 0.24504 -0.17206 0.09120 -0.20205 16 2 C 1S 0.00597 0.00140 0.01203 -0.01753 -0.04589 17 2S 0.01978 0.02900 -0.03151 -0.09889 -0.44168 18 2PX 0.00402 0.12129 -0.03445 -0.00615 -0.08097 19 2PY -0.00234 0.04596 -0.02430 0.00601 -0.06407 20 2PZ 0.02929 0.02994 0.06145 -0.03644 0.00242 21 3S -0.22059 -0.03610 -0.37098 0.82673 2.51920 22 3PX -0.10610 0.02211 0.16724 -0.03940 0.07924 23 3PY -0.14836 0.14683 -0.00049 -0.54186 -1.12884 24 3PZ -0.21485 0.18326 -0.25240 -0.10691 -0.52770 25 4XX -0.00466 -0.27846 0.12670 0.01803 0.04681 26 4YY 0.16850 0.11268 0.22175 -0.00509 0.17890 27 4ZZ -0.15324 0.21897 -0.32747 -0.02000 -0.19599 28 4XY -0.10830 -0.10721 -0.03387 -0.06292 0.07120 29 4XZ 0.20168 -0.18136 -0.04088 0.18501 -0.08997 30 4YZ -0.17040 -0.03494 -0.38884 0.26066 0.22058 31 3 H 1S 0.23086 -0.19469 0.35729 -0.06614 -0.05845 32 2S 0.02525 -0.02112 -0.01240 0.08913 0.17312 33 4 Br 1S -0.00251 -0.00021 -0.00466 0.00223 -0.00065 34 2S 0.01358 -0.00218 0.02151 -0.00863 0.00416 35 3S -0.00871 0.00919 -0.00405 -0.00290 -0.00302 36 4S -0.05430 -0.00437 -0.10636 0.05028 -0.01985 37 5S 0.07143 0.07099 -0.05798 -0.01363 -0.22651 38 6S 0.05915 -0.10659 0.52981 -0.14409 0.54594 39 7PX 0.00059 0.00032 -0.00157 0.00163 0.00024 40 7PY 0.00190 0.00179 0.00698 -0.00429 0.00356 41 7PZ -0.00106 -0.00090 -0.00356 0.00207 0.00006 42 8PX -0.00198 -0.00111 0.00504 -0.00525 -0.00065 43 8PY -0.00580 -0.00561 -0.02259 0.01381 -0.01234 44 8PZ 0.00316 0.00270 0.01130 -0.00659 0.00010 45 9PX 0.01057 0.00577 -0.01286 0.01623 -0.00533 46 9PY -0.00164 0.00735 0.06413 -0.03848 0.07178 47 9PZ 0.00327 0.00458 -0.02381 0.01202 -0.01647 48 10PX -0.02557 -0.00078 -0.02965 -0.00167 0.03905 49 10PY 0.08040 0.01578 0.03027 -0.02547 -0.07017 50 10PZ -0.02558 -0.05614 -0.02855 0.07749 0.09679 51 11XX -0.00005 -0.01000 -0.00468 0.00745 0.00311 52 11YY 0.00956 -0.00512 0.00537 0.00109 0.00177 53 11ZZ 0.00023 -0.00147 -0.00172 0.00084 0.00142 54 11XY -0.00032 0.00182 -0.00418 0.00199 -0.00122 55 11XZ 0.00300 0.00238 0.00540 -0.00470 -0.00580 56 11YZ -0.00990 -0.00525 -0.01206 0.00724 0.00551 57 12XX -0.05284 0.03728 -0.21396 0.07678 -0.12588 58 12YY -0.12230 0.00793 -0.29758 0.12041 -0.16972 59 12ZZ -0.04788 -0.02107 -0.22741 0.12973 -0.10515 60 12XY 0.00397 -0.01457 0.03243 -0.01267 0.00589 61 12XZ -0.01766 -0.01327 -0.04052 0.03134 0.03987 62 12YZ 0.05786 0.03660 0.08015 -0.05649 -0.02587 63 5 C 1S 0.00072 0.00436 0.00138 0.00732 0.02371 64 2S -0.00106 0.22110 -0.05166 -0.01901 0.10483 65 2PX 0.02104 0.02720 0.02110 -0.03731 -0.06027 66 2PY 0.00944 -0.00427 0.04392 -0.02804 -0.03943 67 2PZ -0.04432 -0.02447 -0.14465 0.05756 -0.04805 68 3S -0.18378 -0.11404 -0.04781 -0.40586 -0.82964 69 3PX -0.01631 0.21655 0.25114 -0.50347 -1.21040 70 3PY 0.04632 0.38726 0.57074 -0.65625 -1.18351 71 3PZ -0.39440 -0.13169 -1.20171 0.70781 -0.43867 72 4XX -0.12417 -0.12060 -0.03860 -0.02060 0.13191 73 4YY 0.11364 0.27939 0.11069 -0.05045 -0.18634 74 4ZZ -0.00205 -0.15645 -0.05624 0.06934 0.07295 75 4XY -0.03530 -0.14511 -0.00577 -0.05264 -0.10558 76 4XZ 0.04746 -0.02584 0.14262 0.00552 -0.19542 77 4YZ -0.02946 0.10009 -0.13192 -0.02744 0.00265 78 6 C 1S 0.00922 0.00957 0.01913 -0.01137 0.01158 79 2S 0.14991 0.26309 0.36010 -0.23120 0.10492 80 2PX -0.04438 0.01373 -0.05920 0.03722 0.00358 81 2PY -0.07692 -0.00980 -0.15107 0.07910 0.03800 82 2PZ -0.00840 0.08354 0.02534 -0.02482 0.01668 83 3S -0.31855 -0.47428 -0.79322 0.57098 -0.63579 84 3PX -0.05409 0.03401 -0.35449 0.25954 0.24836 85 3PY -0.02620 0.13986 -0.51912 0.25563 0.07467 86 3PZ -0.22258 -0.16470 -0.76299 0.47144 -0.39951 87 4XX 0.12879 -0.02371 0.24327 -0.05774 0.00779 88 4YY -0.07616 0.03223 -0.00039 -0.04895 0.11414 89 4ZZ -0.02114 -0.00880 -0.18097 0.07575 -0.13916 90 4XY -0.03082 -0.10006 -0.06510 0.06025 -0.13240 91 4XZ -0.03064 -0.17285 0.03778 0.13578 0.16136 92 4YZ -0.04538 -0.04913 -0.11827 0.04446 0.05069 93 7 C 1S 0.01134 -0.00421 0.02289 -0.00909 0.00529 94 2S 0.14386 -0.02327 0.13528 -0.02621 0.04462 95 2PX 0.03742 0.05246 0.05789 -0.03209 -0.02784 96 2PY 0.01683 0.09833 0.02757 -0.05585 0.00909 97 2PZ 0.03169 -0.04273 -0.03836 0.04689 0.01482 98 3S -0.26284 0.12791 -0.78470 0.32788 0.07482 99 3PX -0.06181 -0.10427 -0.19073 0.05215 -0.19836 100 3PY -0.07432 0.15970 -0.33707 0.20335 0.20271 101 3PZ -0.14781 0.12143 -0.16449 -0.02702 -0.01371 102 4XX 0.10809 0.00802 0.07855 0.00186 0.12487 103 4YY -0.09351 -0.06642 -0.12825 0.03422 -0.11711 104 4ZZ 0.00961 0.04460 0.06083 -0.03719 -0.00045 105 4XY -0.13048 0.03602 -0.28610 0.16743 0.09999 106 4XZ 0.01017 -0.27000 0.07322 -0.08050 -0.33026 107 4YZ 0.01134 0.10216 -0.00612 0.05017 0.29693 108 8 C 1S 0.00145 -0.01148 0.00006 0.00557 0.00546 109 2S 0.01114 -0.13978 -0.01476 0.05358 0.05827 110 2PX 0.01583 -0.00045 0.01603 0.01944 0.06034 111 2PY 0.01248 -0.05827 0.02865 -0.01181 0.00746 112 2PZ -0.09292 -0.03786 -0.18496 0.10091 -0.00921 113 3S -0.02683 0.11460 0.03357 -0.01418 -0.04406 114 3PX 0.05432 0.31453 0.06144 0.05498 0.25265 115 3PY -0.07060 0.00036 0.03177 -0.09925 -0.19949 116 3PZ -0.04184 -0.03071 -0.03794 -0.00671 -0.04404 117 4XX 0.09660 0.20155 0.02182 0.16025 0.43022 118 4YY -0.05707 -0.36841 0.04102 -0.09349 -0.33199 119 4ZZ -0.04203 0.11532 -0.07576 -0.03420 -0.04537 120 4XY 0.03925 0.25747 0.00677 0.03154 0.22525 121 4XZ 0.15973 0.09096 0.14317 0.09800 -0.04735 122 4YZ -0.08788 -0.14533 -0.22896 0.04287 0.01598 123 9 C 1S -0.01147 -0.00983 -0.02359 0.01577 0.00158 124 2S -0.10783 -0.07453 -0.07929 0.07246 0.02888 125 2PX -0.05350 0.01304 -0.03906 -0.01656 0.00492 126 2PY -0.03583 0.04956 0.00643 -0.01455 -0.01056 127 2PZ -0.01942 0.07484 -0.06213 -0.00481 -0.03047 128 3S 0.33495 0.14184 0.53503 -0.40169 0.10618 129 3PX -0.01310 -0.15647 0.07112 -0.17114 -0.17339 130 3PY 0.19482 0.17938 0.26435 -0.14375 0.16477 131 3PZ -0.06514 -0.11975 0.04368 0.01696 0.05957 132 4XX -0.13413 -0.15586 -0.13981 0.09472 -0.06045 133 4YY 0.06492 0.08419 0.04054 0.00156 0.15782 134 4ZZ 0.04308 0.05132 0.07816 -0.08101 -0.09011 135 4XY 0.05461 -0.01590 0.16663 -0.10136 0.00677 136 4XZ 0.19855 0.31599 0.25175 0.06438 0.26439 137 4YZ -0.03696 -0.11381 0.07442 -0.16756 -0.14249 138 10 C 1S -0.01182 -0.00208 -0.02611 0.01500 0.00947 139 2S -0.14772 0.05816 -0.34978 0.14335 -0.01518 140 2PX 0.01612 0.04401 0.04669 -0.04791 0.04258 141 2PY 0.03645 0.09131 0.11401 -0.06087 0.03804 142 2PZ 0.03023 -0.04320 0.07535 -0.01979 0.03202 143 3S 0.35460 0.19434 1.20803 -0.70144 -0.44039 144 3PX 0.16061 0.10159 0.42980 -0.23855 0.22224 145 3PY 0.22560 0.04453 0.72278 -0.51952 -0.11494 146 3PZ -0.19337 -0.05389 -0.60804 0.32959 0.29121 147 4XX -0.19364 -0.14225 -0.31761 0.13228 0.15746 148 4YY 0.15510 0.05253 0.06976 0.05889 -0.02290 149 4ZZ 0.00567 0.08758 0.19029 -0.15573 -0.13991 150 4XY 0.04225 -0.12524 0.09241 -0.04561 0.04658 151 4XZ 0.00860 0.04127 -0.02156 -0.02981 -0.30139 152 4YZ -0.05142 -0.00598 -0.15825 0.07772 0.12661 153 11 H 1S -0.01270 -0.06530 -0.13547 0.12852 0.11521 154 2S 0.02558 0.01877 0.11843 -0.08645 -0.16459 155 12 H 1S 0.00252 0.01999 0.03336 -0.02062 -0.01026 156 2S 0.04187 0.05054 0.03760 -0.04275 -0.01301 157 13 H 1S -0.01763 0.02865 0.01189 -0.02350 -0.02094 158 2S -0.01006 0.04290 0.00588 -0.00928 0.01001 159 14 H 1S -0.00889 0.01121 -0.02826 0.00315 -0.01541 160 2S -0.04714 0.04054 -0.05308 -0.00763 -0.01540 161 15 H 1S -0.00320 -0.05138 0.08630 -0.00404 0.11625 162 2S -0.02168 -0.01939 -0.04756 0.00753 -0.18794 163 16 C 1S -0.00096 -0.00209 -0.00511 0.00008 -0.00652 164 2S 0.01719 0.07232 -0.05046 -0.05912 -0.22199 165 2PX -0.01611 0.06377 -0.06949 0.04128 0.06199 166 2PY 0.02936 0.16411 -0.06836 -0.01851 -0.17649 167 2PZ -0.02598 0.09781 -0.01769 -0.04429 -0.09141 168 3S 0.05430 -0.14407 0.42237 0.12593 0.68369 169 3PX -0.07960 0.40009 -1.09928 0.11561 -0.79126 170 3PY 0.52040 0.87949 0.18053 -0.10992 -0.08434 171 3PZ 0.11414 0.52877 0.23461 -0.19426 -0.00213 172 4XX 0.02701 -0.03065 0.03100 -0.03161 -0.02879 173 4YY -0.01612 0.06527 0.20244 0.15893 -0.01490 174 4ZZ -0.01558 -0.00897 -0.23996 -0.14758 -0.00469 175 4XY -0.12262 -0.04910 0.01662 0.25951 -0.07252 176 4XZ 0.19085 -0.09825 -0.15887 -0.41285 0.14810 177 4YZ 0.02246 -0.00010 -0.12303 -0.12933 0.07552 178 17 C 1S -0.00575 -0.01897 0.00452 0.00082 0.01013 179 2S -0.05340 -0.20237 0.07467 -0.00814 0.07742 180 2PX -0.03018 -0.11424 0.04631 0.01005 0.06750 181 2PY 0.01245 0.01888 -0.02602 0.02287 -0.08353 182 2PZ 0.00154 0.01570 -0.03366 -0.06318 -0.02976 183 3S 0.42991 0.79536 0.00195 -0.17973 -0.64722 184 3PX 0.28445 0.16010 0.49135 -0.18514 0.03560 185 3PY 0.16515 0.88936 -0.13988 -0.10487 -0.17193 186 3PZ 0.21640 0.42386 -0.20692 0.06002 -0.09255 187 4XX 0.00113 0.00360 0.03194 -0.01264 -0.01433 188 4YY -0.11672 0.13812 0.16381 0.06515 -0.03030 189 4ZZ 0.10812 -0.18735 -0.16853 -0.05920 0.04577 190 4XY 0.00362 0.15458 -0.04126 -0.08673 -0.16810 191 4XZ 0.00724 0.06923 -0.04034 0.06161 -0.09528 192 4YZ 0.12479 0.14705 -0.22575 -0.03242 -0.06270 193 18 C 1S -0.00218 -0.01454 0.00618 -0.00050 0.00263 194 2S -0.00195 -0.01860 -0.00464 -0.01712 -0.10178 195 2PX 0.01079 0.00344 -0.01209 0.02576 0.04236 196 2PY -0.01730 0.05264 -0.01359 0.01866 -0.07421 197 2PZ 0.02502 0.01526 -0.05871 -0.05152 -0.02442 198 3S -0.15934 0.29780 -0.45918 0.16265 0.09213 199 3PX -0.04108 -0.20662 0.11277 -0.04317 -0.08989 200 3PY -0.02428 -0.01579 -0.19739 0.19204 0.10011 201 3PZ -0.24229 0.04511 -0.05836 -0.13248 0.09728 202 4XX 0.03329 0.21586 -0.08165 -0.03176 -0.09121 203 4YY 0.12904 -0.12829 0.02007 0.19665 0.01417 204 4ZZ -0.17574 -0.08808 0.04686 -0.16277 0.06167 205 4XY 0.10297 -0.03978 0.05898 0.17814 -0.06702 206 4XZ -0.20379 0.00802 0.02558 -0.38414 0.13230 207 4YZ -0.10497 0.03142 -0.00899 -0.13329 0.03891 208 19 C 1S -0.00115 -0.00400 -0.00147 0.00190 -0.00047 209 2S -0.01705 -0.05910 -0.02204 0.02527 0.00842 210 2PX 0.01794 0.09878 -0.03331 -0.00494 -0.03063 211 2PY -0.00866 0.08143 -0.03870 -0.01183 -0.02828 212 2PZ 0.05137 0.02934 -0.04722 0.03169 -0.02880 213 3S 0.16377 0.16033 0.14972 -0.09740 0.01032 214 3PX -0.06617 -0.07646 -0.07797 0.06102 0.00984 215 3PY -0.12046 0.12660 0.07572 -0.13872 -0.10288 216 3PZ 0.34998 -0.01109 -0.08245 0.12041 -0.10205 217 4XX -0.01193 -0.11845 0.07304 -0.01439 0.11776 218 4YY -0.39154 0.19434 0.17547 0.16169 -0.12008 219 4ZZ 0.40106 -0.10002 -0.26178 -0.13479 0.01265 220 4XY 0.13832 0.00274 0.04281 0.19766 -0.12691 221 4XZ -0.22393 0.03947 -0.05954 -0.45727 0.08311 222 4YZ 0.29011 0.02790 -0.21348 -0.13951 0.00904 223 20 C 1S 0.00316 0.01530 -0.00727 0.00002 -0.00380 224 2S 0.03127 0.02053 0.01324 -0.00350 0.02988 225 2PX -0.00998 0.02317 -0.02508 0.01200 -0.01130 226 2PY 0.02995 0.08049 -0.04400 -0.05503 -0.05939 227 2PZ -0.03182 0.05643 0.01338 0.04436 -0.05588 228 3S -0.15179 -0.56998 0.06664 0.03021 -0.01005 229 3PX 0.08306 0.21778 0.01751 -0.03263 0.01090 230 3PY 0.18458 -0.21690 0.04077 0.01968 0.01664 231 3PZ -0.29061 -0.04837 0.15810 -0.07475 0.03017 232 4XX 0.00842 -0.01291 -0.04378 0.01596 -0.02772 233 4YY -0.34657 0.02393 0.27871 0.03054 0.02742 234 4ZZ 0.34394 -0.00797 -0.23206 -0.04715 0.00878 235 4XY -0.15035 0.16299 0.00946 -0.05308 -0.05549 236 4XZ 0.35900 0.01785 -0.08421 0.04626 -0.04320 237 4YZ 0.21939 -0.18498 -0.10113 -0.03482 0.03952 238 21 C 1S 0.00094 0.02011 -0.01560 0.00124 -0.00869 239 2S 0.01989 0.31160 -0.15388 -0.00291 -0.10443 240 2PX 0.03464 0.02984 -0.00615 -0.00781 -0.04134 241 2PY -0.00682 -0.10145 0.00089 -0.01640 0.03121 242 2PZ -0.03221 -0.04551 0.04951 0.04799 0.00394 243 3S -0.03483 -0.65924 0.75285 -0.07593 0.50135 244 3PX 0.04662 0.83974 -0.55248 0.08314 -0.21581 245 3PY -0.11278 0.00014 -0.20503 -0.06671 -0.23331 246 3PZ 0.12130 -0.05101 -0.15132 0.13768 -0.17872 247 4XX -0.01956 -0.18757 0.06796 0.01800 0.12142 248 4YY 0.14103 0.03985 0.01418 0.10038 -0.09316 249 4ZZ -0.11205 0.20732 -0.09545 -0.12446 -0.04267 250 4XY -0.05425 -0.07808 0.14791 0.16717 -0.01406 251 4XZ 0.12773 -0.06780 -0.00014 -0.38137 0.14508 252 4YZ -0.07885 -0.10323 0.11742 -0.12712 0.05066 253 22 H 1S -0.01897 0.08027 -0.10263 0.04461 0.03296 254 2S 0.03042 -0.04176 0.15582 -0.03293 0.08483 255 23 H 1S -0.01001 -0.03198 0.02092 0.00440 0.04139 256 2S -0.02040 -0.01478 -0.01271 0.00792 -0.00470 257 24 H 1S 0.00842 0.02420 -0.00054 -0.02618 -0.07968 258 2S 0.01734 0.01898 0.00869 -0.01152 -0.00822 259 25 H 1S -0.00359 0.05653 -0.02469 -0.00640 -0.02698 260 2S -0.04001 -0.03022 -0.03992 0.02823 0.03122 261 26 H 1S 0.00176 -0.16575 0.05599 0.03070 0.12172 262 2S 0.17660 0.40835 0.22420 -0.14118 0.07451 263 27 H 1S -0.02267 -0.33082 0.16587 0.02172 0.29905 264 2S -0.01388 0.10172 -0.21574 -0.00298 -0.18697 221 222 223 224 225 V V V V V Eigenvalues -- 2.27147 2.28774 2.29412 2.31588 2.39060 1 1 C 1S -0.00394 -0.05101 -0.00439 -0.03050 -0.05907 2 2S -0.01016 -0.30752 -0.05477 -0.29365 -0.58485 3 2PX 0.01019 0.16885 0.00545 0.12303 0.04975 4 2PY -0.00308 -0.10441 0.00424 -0.04866 -0.00365 5 2PZ -0.01039 -0.02478 0.00940 -0.02337 0.00312 6 3S 0.28945 3.04880 0.44396 1.87503 4.06192 7 3PX 0.13749 0.97538 0.10619 0.34605 -0.79821 8 3PY -0.11691 -1.08690 -0.29183 -0.55792 -1.18520 9 3PZ -0.05530 -0.66914 -0.16535 -0.31214 -0.75519 10 4XX -0.01608 0.06672 -0.06567 -0.03417 0.41917 11 4YY 0.04403 0.22486 0.10867 0.10971 -0.11150 12 4ZZ -0.02466 -0.27415 -0.02957 -0.04947 -0.20194 13 4XY -0.03218 -0.17617 0.00689 -0.11524 0.37272 14 4XZ 0.06902 -0.13028 -0.01083 -0.02286 0.12328 15 4YZ 0.04401 0.39803 0.05793 0.33412 0.23790 16 2 C 1S -0.00293 -0.03329 -0.00904 0.00516 0.07081 17 2S -0.00280 -0.24667 0.02585 -0.03642 0.50984 18 2PX 0.00328 -0.11960 0.01682 -0.01531 -0.17395 19 2PY 0.00157 -0.09302 -0.02727 -0.04637 -0.00034 20 2PZ -0.00638 -0.01338 -0.00595 0.03348 -0.03329 21 3S 0.10835 1.73317 0.23778 -0.02404 -3.27611 22 3PX -0.02037 -0.46135 -0.12248 -0.00817 -0.87944 23 3PY -0.04890 -0.61149 0.01362 -0.04554 1.27947 24 3PZ -0.02799 -0.31256 0.08924 -0.40392 0.50388 25 4XX -0.00785 -0.02178 -0.01304 0.05132 -0.18415 26 4YY -0.02881 0.15481 -0.03930 0.28152 -0.13702 27 4ZZ 0.03182 -0.13671 0.02965 -0.29216 0.24212 28 4XY -0.00273 0.35841 0.04331 0.04665 0.26223 29 4XZ 0.07656 0.07998 -0.05749 0.25549 0.17687 30 4YZ 0.07087 0.17044 0.05764 -0.32298 -0.32770 31 3 H 1S -0.02149 0.01833 -0.08832 0.43593 0.17374 32 2S 0.01992 0.03499 -0.04191 0.01303 -0.26015 33 4 Br 1S 0.00025 0.00008 0.00026 -0.00352 -0.00067 34 2S 0.00008 0.00087 -0.00047 0.01342 0.00049 35 3S -0.00345 -0.00319 -0.00204 0.00512 0.00546 36 4S 0.00570 -0.00025 0.00635 -0.07986 -0.00763 37 5S -0.00993 -0.00630 0.00728 0.01836 0.28945 38 6S -0.00726 -0.02464 -0.04999 0.26270 -0.57672 39 7PX 0.00002 0.00101 -0.00004 -0.00026 -0.00092 40 7PY -0.00083 0.00167 -0.00025 0.00772 -0.00159 41 7PZ 0.00051 0.00088 0.00088 -0.00422 -0.00034 42 8PX -0.00005 -0.00357 0.00013 0.00065 0.00269 43 8PY 0.00266 -0.00580 0.00073 -0.02493 0.00611 44 8PZ -0.00160 -0.00274 -0.00282 0.01351 0.00068 45 9PX -0.00117 0.02545 -0.00182 0.01068 0.00720 46 9PY -0.00569 0.03060 0.00113 0.06705 -0.06303 47 9PZ 0.00153 0.00339 0.00816 -0.03454 0.02310 48 10PX 0.00828 -0.03186 0.01792 -0.06542 -0.04075 49 10PY -0.00892 0.03779 -0.00505 0.08024 0.12731 50 10PZ 0.01564 0.00535 -0.01499 -0.01559 -0.15600 51 11XX 0.00309 0.00860 0.00245 -0.00603 -0.00198 52 11YY 0.00159 0.00095 -0.00083 0.00121 -0.00341 53 11ZZ 0.00175 -0.00289 0.00216 -0.01094 -0.00898 54 11XY 0.00092 -0.00797 0.00083 -0.00644 -0.00380 55 11XZ -0.00114 -0.00270 -0.00103 0.00354 0.00356 56 11YZ 0.00231 0.00004 0.00091 -0.01185 -0.01235 57 12XX 0.00664 -0.03289 0.01271 -0.16033 0.06187 58 12YY 0.01756 -0.02793 0.02992 -0.24179 0.12086 59 12ZZ 0.01577 0.03912 0.00999 -0.12673 0.09367 60 12XY -0.00549 0.04530 -0.00781 0.04908 0.01688 61 12XZ 0.00840 0.02954 0.00948 -0.02299 -0.02021 62 12YZ -0.01581 0.01335 -0.00342 0.08554 0.07484 63 5 C 1S 0.00084 0.01327 0.00093 0.00527 -0.03753 64 2S -0.00409 0.03543 0.11904 0.06299 -0.16399 65 2PX -0.00443 -0.04441 -0.05350 -0.00321 -0.03352 66 2PY -0.01218 -0.11945 0.02579 -0.04172 -0.00383 67 2PZ 0.01706 -0.05491 0.00369 -0.09826 0.01104 68 3S 0.00634 0.06115 0.05599 -0.12238 1.85194 69 3PX -0.09507 -1.04035 -0.15643 -0.07561 0.56459 70 3PY -0.19824 -1.61312 -0.24664 -0.05561 0.68442 71 3PZ 0.34782 -0.55726 -0.17778 -0.56821 -0.15931 72 4XX -0.00942 -0.08487 0.02678 -0.04053 0.35998 73 4YY -0.00322 -0.00690 -0.01751 -0.00082 -0.41435 74 4ZZ 0.01121 0.09367 -0.03163 0.02690 0.03287 75 4XY -0.01326 -0.18823 -0.02714 -0.00475 0.43996 76 4XZ -0.00455 0.20906 0.11823 -0.42001 0.17229 77 4YZ 0.00787 -0.23424 -0.08894 0.24102 -0.06128 78 6 C 1S -0.00405 0.01574 0.00453 0.01063 0.00484 79 2S -0.08931 0.07066 0.11135 0.20629 -0.04403 80 2PX 0.01405 0.04996 -0.01836 -0.07443 -0.05131 81 2PY 0.03554 -0.01491 0.00528 -0.01367 -0.07284 82 2PZ -0.00163 -0.04076 0.01328 0.01129 -0.07880 83 3S 0.22053 -1.26676 -0.47673 -0.62736 -0.51004 84 3PX 0.10078 0.27672 -0.04628 -0.27524 0.16231 85 3PY 0.13865 0.40386 0.26664 -0.10029 -0.05972 86 3PZ 0.16710 -0.54152 -0.16068 -0.40229 -0.25749 87 4XX -0.02809 0.10930 0.47053 0.12968 -0.01146 88 4YY -0.01620 0.08720 -0.43745 0.01680 0.12703 89 4ZZ 0.03623 -0.22930 -0.05683 -0.15765 -0.09847 90 4XY 0.01613 -0.06996 0.24316 0.01951 -0.01423 91 4XZ 0.00372 0.17154 0.21836 -0.23121 0.22303 92 4YZ 0.02671 0.13058 -0.17491 0.19147 -0.17678 93 7 C 1S -0.00494 0.00349 -0.00050 0.00924 0.00298 94 2S -0.02716 -0.11203 -0.02790 -0.03451 -0.13726 95 2PX -0.00990 -0.00935 0.07469 -0.04726 -0.00677 96 2PY -0.01095 -0.04702 -0.01570 0.01253 0.01071 97 2PZ 0.01191 -0.01755 -0.01781 -0.04733 -0.06123 98 3S 0.20707 0.67238 0.24818 -0.17361 0.25759 99 3PX 0.05772 0.23426 0.22312 0.03576 -0.07264 100 3PY 0.06302 0.23780 0.01227 -0.06989 0.13444 101 3PZ 0.04893 0.23086 0.10241 0.01604 0.26932 102 4XX -0.02542 -0.15371 0.41559 0.26747 0.03696 103 4YY 0.04101 0.24062 -0.39297 -0.28220 -0.03429 104 4ZZ -0.01413 -0.05713 -0.01865 0.01080 0.01965 105 4XY 0.05332 -0.10569 0.23718 0.06010 -0.04328 106 4XZ 0.01971 0.21273 0.11186 -0.02276 -0.16709 107 4YZ -0.01187 0.04017 -0.07470 0.05343 0.11248 108 8 C 1S 0.00092 0.00330 -0.00324 -0.00280 -0.01348 109 2S 0.01457 0.07784 -0.00852 -0.01708 -0.03312 110 2PX -0.00431 0.00025 0.07053 0.00406 0.02192 111 2PY -0.00173 0.05539 -0.04091 0.01615 -0.00783 112 2PZ 0.03905 -0.00074 -0.01126 -0.07563 -0.02371 113 3S -0.06043 -0.27655 -0.06562 0.05552 -0.01703 114 3PX -0.04729 -0.18504 -0.06277 -0.08069 0.05716 115 3PY -0.03230 -0.23123 -0.02498 0.02601 -0.17442 116 3PZ 0.00634 -0.09665 -0.03608 -0.03220 0.02016 117 4XX -0.02072 -0.06518 -0.03814 -0.02181 0.02450 118 4YY 0.01972 0.19492 0.01122 0.03072 -0.13633 119 4ZZ 0.00647 -0.06942 0.02155 -0.00458 0.07484 120 4XY -0.01854 -0.02069 0.01772 0.08226 0.18584 121 4XZ 0.00102 0.26951 0.13128 -0.44144 0.00931 122 4YZ 0.04042 -0.13100 -0.08949 0.18156 -0.03939 123 9 C 1S 0.00555 0.00013 -0.00331 -0.01046 -0.00226 124 2S 0.00704 -0.03951 -0.04394 -0.03101 -0.10371 125 2PX -0.00244 -0.05543 0.03572 0.05819 0.00523 126 2PY -0.00685 0.01677 -0.01029 -0.02270 -0.00011 127 2PZ 0.00883 -0.02668 0.02150 -0.03235 0.04207 128 3S -0.08695 0.66306 0.27479 0.51167 0.44516 129 3PX 0.00373 0.15683 0.18362 0.25052 0.04470 130 3PY -0.04080 0.33916 0.05953 0.17210 0.36046 131 3PZ -0.03726 -0.05466 -0.07198 0.07591 -0.05222 132 4XX 0.03781 -0.00404 0.43815 -0.06716 -0.04600 133 4YY -0.00821 0.15207 -0.41466 0.04104 0.06651 134 4ZZ -0.02362 -0.12569 -0.02348 0.03073 -0.01177 135 4XY -0.03808 0.05231 0.29835 0.08427 -0.07099 136 4XZ -0.05317 0.06918 0.23768 -0.21650 0.14550 137 4YZ -0.01372 -0.01989 -0.15618 0.22302 -0.05055 138 10 C 1S 0.00476 0.01824 0.00370 -0.00617 0.00021 139 2S 0.07885 0.05739 0.04144 -0.09811 0.03141 140 2PX -0.01160 -0.00943 -0.04821 0.06464 -0.02636 141 2PY -0.02765 0.04398 0.05449 0.00208 -0.06409 142 2PZ -0.01445 0.04256 0.00151 0.02518 0.01503 143 3S -0.35159 -1.17192 -0.26257 0.13895 -0.30649 144 3PX -0.12199 0.12741 -0.06313 0.31035 0.30059 145 3PY -0.16958 0.17699 0.17759 0.53479 0.21622 146 3PZ 0.16656 0.67414 0.18104 -0.07888 0.09474 147 4XX 0.03639 -0.06904 0.42411 0.12135 0.01535 148 4YY 0.01821 0.30618 -0.40337 -0.18979 -0.07465 149 4ZZ -0.05074 -0.26721 -0.03459 0.03618 0.02690 150 4XY -0.01574 -0.15923 0.22281 0.13619 0.03035 151 4XZ 0.02624 0.07947 0.09058 -0.10719 -0.18647 152 4YZ 0.01674 -0.07438 -0.05931 -0.02779 0.19432 153 11 H 1S 0.03367 0.14530 0.00089 -0.04705 -0.07408 154 2S -0.02936 -0.25787 -0.06283 -0.00339 0.05309 155 12 H 1S 0.00131 0.00857 -0.00230 0.00448 0.04023 156 2S 0.00010 0.04332 0.03744 0.02210 0.05830 157 13 H 1S -0.00849 -0.09022 -0.01288 -0.03743 -0.05518 158 2S -0.00987 -0.03810 -0.00618 0.00529 -0.02348 159 14 H 1S 0.00335 -0.00971 0.00440 -0.00711 0.02987 160 2S 0.01465 0.04714 0.03163 0.00457 0.07545 161 15 H 1S -0.02125 0.15245 0.00023 0.10740 -0.04387 162 2S -0.00195 -0.24344 -0.06345 -0.05097 0.00759 163 16 C 1S 0.00110 0.00460 -0.00041 -0.00185 0.00223 164 2S 0.01078 -0.03678 0.00417 -0.01946 0.19623 165 2PX 0.01167 0.13494 0.02300 0.07393 -0.06241 166 2PY -0.01799 -0.08389 0.01676 -0.03575 0.03735 167 2PZ 0.06368 -0.05019 0.01003 -0.02753 0.03303 168 3S -0.01028 0.15104 -0.08018 0.20668 -0.38153 169 3PX 0.35087 3.18806 0.74229 2.05842 1.86322 170 3PY -0.11449 -1.43588 0.04663 -0.52285 -1.33474 171 3PZ -0.14624 -0.80954 0.02037 -0.30701 -0.79399 172 4XX -0.00422 -0.08632 0.00526 -0.01879 0.00454 173 4YY 0.04696 0.04568 0.00873 0.02359 -0.05342 174 4ZZ -0.04157 0.01609 -0.01133 -0.02782 0.09294 175 4XY -0.00195 0.13144 -0.01997 0.13314 0.20503 176 4XZ 0.04880 0.20700 0.06185 -0.01587 -0.00386 177 4YZ -0.05723 -0.10980 0.00308 -0.04711 0.03656 178 17 C 1S 0.00027 0.02187 0.00032 0.01285 0.02096 179 2S -0.00018 0.11535 -0.01366 0.06559 0.16182 180 2PX -0.00273 -0.02682 0.00489 -0.05138 -0.02175 181 2PY -0.01247 0.03618 -0.01381 0.02161 0.02249 182 2PZ 0.05116 0.01530 -0.00360 0.01112 0.01781 183 3S -0.12297 -1.75108 -0.09244 -0.92311 -1.00064 184 3PX -0.20946 -1.72821 -0.30237 -0.83226 -0.78194 185 3PY -0.09293 -0.10588 0.28333 0.21818 -0.60314 186 3PZ 0.16766 -0.07144 0.14556 0.08495 -0.26050 187 4XX 0.00713 -0.17277 -0.01094 -0.13276 -0.02529 188 4YY 0.32177 0.04040 0.02672 0.03443 -0.10159 189 4ZZ -0.33496 0.08514 -0.01542 0.06263 0.12798 190 4XY -0.20644 -0.10638 0.01480 -0.06244 0.01036 191 4XZ 0.37959 -0.13174 -0.00419 -0.04694 0.06794 192 4YZ -0.22473 -0.09112 0.01971 -0.05307 -0.13576 193 18 C 1S -0.00128 -0.00661 -0.00139 -0.00542 0.00678 194 2S -0.00422 -0.08064 -0.00779 -0.02275 0.03267 195 2PX -0.00389 -0.01013 -0.00035 -0.01474 -0.13237 196 2PY 0.03869 0.02349 0.01091 0.03784 0.02849 197 2PZ -0.05197 0.01881 0.00977 0.00864 0.01618 198 3S 0.18527 1.54912 0.34662 0.87827 0.28153 199 3PX -0.02638 -0.31904 -0.13773 -0.28831 0.10020 200 3PY 0.18386 0.69670 0.09536 0.31166 0.18154 201 3PZ -0.13076 0.45236 0.07470 0.19787 0.06197 202 4XX 0.03343 0.05134 0.03900 0.06935 -0.07041 203 4YY 0.25923 -0.06062 -0.04401 -0.03757 0.07496 204 4ZZ -0.28701 0.03770 0.01171 -0.01953 0.02011 205 4XY -0.24041 -0.16477 -0.02140 -0.07564 -0.04020 206 4XZ 0.39236 -0.06492 0.02475 -0.11799 -0.02108 207 4YZ -0.19336 0.06248 -0.01316 0.00635 -0.01673 208 19 C 1S 0.00031 -0.00045 -0.00174 -0.00339 -0.00617 209 2S 0.01028 0.07984 0.00125 0.03414 0.02844 210 2PX 0.00407 0.01430 0.01856 0.02181 -0.04925 211 2PY 0.04639 0.07154 0.02174 0.05988 -0.00683 212 2PZ -0.05949 0.03310 0.00780 0.03434 -0.00007 213 3S -0.09844 -0.63155 -0.06930 -0.19577 -0.20570 214 3PX 0.04845 0.33102 0.03850 0.14534 0.09738 215 3PY -0.06954 -0.26705 -0.05683 -0.12574 -0.01759 216 3PZ 0.05459 -0.21556 -0.04988 -0.08504 0.01782 217 4XX -0.01376 0.01954 -0.00903 0.00564 0.02045 218 4YY 0.01639 0.07718 0.01535 0.09813 0.00364 219 4ZZ -0.00055 -0.05259 -0.01073 -0.07893 -0.02656 220 4XY 0.02404 -0.11137 -0.03054 -0.03603 0.14137 221 4XZ -0.05037 0.01252 0.02484 -0.07824 0.04988 222 4YZ 0.00718 0.06536 0.04334 0.03933 0.05616 223 20 C 1S 0.00077 0.00792 0.00319 0.00954 -0.00506 224 2S -0.01444 -0.05839 -0.02487 -0.03328 -0.02802 225 2PX 0.00364 0.01073 0.01348 0.01758 -0.07803 226 2PY 0.03612 0.03054 0.01783 0.02469 0.11365 227 2PZ -0.04577 0.01751 0.00561 0.02051 0.06199 228 3S 0.09614 0.78566 0.10108 0.33946 1.01814 229 3PX -0.07073 -0.54328 -0.09455 -0.29094 -0.46629 230 3PY 0.06228 -0.18512 -0.08617 -0.09351 0.14804 231 3PZ -0.18045 -0.02150 -0.02933 -0.02224 0.05589 232 4XX 0.03182 0.10111 0.01325 0.06273 0.06153 233 4YY 0.29212 -0.09377 -0.02748 -0.05057 -0.02492 234 4ZZ -0.32228 0.01902 0.01841 0.00589 -0.01863 235 4XY -0.22618 -0.03988 0.02644 -0.02839 -0.06166 236 4XZ 0.39459 -0.10927 -0.00673 -0.01524 0.00489 237 4YZ -0.23488 -0.12149 -0.03407 -0.13982 0.01399 238 21 C 1S 0.00439 0.03848 0.01032 0.02735 0.01727 239 2S 0.04162 0.32482 0.09548 0.24006 0.09364 240 2PX 0.00360 -0.00156 0.02383 0.04141 0.03439 241 2PY -0.03247 0.01141 -0.01400 -0.02022 0.03163 242 2PZ 0.05586 -0.00248 -0.01481 0.00730 0.02018 243 3S -0.28806 -2.58157 -0.65693 -1.79563 -1.38344 244 3PX 0.12289 0.96207 0.33440 0.73279 -0.25989 245 3PY 0.04270 1.13390 0.22382 0.69316 1.02674 246 3PZ 0.22735 0.52984 0.09269 0.35570 0.61435 247 4XX 0.00286 -0.04631 -0.03120 -0.04180 -0.15565 248 4YY 0.23810 -0.20996 -0.03865 -0.07100 0.07129 249 4ZZ -0.24356 0.22925 0.07665 0.10099 0.05436 250 4XY -0.27096 -0.22409 -0.07594 -0.14209 0.04168 251 4XZ 0.41940 -0.08111 -0.00322 -0.11636 0.00166 252 4YZ -0.20464 -0.22797 -0.04318 -0.19452 -0.09097 253 22 H 1S 0.01844 0.22036 0.04956 0.14426 -0.09951 254 2S -0.05905 -0.49371 -0.09750 -0.29396 -0.28994 255 23 H 1S -0.00302 0.02189 -0.00076 0.01313 -0.01848 256 2S 0.01704 0.11483 0.02927 0.06150 0.05979 257 24 H 1S -0.00361 -0.11015 -0.02565 -0.08083 0.06114 258 2S -0.00982 -0.05421 -0.01288 -0.01556 -0.01900 259 25 H 1S 0.00802 0.04822 0.02594 0.03719 -0.00953 260 2S 0.02210 0.15200 0.00236 0.03064 0.05175 261 26 H 1S -0.00805 0.05753 -0.05138 0.02567 0.00312 262 2S -0.10667 -0.63552 0.05516 -0.08426 -0.49467 263 27 H 1S -0.04554 -0.24786 -0.05456 -0.22640 -0.18926 264 2S 0.03709 0.32010 0.12705 0.15806 0.30185 226 227 228 229 230 V V V V V Eigenvalues -- 2.42039 2.44115 2.51635 2.54842 2.56667 1 1 C 1S -0.00540 -0.01757 -0.00965 -0.01695 0.01412 2 2S -0.04269 -0.34337 0.01964 -0.01773 0.09354 3 2PX -0.01456 0.08596 -0.27343 -0.01092 0.02776 4 2PY 0.03699 0.03298 0.06691 -0.02197 -0.00806 5 2PZ -0.04421 0.04794 0.05003 -0.01210 -0.01628 6 3S 0.36531 1.88651 0.62155 0.80319 -0.37344 7 3PX 0.62831 1.30085 -0.32449 0.90238 0.39307 8 3PY -0.29143 -1.34618 0.10558 -0.07834 0.20079 9 3PZ -0.18207 -0.82574 -0.02053 -0.04425 0.06704 10 4XX -0.03299 -0.09646 0.23734 0.03049 -0.10319 11 4YY -0.23313 0.18002 -0.19380 0.00102 0.05546 12 4ZZ 0.23454 -0.08631 -0.07885 -0.07017 0.06751 13 4XY 0.11442 -0.37535 0.05398 -0.09578 0.03372 14 4XZ -0.60653 -0.02397 0.12169 -0.05727 0.05416 15 4YZ 0.18579 0.08349 -0.16384 0.08894 -0.05452 16 2 C 1S 0.00556 0.01862 0.02977 0.01226 -0.02621 17 2S 0.04727 0.46064 0.13123 0.13316 -0.03911 18 2PX 0.01637 0.04117 -0.06629 0.01528 0.06081 19 2PY -0.00056 -0.03430 0.03240 -0.01485 -0.02838 20 2PZ -0.01336 -0.03982 -0.01782 -0.01509 -0.01677 21 3S -0.27629 -2.06058 -1.02576 -0.16453 1.03840 22 3PX 0.46938 1.13105 -0.40676 0.31753 -0.08450 23 3PY 0.37927 1.64931 0.15779 0.32643 -0.30639 24 3PZ 0.13982 0.83275 0.20675 0.08104 0.22592 25 4XX 0.05630 0.30952 -0.41557 -0.04026 0.07171 26 4YY 0.01937 -0.46346 0.17930 -0.05166 -0.03000 27 4ZZ -0.06281 0.05268 0.24423 0.08600 -0.09735 28 4XY 0.02062 -0.29709 -0.11098 -0.10596 0.10974 29 4XZ -0.34431 -0.03314 -0.05824 -0.04449 0.04174 30 4YZ -0.08285 -0.14996 0.05884 -0.02737 0.02178 31 3 H 1S 0.00776 -0.02927 -0.13756 -0.04662 -0.02659 32 2S -0.00425 -0.13472 0.02094 0.03185 -0.14631 33 4 Br 1S 0.00066 0.00207 0.00077 0.00070 -0.00080 34 2S -0.00912 -0.00814 -0.00478 -0.00537 0.00750 35 3S 0.01932 -0.00345 0.00391 0.00722 -0.01247 36 4S 0.01260 0.05278 0.02048 0.01572 -0.01718 37 5S -0.05805 0.17187 0.11854 -0.01454 0.00930 38 6S 0.09478 -0.59931 -0.27908 -0.02869 0.05597 39 7PX -0.00095 0.00104 0.00080 -0.00011 0.00165 40 7PY 0.00163 -0.00691 -0.00325 -0.00054 -0.00008 41 7PZ -0.00191 0.00118 0.00098 -0.00013 0.00057 42 8PX 0.00311 -0.00335 -0.00271 0.00033 -0.00535 43 8PY -0.00546 0.02300 0.01103 0.00172 0.00035 44 8PZ 0.00638 -0.00376 -0.00355 0.00043 -0.00181 45 9PX -0.00989 0.01022 0.01351 0.00043 0.01393 46 9PY 0.02464 -0.09278 -0.05512 0.00078 -0.00882 47 9PZ -0.02844 0.00743 0.02873 -0.00164 0.00561 48 10PX -0.00708 -0.04437 -0.00079 -0.01284 0.03321 49 10PY -0.03532 0.04479 0.01358 -0.04155 0.02625 50 10PZ 0.02584 -0.05079 -0.04119 -0.01358 0.01409 51 11XX -0.01138 0.00111 -0.00303 -0.00182 0.00396 52 11YY -0.01089 0.00121 -0.00447 -0.00874 0.01152 53 11ZZ -0.00901 0.00542 0.00115 -0.00038 0.00388 54 11XY -0.00308 -0.00087 0.00067 -0.00116 0.00522 55 11XZ -0.00123 0.00028 0.00139 -0.00011 -0.00187 56 11YZ 0.00355 0.00258 -0.00473 -0.00056 0.00147 57 12XX -0.01198 0.19455 0.08915 0.01220 -0.00135 58 12YY -0.01538 0.24310 0.12927 0.06442 -0.05880 59 12ZZ -0.03188 0.14128 0.06969 -0.00460 -0.00376 60 12XY 0.02310 0.01320 -0.01433 0.00929 -0.04284 61 12XZ 0.00021 -0.01248 -0.00258 -0.00113 0.01786 62 12YZ -0.01605 -0.02616 0.01517 0.00225 -0.00881 63 5 C 1S 0.00014 0.00964 -0.01617 -0.02614 0.02993 64 2S -0.00044 0.18084 -0.21711 0.11681 0.09543 65 2PX 0.01579 0.10510 -0.05729 0.02954 0.01986 66 2PY 0.03174 0.14422 -0.00522 0.00322 0.00439 67 2PZ -0.07618 0.10984 0.06772 0.02095 -0.04136 68 3S -0.02413 -1.20690 0.75362 0.44140 -0.86568 69 3PX 0.45862 1.69599 0.30269 -0.02369 -0.03995 70 3PY 0.81062 2.84824 -0.01342 0.10902 0.10629 71 3PZ -0.39821 1.11564 0.34089 0.66240 -1.33546 72 4XX -0.06641 0.24844 -0.18116 -0.12907 0.15807 73 4YY 0.05239 -0.14592 0.20158 0.01754 -0.13115 74 4ZZ 0.02914 -0.14920 0.04971 0.02496 -0.02115 75 4XY -0.07792 0.01601 -0.00407 0.11018 -0.16613 76 4XZ 0.08109 0.05343 -0.06292 -0.05985 0.10408 77 4YZ 0.05807 -0.06306 -0.03761 -0.10548 0.17790 78 6 C 1S 0.00262 -0.04854 -0.00971 -0.02346 0.05130 79 2S 0.00333 -0.35497 -0.17861 -0.12361 0.33614 80 2PX -0.01847 -0.01008 -0.06251 -0.03936 0.09137 81 2PY -0.03124 -0.02263 -0.02351 -0.06019 0.10967 82 2PZ -0.02987 0.05665 -0.03136 -0.03532 0.06755 83 3S 0.07061 2.95928 0.58228 1.25745 -2.72993 84 3PX -0.23510 -0.28697 -0.03274 -0.13851 0.40881 85 3PY -0.43278 -0.87220 -0.06067 -0.34528 0.80017 86 3PZ -0.12828 1.42297 0.15257 0.33546 -0.73993 87 4XX 0.04057 -0.30498 -0.00119 -0.06776 0.17107 88 4YY 0.05158 0.00329 0.00072 0.09016 -0.21127 89 4ZZ -0.07858 0.37450 0.06066 -0.02303 -0.00616 90 4XY -0.00296 0.15162 0.09002 0.15894 -0.40669 91 4XZ -0.03486 0.02952 -0.10426 -0.04718 0.10945 92 4YZ -0.01985 -0.27544 -0.00434 -0.11978 0.18657 93 7 C 1S 0.00383 -0.00191 0.01103 0.03672 -0.06905 94 2S -0.04374 0.01526 0.02154 0.07523 -0.25409 95 2PX 0.00621 -0.04505 -0.00314 0.00686 0.01896 96 2PY 0.00441 -0.05090 -0.00394 0.03116 0.02671 97 2PZ -0.05346 0.01543 -0.00863 -0.09185 0.12312 98 3S -0.39761 -0.94463 -0.40312 -1.47286 2.90297 99 3PX -0.09439 -0.31602 -0.05240 -0.09223 0.29861 100 3PY -0.18225 -0.40636 -0.10625 -0.11333 0.35265 101 3PZ -0.03286 -0.40019 -0.18402 -0.69679 1.36168 102 4XX -0.06288 -0.11317 0.07394 0.17345 -0.33331 103 4YY -0.01051 -0.02799 -0.00944 0.00581 0.00306 104 4ZZ 0.06683 0.14401 -0.04589 -0.17504 0.37939 105 4XY -0.08309 -0.06562 -0.05740 -0.19835 0.37200 106 4XZ 0.06216 -0.13801 -0.02123 -0.01956 0.11338 107 4YZ 0.00541 -0.16004 -0.06661 -0.00750 0.09243 108 8 C 1S -0.00066 0.01398 -0.00738 -0.02563 0.02971 109 2S -0.02479 -0.03851 -0.03621 -0.08825 0.09822 110 2PX -0.00386 -0.03589 -0.00321 0.02319 -0.03575 111 2PY 0.00756 -0.05643 0.00291 0.05143 -0.07273 112 2PZ -0.06574 -0.00711 0.01613 -0.05853 0.14363 113 3S 0.09546 0.04076 0.23811 0.98130 -1.16080 114 3PX 0.05180 0.14197 0.06342 0.28534 -0.36512 115 3PY 0.10139 0.14392 0.14636 0.47660 -0.64009 116 3PZ 0.03069 0.06652 0.02350 -0.11641 0.41680 117 4XX -0.03053 0.08857 -0.06541 -0.12750 0.11624 118 4YY 0.01963 -0.15593 0.00265 0.02681 -0.10711 119 4ZZ -0.00138 0.01806 0.05550 0.09690 0.00301 120 4XY -0.03732 -0.19606 0.01996 0.14108 -0.21228 121 4XZ 0.02893 0.01091 -0.01674 -0.05740 0.16354 122 4YZ -0.12554 -0.06927 0.01540 -0.15315 0.26276 123 9 C 1S -0.00324 -0.00656 0.00167 -0.00976 0.03663 124 2S 0.04945 -0.00562 -0.03158 -0.04683 0.13666 125 2PX 0.00765 -0.03358 0.01121 0.05255 -0.08397 126 2PY 0.03036 -0.02832 0.00622 0.08742 -0.13339 127 2PZ -0.02074 -0.01444 0.04226 0.07828 -0.05980 128 3S -0.16221 -0.78685 -0.15315 0.21857 -1.24998 129 3PX -0.04483 -0.30024 0.00634 0.09487 -0.30615 130 3PY -0.09486 -0.42401 -0.04015 0.17093 -0.52608 131 3PZ 0.10372 0.06081 -0.04306 0.04750 0.28176 132 4XX 0.01629 -0.12391 0.01131 -0.02055 0.14235 133 4YY -0.07391 -0.11469 0.00291 0.07865 -0.15178 134 4ZZ 0.06344 0.21709 -0.01412 -0.03526 -0.03200 135 4XY 0.01371 -0.05315 0.00811 0.12077 -0.29312 136 4XZ 0.07640 0.03682 -0.05863 -0.03179 0.09668 137 4YZ 0.04937 -0.07240 -0.02454 -0.07429 0.16053 138 10 C 1S -0.01632 -0.03309 0.01551 0.03036 -0.06211 139 2S -0.09946 -0.24341 0.03628 0.06911 -0.26050 140 2PX 0.01053 -0.00633 -0.04377 -0.01944 0.01181 141 2PY 0.05240 -0.01512 -0.02916 -0.01927 0.01191 142 2PZ -0.02516 -0.04355 0.03568 0.06027 -0.07717 143 3S 0.96804 2.24480 -0.45370 -1.00501 2.51618 144 3PX 0.10796 -0.11082 -0.21837 0.04709 -0.06140 145 3PY 0.23654 -0.24795 -0.23974 -0.01889 -0.08656 146 3PZ -0.49134 -1.39507 0.18037 0.34071 -0.98761 147 4XX -0.11563 -0.19706 0.06319 0.15040 -0.26974 148 4YY -0.08315 -0.11116 0.04679 -0.06289 0.02801 149 4ZZ 0.20715 0.36322 -0.09176 -0.07386 0.25014 150 4XY 0.02132 0.08791 -0.08460 -0.19309 0.36847 151 4XZ 0.02869 -0.06945 0.13076 -0.02973 0.06301 152 4YZ -0.07896 0.06086 -0.00437 -0.00865 0.13156 153 11 H 1S -0.11357 -0.15154 0.06021 0.07105 -0.20201 154 2S 0.14581 0.45187 -0.01981 -0.06952 0.24032 155 12 H 1S 0.02714 -0.06474 -0.01377 -0.06953 0.17887 156 2S -0.03362 -0.04387 0.01314 0.06062 -0.22616 157 13 H 1S 0.04658 0.17863 0.00254 -0.01193 0.03596 158 2S 0.01254 -0.02712 0.03211 0.12030 -0.15026 159 14 H 1S -0.03688 -0.03260 0.04840 0.10327 -0.23681 160 2S 0.00597 -0.08062 -0.06172 -0.18759 0.41539 161 15 H 1S 0.02707 -0.22859 -0.08577 -0.11192 0.22146 162 2S 0.07738 0.53639 0.05593 0.11541 -0.28408 163 16 C 1S -0.00828 -0.00742 -0.07855 0.02655 -0.00656 164 2S -0.11298 -0.15686 -0.20818 0.03856 0.04219 165 2PX 0.06214 0.14462 -0.02259 0.03759 -0.00178 166 2PY -0.08429 -0.04226 -0.03731 -0.01794 0.03740 167 2PZ 0.00149 -0.03548 -0.02231 -0.00590 0.01023 168 3S 0.23679 -0.37541 2.55412 -0.87484 -0.11422 169 3PX 0.49016 2.05672 0.05233 -0.56916 -0.42262 170 3PY -0.54548 -1.15844 -1.33779 -1.42888 -0.36165 171 3PZ -0.41397 -0.72086 -0.70691 -0.80856 -0.15136 172 4XX -0.01209 0.14364 0.10618 -0.27905 0.01105 173 4YY -0.37360 0.00556 0.21369 0.11641 0.05047 174 4ZZ 0.35291 -0.20433 -0.35611 0.17126 -0.05386 175 4XY 0.22278 -0.08553 -0.02366 -0.07171 0.08377 176 4XZ -0.43852 0.10962 0.02174 -0.01921 0.05496 177 4YZ 0.31729 -0.04291 0.47042 -0.03463 0.04216 178 17 C 1S 0.01175 0.01359 0.05216 0.05983 0.03798 179 2S 0.05444 0.07589 0.15940 0.33023 0.10920 180 2PX 0.00124 -0.04555 0.03636 -0.10180 -0.01053 181 2PY -0.02736 0.07829 -0.19227 0.10317 0.00668 182 2PZ 0.04543 0.01172 -0.11249 0.05200 0.00743 183 3S -0.68442 -0.95649 -1.66568 -3.25221 -1.16779 184 3PX -0.30853 -0.80097 -0.43498 -1.43228 -0.50391 185 3PY -0.34138 -0.22930 -1.22777 -0.37057 -0.01336 186 3PZ 0.00966 -0.06960 -0.66095 -0.13333 -0.02241 187 4XX -0.05894 -0.18826 -0.01531 -0.54831 -0.17615 188 4YY -0.12918 0.08708 -0.19321 0.16201 0.04248 189 4ZZ 0.18271 0.07639 0.22828 0.36465 0.19366 190 4XY -0.24372 -0.10826 -0.14691 0.01873 0.15457 191 4XZ 0.19560 -0.11574 -0.09668 0.04665 0.07936 192 4YZ 0.04986 -0.05392 -0.34273 -0.15960 -0.15908 193 18 C 1S 0.00291 0.00261 0.04503 -0.07614 -0.02185 194 2S -0.00422 0.07549 0.10017 -0.27038 -0.01195 195 2PX 0.00896 0.04281 -0.30500 0.03115 -0.12002 196 2PY -0.00568 0.04441 -0.05423 0.13625 0.09062 197 2PZ -0.00516 0.02835 -0.02237 0.07323 0.05332 198 3S 0.10175 0.37185 -1.71130 3.40457 0.72631 199 3PX -0.08848 -0.26358 -0.36316 0.19628 -0.06482 200 3PY 0.15334 0.14090 -0.48775 1.45387 0.20506 201 3PZ -0.04218 0.07291 -0.25167 0.76707 0.12690 202 4XX -0.01082 0.05973 -0.38105 0.15250 0.07582 203 4YY 0.11360 -0.07761 0.10593 0.25228 0.06495 204 4ZZ -0.10522 0.02805 0.28238 -0.34055 -0.09544 205 4XY -0.13646 -0.15837 -0.23736 0.01192 -0.00861 206 4XZ 0.06956 -0.10478 -0.15332 -0.02438 -0.01163 207 4YZ -0.10941 -0.03958 -0.12487 0.51189 0.15926 208 19 C 1S -0.00504 -0.00647 -0.08530 0.03322 -0.02495 209 2S -0.01110 0.00089 -0.24854 0.12070 -0.07643 210 2PX -0.01145 0.00468 -0.16699 0.14737 0.09827 211 2PY 0.00318 0.06804 0.01275 0.10531 0.15968 212 2PZ 0.01477 0.03176 0.01124 0.05256 0.08590 213 3S 0.12577 0.23635 2.91508 -1.31053 1.09363 214 3PX -0.00921 0.05796 -1.11351 1.02988 -0.10740 215 3PY -0.05403 0.01280 0.84241 0.10606 0.69909 216 3PZ 0.08437 0.00009 0.48337 0.04046 0.37468 217 4XX 0.06811 0.04208 0.37070 -0.44801 -0.21456 218 4YY -0.15345 0.07971 0.08105 0.23824 0.24383 219 4ZZ 0.10822 -0.05957 -0.46663 0.22815 -0.04586 220 4XY -0.08636 -0.19557 0.10255 -0.12907 0.02031 221 4XZ -0.02691 -0.11629 -0.00093 -0.06531 0.02021 222 4YZ 0.14544 0.06576 0.42110 -0.00341 0.26296 223 20 C 1S 0.00369 0.00846 0.04275 0.04031 0.05810 224 2S 0.01899 0.00269 0.22838 0.12633 0.15176 225 2PX -0.00065 0.02216 -0.07297 0.14762 0.12740 226 2PY -0.00530 -0.01655 0.21705 -0.12013 0.06107 227 2PZ -0.02648 -0.00474 0.12332 -0.06997 0.03105 228 3S 0.01774 0.17232 -1.59902 -1.41895 -2.49778 229 3PX -0.05352 -0.20619 0.70028 0.69553 1.12726 230 3PY 0.11457 0.15008 0.70535 0.03041 0.34873 231 3PZ -0.07217 0.10382 0.36920 -0.00517 0.17399 232 4XX 0.00886 0.08725 -0.16851 -0.42004 -0.21781 233 4YY -0.14776 -0.08678 -0.02542 0.11402 -0.09228 234 4ZZ 0.14333 -0.00796 0.20516 0.24691 0.27470 235 4XY -0.11415 -0.12877 -0.22468 -0.03160 0.00286 236 4XZ 0.06583 -0.09633 -0.10086 0.01315 0.00811 237 4YZ 0.06260 -0.12612 -0.26995 -0.14610 -0.31464 238 21 C 1S 0.00835 0.02889 0.01525 -0.06484 -0.03260 239 2S 0.06306 0.14860 0.00990 -0.24558 -0.19146 240 2PX -0.01818 0.01942 0.12763 -0.03404 0.16162 241 2PY 0.00572 0.03364 0.00348 -0.05094 -0.04553 242 2PZ 0.01066 0.01313 -0.00275 -0.02676 -0.02842 243 3S -0.41313 -1.51516 -0.01757 2.55626 1.89450 244 3PX 0.13754 0.49859 -0.12680 -0.25445 0.17381 245 3PY 0.13126 0.65856 0.31655 -0.86251 -0.82100 246 3PZ 0.21395 0.33686 0.17792 -0.45587 -0.47200 247 4XX 0.03175 0.05487 -0.24512 0.12856 -0.01923 248 4YY 0.08663 -0.21840 0.13167 0.15252 0.14080 249 4ZZ -0.12894 0.13668 0.12599 -0.29570 -0.10946 250 4XY 0.00852 -0.23881 -0.02749 -0.14564 -0.16503 251 4XZ -0.16348 -0.08404 0.03081 -0.08035 -0.10203 252 4YZ -0.20269 -0.22294 0.01575 0.39233 0.25619 253 22 H 1S 0.07708 0.21710 -0.11729 -0.18322 -0.10192 254 2S -0.10189 -0.34288 -0.08054 0.23806 0.19324 255 23 H 1S 0.02990 0.02575 0.16511 0.21597 0.11679 256 2S -0.00700 -0.00076 -0.27372 -0.25267 -0.31205 257 24 H 1S -0.08233 -0.17001 -0.14457 0.01826 0.00755 258 2S 0.03121 0.05356 0.39387 -0.17286 0.12225 259 25 H 1S 0.03033 0.07480 0.04534 -0.26604 -0.08968 260 2S 0.01173 -0.02021 -0.10461 0.47159 0.08873 261 26 H 1S 0.09440 0.14479 0.15038 0.24567 0.05915 262 2S -0.17640 -0.45821 -0.51518 -0.40475 -0.03022 263 27 H 1S 0.04182 0.02563 0.08939 -0.06306 -0.02813 264 2S -0.00966 0.24865 -0.03842 -0.15111 -0.02759 231 232 233 234 235 V V V V V Eigenvalues -- 2.57055 2.59048 2.60387 2.63696 2.67727 1 1 C 1S 0.01750 -0.02415 -0.07310 -0.01785 -0.00504 2 2S -0.00205 -0.06422 -0.25973 -0.04862 -0.20196 3 2PX -0.02203 -0.03354 -0.12477 -0.01765 -0.13082 4 2PY 0.07340 -0.01210 -0.02724 -0.02124 0.10307 5 2PZ 0.04019 -0.02438 -0.00290 -0.01558 0.06582 6 3S -0.86155 1.10513 3.45968 0.88279 -0.58211 7 3PX 0.26048 -0.13606 -0.50060 -0.19722 -0.79810 8 3PY 0.07418 -0.33153 -0.95620 -0.19743 0.30041 9 3PZ -0.01088 -0.18926 -0.69650 -0.12836 0.19024 10 4XX -0.10414 0.11235 0.35540 0.07218 0.05948 11 4YY 0.03318 -0.02303 -0.09850 -0.01039 -0.02116 12 4ZZ 0.04488 -0.10962 -0.31675 -0.06972 -0.04178 13 4XY -0.08422 0.02913 -0.16833 -0.06086 0.28492 14 4XZ 0.01637 -0.15052 0.04539 0.05638 0.16358 15 4YZ -0.06841 0.05829 0.20070 0.05988 0.00314 16 2 C 1S 0.01186 0.01299 0.05221 0.01471 0.01776 17 2S -0.02749 0.13199 0.46081 0.10845 -0.05520 18 2PX 0.08359 -0.06183 -0.17638 -0.03395 -0.01199 19 2PY 0.09034 -0.02617 -0.04202 -0.01652 0.05184 20 2PZ 0.01271 -0.02294 -0.05910 -0.00526 0.02815 21 3S -0.02646 -0.66001 -2.48702 -0.63922 -0.39045 22 3PX 0.49277 -0.30445 -0.89150 -0.24755 -0.42542 23 3PY 0.10703 0.17114 0.56243 0.07966 0.02200 24 3PZ 0.37578 0.10598 0.59514 0.02700 -0.05466 25 4XX 0.20136 -0.17892 -0.52273 -0.13797 -0.09830 26 4YY -0.16063 0.07965 0.19023 0.11440 0.02527 27 4ZZ 0.00984 0.08231 0.28900 0.02471 0.11594 28 4XY -0.23078 0.04306 -0.08578 -0.03402 0.06743 29 4XZ -0.10217 -0.07184 -0.02474 0.09700 0.03994 30 4YZ -0.06584 0.00279 -0.01839 -0.07577 -0.07485 31 3 H 1S -0.06888 -0.02120 -0.08245 0.07487 0.00955 32 2S 0.01805 -0.02785 -0.09368 -0.01019 -0.04986 33 4 Br 1S 0.00004 0.00004 0.00002 -0.00055 -0.00045 34 2S 0.00113 -0.00164 0.00020 0.00116 0.00083 35 3S -0.00389 0.00406 -0.00256 0.00313 0.00311 36 4S 0.00084 0.00258 0.00850 -0.01064 -0.00945 37 5S -0.09721 0.06053 0.24167 0.04659 0.07549 38 6S 0.25423 -0.11843 -0.45139 -0.02698 -0.12718 39 7PX 0.00018 -0.00010 0.00088 0.00014 -0.00035 40 7PY -0.00111 -0.00059 -0.00536 0.00048 0.00105 41 7PZ 0.00186 -0.00012 0.00157 -0.00076 -0.00065 42 8PX -0.00047 0.00026 -0.00311 -0.00054 0.00106 43 8PY 0.00362 0.00216 0.01850 -0.00127 -0.00327 44 8PZ -0.00612 0.00028 -0.00567 0.00228 0.00198 45 9PX -0.00401 0.00183 0.02157 0.00530 0.00108 46 9PY -0.00637 -0.01838 -0.10828 -0.00946 0.00051 47 9PZ 0.02278 0.00390 0.04430 0.00076 0.00299 48 10PX 0.01150 0.00912 0.00409 -0.00455 -0.00919 49 10PY -0.11538 0.02887 0.06729 0.02225 0.05144 50 10PZ 0.01512 -0.01276 -0.04775 -0.00687 -0.05338 51 11XX 0.00346 -0.00292 0.00171 -0.00293 -0.00273 52 11YY -0.00101 -0.00177 0.00033 -0.00130 -0.00085 53 11ZZ 0.00451 -0.00308 -0.00105 -0.00338 -0.00330 54 11XY 0.00305 -0.00065 -0.00069 -0.00053 -0.00088 55 11XZ -0.00178 -0.00037 -0.00030 0.00054 0.00181 56 11YZ 0.00162 -0.00144 -0.00731 -0.00404 -0.00483 57 12XX -0.03771 0.02435 0.09864 -0.00845 0.00543 58 12YY 0.01552 0.02652 0.16692 -0.01095 -0.00744 59 12ZZ -0.04500 0.02757 0.12810 -0.00045 0.00686 60 12XY -0.01614 -0.00194 -0.01495 0.00005 0.00262 61 12XZ 0.00595 0.00626 0.01442 -0.00044 -0.01046 62 12YZ -0.02646 0.00628 0.01671 0.02003 0.03683 63 5 C 1S -0.07456 0.00662 -0.00879 -0.00091 0.00547 64 2S -0.12656 0.06970 0.16243 0.02414 -0.02054 65 2PX -0.01067 0.00223 -0.00429 -0.00568 0.00862 66 2PY -0.01398 0.00128 -0.00316 -0.00615 0.00952 67 2PZ 0.00143 0.00555 0.09083 -0.00178 -0.01738 68 3S 1.92124 -0.16124 0.00237 0.02939 0.28576 69 3PX -0.09256 0.18252 0.65832 0.11201 -0.04722 70 3PY 0.00291 0.21136 0.73621 0.11411 -0.19966 71 3PZ -0.65190 -0.20495 -0.28530 -0.07261 -0.12109 72 4XX -0.33752 -0.00799 -0.17235 0.03542 0.15921 73 4YY -0.02149 -0.01612 0.03571 -0.08824 0.08229 74 4ZZ 0.32436 0.00221 0.05351 0.04353 -0.22032 75 4XY 0.38364 -0.09391 -0.11845 0.04826 0.08737 76 4XZ 0.02412 -0.00231 0.04271 -0.45401 0.05508 77 4YZ 0.02087 0.03665 -0.07101 0.25390 0.15022 78 6 C 1S 0.04857 0.00240 0.01126 0.00214 -0.00335 79 2S 0.14997 0.02023 0.03827 0.01702 0.07424 80 2PX -0.05444 -0.00094 -0.03088 -0.00596 0.01608 81 2PY -0.07854 0.00366 -0.01549 -0.00524 0.02014 82 2PZ -0.16348 0.00060 -0.01109 0.00241 0.07089 83 3S -1.27465 -0.31794 -0.60268 -0.14644 -0.41608 84 3PX -0.01727 0.04062 0.13258 0.01575 0.05918 85 3PY 0.00531 0.09198 0.29707 0.03485 0.15184 86 3PZ -0.69739 -0.04742 0.01767 -0.05877 -0.29392 87 4XX 0.21142 0.00157 0.12949 -0.29871 -0.00908 88 4YY 0.03507 -0.02607 -0.20384 0.27834 0.08157 89 4ZZ -0.22792 0.02061 0.09459 0.02753 -0.09939 90 4XY -0.28055 -0.02394 -0.07053 -0.17152 0.07817 91 4XZ -0.09199 -0.01117 0.01276 -0.32353 0.06007 92 4YZ -0.04952 0.03389 -0.01401 0.19495 0.13067 93 7 C 1S 0.02400 -0.01348 -0.02688 -0.00585 -0.01492 94 2S 0.14877 -0.09569 -0.16510 -0.04792 -0.04688 95 2PX 0.14783 -0.01170 0.00963 -0.00480 -0.07460 96 2PY 0.24600 -0.02219 0.01640 -0.00698 -0.14223 97 2PZ -0.09988 0.01450 0.03823 0.00539 0.05466 98 3S -1.45783 0.68249 1.17943 0.28843 0.80696 99 3PX 0.04124 0.03710 0.09303 0.00017 0.00372 100 3PY 0.17590 0.01123 0.04457 -0.02480 -0.00556 101 3PZ -0.82071 0.36852 0.53766 0.17860 0.53458 102 4XX 0.09325 -0.08783 -0.04218 -0.41233 -0.06746 103 4YY 0.06172 -0.02593 -0.18858 0.37756 0.05491 104 4ZZ -0.14458 0.12828 0.29461 0.04587 -0.02345 105 4XY -0.11326 0.03689 0.16020 -0.22878 0.06464 106 4XZ 0.11794 0.02265 0.00927 0.12847 -0.06770 107 4YZ 0.21897 -0.01322 -0.00769 -0.09131 -0.11330 108 8 C 1S -0.09292 0.01662 0.00676 0.00485 0.02970 109 2S -0.29730 0.05557 0.01612 0.00749 0.03629 110 2PX 0.06521 -0.01556 -0.02339 -0.01078 -0.03540 111 2PY 0.10229 -0.02501 -0.04345 -0.01946 -0.06838 112 2PZ 0.14200 -0.01628 0.08267 0.01820 -0.03659 113 3S 3.69569 -0.74884 -0.35707 -0.23662 -1.29037 114 3PX 0.95109 -0.19709 -0.11679 -0.06163 -0.33816 115 3PY 1.52482 -0.32057 -0.19141 -0.10145 -0.55662 116 3PZ 0.79736 -0.04569 0.32009 0.03847 -0.21133 117 4XX -0.45402 0.05346 -0.01904 -0.06518 0.17174 118 4YY -0.03570 -0.03724 -0.18917 0.07730 0.14349 119 4ZZ 0.47072 -0.02283 0.18240 -0.01940 -0.31401 120 4XY 0.44682 -0.12204 -0.14229 -0.12448 -0.02476 121 4XZ 0.14769 0.01412 -0.03581 0.45254 0.05346 122 4YZ 0.07769 -0.01489 0.18253 -0.24846 0.07715 123 9 C 1S 0.08078 -0.00777 0.01796 0.00092 -0.01748 124 2S 0.28962 -0.03293 0.00071 -0.01475 -0.06276 125 2PX 0.03397 -0.00669 -0.01615 -0.00966 -0.06120 126 2PY 0.04343 -0.01387 -0.04987 -0.01830 -0.10336 127 2PZ 0.26329 -0.02964 0.05965 -0.00403 -0.14871 128 3S -3.62408 0.38495 -0.83999 0.00195 0.94343 129 3PX -0.48434 0.02960 -0.16293 -0.00934 0.10208 130 3PY -0.90834 0.06133 -0.29939 -0.02102 0.22428 131 3PZ 1.49655 -0.19138 0.16534 -0.01403 -0.49948 132 4XX 0.41408 -0.02799 -0.00497 0.30775 -0.06622 133 4YY 0.01434 -0.06388 -0.04253 -0.32062 -0.08258 134 4ZZ -0.46338 0.09035 0.01629 0.00903 0.13451 135 4XY -0.38939 0.02132 -0.17532 0.15283 0.03711 136 4XZ 0.00534 0.03332 -0.06578 0.30084 0.09329 137 4YZ 0.04244 0.01296 0.08709 -0.21467 0.07988 138 10 C 1S -0.00792 -0.00836 -0.02402 -0.00473 -0.00610 139 2S -0.15398 -0.03068 -0.17460 -0.02915 0.09190 140 2PX -0.13415 0.00708 -0.05091 -0.02053 0.03655 141 2PY -0.23763 0.03011 -0.04905 -0.02134 0.06295 142 2PZ 0.08892 -0.01821 0.01965 0.00566 -0.06454 143 3S 1.29234 0.29232 1.36440 0.19580 -0.35158 144 3PX -0.34943 0.06543 -0.14511 0.00139 0.04524 145 3PY -0.55775 0.12271 -0.17338 0.02233 0.06296 146 3PZ -0.42954 -0.13685 -0.66461 -0.10068 0.26217 147 4XX 0.00185 -0.02989 -0.18327 0.37018 0.03872 148 4YY 0.00107 -0.05367 0.02968 -0.38583 0.07820 149 4ZZ 0.02672 0.08511 0.16499 0.01554 -0.14341 150 4XY 0.05242 0.03341 0.04562 0.27205 0.13715 151 4XZ 0.17827 0.02403 0.21448 -0.09795 -0.03057 152 4YZ 0.32393 -0.00967 0.13441 0.07434 -0.01142 153 11 H 1S -0.09088 -0.05448 -0.13319 -0.01600 0.04404 154 2S 0.11498 0.05027 0.22484 0.03531 -0.07457 155 12 H 1S 0.19388 -0.00236 0.05960 -0.00892 0.04176 156 2S -0.46477 0.03932 -0.10224 -0.00221 0.09964 157 13 H 1S -0.13610 0.05570 0.09809 0.02496 -0.09274 158 2S 0.48633 -0.10466 -0.07153 -0.03372 -0.11914 159 14 H 1S 0.00508 -0.06109 -0.14945 -0.01527 0.05854 160 2S -0.14320 0.10593 0.19248 0.04812 0.09289 161 15 H 1S 0.09897 0.01214 0.00253 -0.00901 0.03707 162 2S -0.17596 -0.00025 0.02218 -0.00022 -0.10789 163 16 C 1S 0.00085 0.01094 0.02675 -0.00064 0.06648 164 2S -0.05382 0.00637 -0.00773 -0.01872 0.36927 165 2PX 0.00802 -0.01176 -0.02381 -0.00598 -0.11882 166 2PY 0.02217 -0.05118 -0.09984 -0.02879 0.15862 167 2PZ 0.00130 -0.01959 -0.06717 -0.02230 0.08912 168 3S -0.22974 -0.19702 -0.45037 0.24084 -3.73605 169 3PX -0.45847 0.47569 1.41713 0.51939 -2.12487 170 3PY 0.38159 -0.39996 -1.28017 -0.35191 1.93105 171 3PZ 0.26740 -0.23437 -0.69314 -0.19802 1.10925 172 4XX 0.09699 -0.12933 -0.40248 -0.09981 -0.09584 173 4YY -0.08420 -0.23421 0.31336 0.12078 -0.08797 174 4ZZ -0.02614 0.36605 0.08670 -0.02744 0.23609 175 4XY -0.21339 -0.11366 -0.06168 0.03954 -0.45488 176 4XZ -0.04470 0.22578 -0.06306 0.01577 -0.24719 177 4YZ -0.02847 0.20990 -0.08106 -0.00065 -0.25938 178 17 C 1S -0.01670 0.00425 0.01267 0.00790 -0.07441 179 2S -0.05197 0.03189 0.09442 0.02864 -0.33217 180 2PX -0.03326 -0.00758 -0.04412 -0.01355 0.02021 181 2PY 0.06289 0.00195 -0.01822 -0.02915 0.16609 182 2PZ 0.04272 -0.01530 -0.00617 -0.01770 0.09233 183 3S 0.77815 -0.51129 -1.54070 -0.58332 4.48543 184 3PX 0.66747 -0.32974 -0.87502 -0.35846 2.41181 185 3PY 0.13546 -0.12130 -0.39633 -0.11457 0.96647 186 3PZ -0.01118 -0.06358 -0.21253 -0.05810 0.44494 187 4XX -0.01277 -0.03437 -0.16735 -0.02973 -0.00792 188 4YY 0.01096 -0.34735 0.14203 0.02798 0.17985 189 4ZZ -0.01948 0.36302 -0.05118 -0.01478 -0.22082 190 4XY -0.03460 0.02164 -0.30102 -0.04799 -0.15061 191 4XZ -0.07187 -0.19803 -0.11589 -0.01443 -0.09131 192 4YZ 0.10997 0.24718 -0.09108 -0.06291 0.35825 193 18 C 1S 0.00765 -0.00629 -0.01241 -0.00220 0.04158 194 2S 0.09831 -0.08820 -0.23164 -0.07174 0.35889 195 2PX 0.08145 0.02784 0.08079 -0.02593 0.23082 196 2PY -0.00448 -0.02269 -0.06686 -0.01506 -0.06385 197 2PZ -0.00756 -0.00868 -0.03964 -0.00828 -0.04122 198 3S -0.80314 0.62753 1.56158 0.48424 -3.81925 199 3PX -0.02740 0.04200 -0.00696 -0.04225 -0.39237 200 3PY -0.38595 0.34585 0.90369 0.27879 -1.86748 201 3PZ -0.17249 0.18776 0.49850 0.15481 -0.99539 202 4XX 0.05870 -0.04446 -0.15390 -0.06822 0.00755 203 4YY -0.11841 -0.01803 0.15783 0.06226 -0.18620 204 4ZZ 0.03286 0.05664 -0.02336 0.00672 0.10868 205 4XY -0.02754 0.25532 -0.14617 -0.04784 -0.13687 206 4XZ -0.10427 -0.46783 0.08441 0.02754 -0.06863 207 4YZ -0.08103 0.08144 0.13649 0.04347 -0.25489 208 19 C 1S -0.00019 0.01928 0.05140 0.00914 -0.02729 209 2S -0.05407 0.08233 0.22699 0.07123 -0.36924 210 2PX -0.00368 -0.02566 -0.13466 -0.04473 -0.06998 211 2PY -0.00746 -0.06087 -0.21666 -0.05274 -0.05902 212 2PZ -0.00321 -0.03231 -0.11539 -0.02804 -0.02919 213 3S 0.42859 -0.96638 -2.59094 -0.67537 3.35993 214 3PX -0.16949 0.30486 0.78697 0.18116 -1.39314 215 3PY 0.08903 -0.40333 -1.17487 -0.32813 0.93878 216 3PZ 0.03589 -0.22096 -0.66346 -0.18586 0.54172 217 4XX 0.07247 0.02078 0.17195 0.05537 0.21956 218 4YY 0.01206 0.20560 -0.36496 -0.09727 -0.02900 219 4ZZ -0.04776 -0.22293 0.21807 0.03606 -0.08954 220 4XY -0.15215 0.16297 -0.06588 0.04824 -0.50262 221 4XZ -0.13119 -0.29691 0.07534 0.05959 -0.28161 222 4YZ -0.05212 -0.36058 -0.32637 -0.06365 0.07667 223 20 C 1S -0.00438 -0.01902 -0.05985 -0.01471 0.02695 224 2S 0.02046 -0.04346 -0.10264 -0.04232 0.36850 225 2PX 0.01207 -0.04626 -0.16700 -0.05165 0.04809 226 2PY -0.05913 -0.04618 -0.13347 -0.00572 -0.12506 227 2PZ -0.03192 -0.02891 -0.06391 -0.00016 -0.06898 228 3S -0.20852 1.12112 3.42066 0.99219 -3.31484 229 3PX 0.06443 -0.46031 -1.42401 -0.42289 1.73543 230 3PY 0.10003 -0.20458 -0.57184 -0.17788 0.60240 231 3PZ 0.06307 -0.11662 -0.27561 -0.08210 0.28766 232 4XX 0.02305 0.01876 -0.01571 0.02316 -0.42104 233 4YY 0.04458 0.43647 0.15969 0.01737 0.18118 234 4ZZ -0.08284 -0.43510 -0.08822 -0.01637 0.16007 235 4XY -0.08910 -0.07936 0.01454 0.03681 -0.33046 236 4XZ -0.02851 0.17884 -0.06920 -0.00741 -0.16433 237 4YZ -0.01691 -0.14464 0.47191 0.10776 0.03416 238 21 C 1S 0.00108 0.00170 0.00989 0.00818 -0.05982 239 2S 0.00297 0.06022 0.19116 0.07258 -0.31244 240 2PX -0.06481 -0.07372 -0.26694 -0.03175 -0.24997 241 2PY 0.00936 -0.00847 0.01918 0.00212 -0.02706 242 2PZ 0.00737 0.01848 0.00526 0.00086 -0.00998 243 3S 0.17575 -0.56574 -1.84680 -0.74985 3.70906 244 3PX -0.00150 -0.16700 -0.54594 -0.07629 -0.40056 245 3PY -0.19839 0.38163 1.28587 0.45483 -1.91656 246 3PZ -0.12256 0.24084 0.70948 0.24460 -1.04246 247 4XX 0.09961 0.04740 0.03622 -0.02732 0.12623 248 4YY -0.10314 0.05615 -0.10083 -0.01136 0.04776 249 4ZZ -0.01050 -0.10899 0.04652 0.04185 -0.19961 250 4XY -0.07706 -0.14987 0.33008 0.09999 0.01768 251 4XZ 0.03917 0.46420 0.03354 0.00501 -0.00041 252 4YZ -0.08051 -0.08150 -0.05632 -0.01929 0.22646 253 22 H 1S 0.10527 -0.01985 -0.07784 -0.03165 -0.02610 254 2S 0.02660 -0.09070 -0.29378 -0.10207 0.55231 255 23 H 1S 0.01208 -0.01870 -0.00373 -0.01944 0.24014 256 2S -0.02341 0.11387 0.32497 0.10705 -0.51216 257 24 H 1S -0.10428 0.01906 0.00779 0.02993 -0.28929 258 2S 0.08112 -0.12434 -0.32749 -0.09493 0.49446 259 25 H 1S 0.08098 -0.01817 -0.06555 -0.02657 0.11558 260 2S -0.13342 0.09410 0.24654 0.07831 -0.52747 261 26 H 1S 0.03145 0.03284 0.16597 0.02075 0.10874 262 2S 0.24988 -0.13673 -0.42035 -0.13319 0.58356 263 27 H 1S 0.05818 0.00559 -0.00742 -0.01715 -0.09292 264 2S -0.02921 0.04412 0.14336 0.03168 -0.00556 236 237 238 239 240 V V V V V Eigenvalues -- 2.69363 2.70691 2.71031 2.72560 2.73875 1 1 C 1S -0.00513 -0.01713 0.00366 -0.00096 0.02647 2 2S -0.07015 -0.08588 -0.11943 -0.00513 0.20903 3 2PX -0.00584 -0.07234 0.05901 0.02162 0.06934 4 2PY 0.01469 0.03561 0.00491 0.00299 -0.02226 5 2PZ 0.02013 0.02478 0.00749 -0.01118 -0.02000 6 3S 0.66957 0.75331 -0.24349 0.34186 -1.66484 7 3PX 0.44234 0.59666 -0.55015 -0.14909 -0.10406 8 3PY -0.48716 0.06471 -0.25068 -0.24152 0.53888 9 3PZ -0.31015 -0.02609 -0.12492 -0.22632 0.37704 10 4XX -0.01808 0.13247 -0.02481 -0.02759 -0.08720 11 4YY 0.02793 -0.10178 0.05412 0.04237 0.02625 12 4ZZ -0.01788 -0.07879 0.03693 -0.00049 0.06791 13 4XY -0.07022 0.07980 0.04387 -0.06688 -0.06377 14 4XZ -0.04792 0.06282 0.02125 -0.01978 -0.04794 15 4YZ 0.03520 -0.01332 0.02312 0.02108 -0.04690 16 2 C 1S 0.00076 0.00362 -0.00963 -0.00717 -0.02431 17 2S -0.19515 0.04846 -0.00135 0.03608 -0.31951 18 2PX 0.02599 -0.04684 -0.06721 0.00821 0.01927 19 2PY 0.07061 -0.02279 -0.04017 0.00102 0.02090 20 2PZ 0.03484 -0.02291 -0.01124 -0.00148 0.02195 21 3S -0.24947 0.45110 0.26762 0.12166 1.70308 22 3PX 0.33744 -0.15111 -0.12521 -0.29064 0.11467 23 3PY 0.29346 -0.10560 -0.23957 -0.23646 -0.85753 24 3PZ 0.10000 0.08754 -0.24947 0.47270 -0.49577 25 4XX 0.03866 -0.10477 0.09161 -0.00181 0.12136 26 4YY -0.05056 0.06657 0.04159 0.02612 -0.00118 27 4ZZ 0.07062 0.02088 -0.13183 -0.07257 -0.04484 28 4XY -0.07161 0.08056 0.11826 0.02502 -0.01166 29 4XZ -0.06486 0.03432 0.11071 -0.07159 -0.00895 30 4YZ -0.04377 0.02713 0.08850 -0.06028 0.09816 31 3 H 1S -0.05446 -0.02630 0.10266 -0.03712 -0.03066 32 2S 0.03939 -0.02004 0.04694 -0.11921 0.21796 33 4 Br 1S 0.00041 0.00010 -0.00013 -0.00082 -0.00002 34 2S -0.00415 0.00022 0.00319 0.00623 -0.00157 35 3S 0.00749 -0.00207 -0.00791 -0.00872 0.00644 36 4S 0.00809 0.00318 -0.00295 -0.01667 -0.00724 37 5S 0.00936 0.02200 -0.00640 -0.00804 -0.28595 38 6S -0.05637 -0.04367 -0.00409 0.16099 0.64269 39 7PX 0.00015 0.00086 -0.00033 0.00089 -0.00112 40 7PY 0.00085 -0.00092 -0.00028 -0.00059 0.00409 41 7PZ -0.00037 0.00083 0.00067 0.00123 0.00044 42 8PX -0.00052 -0.00291 0.00110 -0.00290 0.00376 43 8PY -0.00283 0.00307 0.00083 0.00221 -0.01416 44 8PZ 0.00120 -0.00282 -0.00207 -0.00421 -0.00126 45 9PX 0.00446 0.01487 -0.00304 0.00741 -0.01772 46 9PY 0.01176 -0.01223 0.00030 -0.02228 0.08890 47 9PZ -0.00262 0.01534 0.00062 0.02273 -0.00565 48 10PX -0.02471 -0.00900 -0.01247 0.04688 0.01483 49 10PY -0.00147 -0.01355 0.02231 -0.03217 -0.16963 50 10PZ -0.02566 -0.01938 0.02163 0.02631 0.06079 51 11XX -0.00397 0.00323 0.00544 0.00369 0.00236 52 11YY -0.00483 -0.00141 0.00658 0.00632 -0.00931 53 11ZZ -0.00263 0.00161 0.00133 0.00227 -0.00131 54 11XY -0.00336 -0.00020 -0.00144 0.00409 -0.00150 55 11XZ -0.00058 0.00006 0.00065 -0.00309 -0.00307 56 11YZ -0.00206 -0.00172 0.00307 -0.00120 0.00293 57 12XX 0.01697 0.00756 -0.00895 -0.02871 -0.16270 58 12YY 0.01653 0.04205 -0.02181 -0.03183 -0.11535 59 12ZZ 0.00102 0.01574 0.02379 -0.01280 -0.13143 60 12XY 0.02409 -0.00455 0.01544 -0.03895 0.01781 61 12XZ 0.00093 0.00490 -0.00507 0.02731 0.01656 62 12YZ 0.01842 0.00717 -0.01843 -0.00899 -0.01481 63 5 C 1S 0.02966 -0.03531 -0.03107 -0.00436 -0.05245 64 2S 0.08512 -0.23261 -0.26391 0.12603 0.11573 65 2PX -0.01975 -0.07986 -0.06136 0.01115 -0.11996 66 2PY -0.00279 -0.07742 -0.07359 0.03529 -0.22312 67 2PZ 0.07429 -0.05605 -0.03116 -0.40681 0.04396 68 3S -1.71996 2.42334 2.22588 0.19739 2.90060 69 3PX 0.86314 -0.59902 -0.81736 0.06998 -1.52807 70 3PY 1.28967 -1.12629 -1.37107 0.27132 -2.12210 71 3PZ 0.66662 -0.55821 -0.25927 -2.22380 0.03956 72 4XX 0.18297 -0.13640 -0.17272 -0.05784 -0.23161 73 4YY 0.21606 -0.07831 -0.20764 -0.10759 0.00661 74 4ZZ -0.27886 0.30416 0.39796 0.18430 0.27026 75 4XY 0.01154 0.06461 -0.00394 -0.05387 0.18462 76 4XZ 0.02583 -0.03546 -0.06624 0.18694 -0.06905 77 4YZ 0.08333 -0.08951 -0.13093 0.22163 -0.14653 78 6 C 1S -0.05109 0.03123 0.03833 0.06249 0.00005 79 2S -0.19511 0.10003 0.15628 0.14412 0.33851 80 2PX -0.05050 -0.07782 -0.02655 0.04858 -0.16752 81 2PY -0.07128 -0.09016 -0.03444 0.07123 -0.28738 82 2PZ 0.09351 -0.13836 -0.14976 -0.08554 -0.15497 83 3S 3.05970 -1.93049 -2.36003 -2.72095 -1.00730 84 3PX -0.60889 0.26637 0.49335 -0.10295 0.00840 85 3PY -1.16335 0.50706 0.93329 0.01563 0.13440 86 3PZ 0.86998 -1.11545 -0.81689 -1.49948 -1.48592 87 4XX -0.09610 0.13843 0.08463 0.29011 0.14230 88 4YY 0.20248 0.11867 -0.09202 0.16579 0.39748 89 4ZZ -0.06792 -0.19805 -0.00356 -0.42757 -0.56775 90 4XY 0.33748 -0.04297 -0.22525 -0.14648 0.30324 91 4XZ 0.11390 -0.10161 -0.07410 -0.32494 0.09031 92 4YZ 0.16836 -0.10467 -0.07146 -0.49739 0.18086 93 7 C 1S 0.03440 -0.01780 -0.01891 -0.03616 0.00946 94 2S 0.16679 -0.15596 -0.18615 -0.10933 -0.15277 95 2PX -0.15976 0.01614 0.10216 0.08903 -0.15671 96 2PY -0.25627 0.01995 0.17204 0.15359 -0.26927 97 2PZ 0.01788 -0.00695 -0.03347 -0.05639 -0.01383 98 3S -2.54812 1.57020 2.02405 0.88800 0.76998 99 3PX -0.44183 -0.00303 0.27626 0.07150 -0.34782 100 3PY -0.65169 -0.05037 0.38428 0.01597 -0.63469 101 3PZ -1.14506 0.99164 0.95685 0.90307 0.86728 102 4XX 0.09973 -0.10463 -0.10004 -0.04733 -0.08767 103 4YY -0.02698 -0.09338 -0.10167 0.23481 -0.37794 104 4ZZ -0.09574 0.19773 0.24681 -0.28271 0.43857 105 4XY -0.17189 -0.01764 -0.00112 0.32792 -0.32622 106 4XZ -0.15407 -0.06434 0.12674 -0.17636 -0.17065 107 4YZ -0.23425 -0.12159 0.17965 -0.28076 -0.31836 108 8 C 1S -0.01165 0.02016 0.00946 0.00758 0.03635 109 2S -0.31138 0.12902 0.26090 -0.05626 0.02321 110 2PX -0.04112 -0.03537 0.02551 -0.06110 -0.09266 111 2PY -0.05839 -0.06390 0.04174 -0.12249 -0.14518 112 2PZ -0.03397 0.03090 -0.02552 0.24628 -0.16916 113 3S 1.77088 -1.84304 -1.72499 -0.33613 -2.65503 114 3PX 0.57227 -0.42604 -0.49985 -0.00058 -0.47725 115 3PY 0.92821 -0.71024 -0.80673 0.01185 -0.78326 116 3PZ 0.37263 -0.18028 -0.31245 -0.07711 -0.30989 117 4XX 0.04603 0.00837 -0.07694 0.04562 0.08734 118 4YY 0.21305 -0.16811 -0.26071 0.05600 -0.12426 119 4ZZ -0.24054 0.08999 0.28887 -0.13389 -0.08909 120 4XY 0.19746 -0.19694 -0.22216 0.00604 -0.22050 121 4XZ 0.12777 -0.05773 -0.11227 -0.11446 -0.03775 122 4YZ 0.22860 -0.09442 -0.21583 -0.14418 -0.02176 123 9 C 1S 0.02914 -0.00864 -0.02530 0.04654 -0.02141 124 2S 0.18046 -0.16766 -0.19075 0.07017 -0.21422 125 2PX -0.10655 -0.01470 0.09504 -0.17247 -0.07461 126 2PY -0.16687 -0.02704 0.15436 -0.27478 -0.11754 127 2PZ -0.08372 0.00020 0.11071 -0.21220 -0.06160 128 3S -2.54585 1.33006 2.23296 -1.31238 1.68123 129 3PX -0.52872 0.14614 0.43164 -0.49561 0.04815 130 3PY -0.94013 0.30098 0.77035 -0.85638 0.18319 131 3PZ 0.62352 -0.77562 -0.77907 0.34405 -1.56600 132 4XX 0.06049 -0.07399 -0.07638 0.07248 -0.20590 133 4YY -0.15657 -0.11689 0.06563 -0.23775 -0.37263 134 4ZZ 0.02448 0.21008 0.06331 0.22614 0.52418 135 4XY -0.21481 -0.06517 0.12906 -0.38552 -0.18675 136 4XZ 0.15237 -0.10271 -0.10681 -0.27528 0.05934 137 4YZ 0.27026 -0.19757 -0.19969 -0.42932 0.06420 138 10 C 1S -0.03459 0.02050 0.04271 -0.07111 0.04388 139 2S -0.17559 0.15769 0.16933 -0.03834 0.32180 140 2PX -0.00548 -0.09957 -0.03601 -0.12093 -0.14047 141 2PY 0.00250 -0.15862 -0.07049 -0.20065 -0.25161 142 2PZ -0.07524 0.04979 0.09671 -0.14040 0.05975 143 3S 2.39503 -1.50995 -2.60026 3.00698 -2.72049 144 3PX -0.50910 0.00996 0.27254 0.00744 -0.32487 145 3PY -0.77853 -0.00238 0.41678 0.06163 -0.69348 146 3PZ -1.14147 1.04790 1.33520 -1.03017 2.06735 147 4XX -0.07249 0.08633 0.08470 -0.14282 0.20864 148 4YY 0.15835 0.07082 -0.15448 0.42147 0.12526 149 4ZZ -0.05400 -0.14198 0.08028 -0.29831 -0.28620 150 4XY 0.24121 -0.02698 -0.27233 0.55597 -0.07182 151 4XZ 0.13782 0.07334 -0.02406 -0.09893 0.31073 152 4YZ 0.21640 0.10522 -0.03077 -0.18307 0.57021 153 11 H 1S -0.00113 0.00185 -0.05049 0.13674 -0.06850 154 2S 0.30456 -0.25072 -0.28996 0.05914 -0.43483 155 12 H 1S 0.19023 -0.09320 -0.12547 -0.21692 0.07122 156 2S -0.32844 0.20644 0.30683 -0.14151 0.25424 157 13 H 1S -0.16464 0.14653 0.20161 0.02771 0.13826 158 2S 0.31722 -0.24312 -0.29972 -0.00969 -0.25528 159 14 H 1S 0.09725 -0.02731 -0.14721 0.24936 -0.06970 160 2S -0.32112 0.21314 0.28110 0.12030 0.15995 161 15 H 1S 0.04608 -0.07149 -0.02855 -0.15703 0.06372 162 2S 0.30102 -0.26196 -0.27849 -0.11432 -0.43905 163 16 C 1S -0.05372 -0.00874 -0.00746 -0.00301 0.01241 164 2S -0.11485 0.15972 0.11176 -0.05970 -0.06794 165 2PX 0.20853 -0.08147 0.19145 0.04089 -0.01201 166 2PY -0.01276 -0.17318 0.15356 0.02604 0.03119 167 2PZ -0.00940 -0.09175 0.07867 0.00228 0.01598 168 3S 2.63775 0.10734 -0.01587 0.27115 -0.31315 169 3PX 1.97196 -0.86059 0.97457 0.76059 -0.73062 170 3PY -0.75471 -1.53774 1.55587 0.11990 0.95557 171 3PZ -0.45892 -0.80571 0.84375 0.10283 0.54191 172 4XX 0.23115 -0.12152 0.33185 0.01475 0.02805 173 4YY -0.02195 0.17388 -0.24034 -0.01290 -0.06814 174 4ZZ -0.19371 0.00780 -0.09235 -0.01459 0.02174 175 4XY 0.10336 -0.08891 0.08464 0.04693 0.02908 176 4XZ 0.05641 -0.05877 0.03550 0.03446 0.02100 177 4YZ 0.16249 0.11247 -0.12404 0.00153 -0.09350 178 17 C 1S 0.00160 0.02622 -0.06826 0.00146 -0.00882 179 2S 0.24213 0.12381 -0.06271 0.01006 -0.08615 180 2PX 0.22866 0.05284 0.23991 0.00743 -0.04657 181 2PY -0.18751 -0.05864 -0.07428 -0.01518 0.03536 182 2PZ -0.11105 -0.03027 -0.04073 -0.00272 0.03037 183 3S -1.00040 -1.07028 3.31590 -0.15524 0.59272 184 3PX -0.96265 0.03910 1.15385 -0.25455 0.29734 185 3PY -0.87034 -1.46787 0.51359 0.25967 0.78018 186 3PZ -0.43071 -0.80773 0.22368 0.11335 0.37915 187 4XX 0.11814 0.48006 0.02427 -0.12984 -0.11272 188 4YY -0.06757 -0.39962 0.18984 0.09693 0.12111 189 4ZZ -0.02274 -0.02690 -0.21222 0.03638 -0.01121 190 4XY -0.43524 -0.18056 -0.34107 -0.02377 0.21904 191 4XZ -0.24244 -0.10262 -0.19287 -0.01929 0.12645 192 4YZ -0.00865 -0.35355 0.37090 0.05785 0.09628 193 18 C 1S 0.00045 -0.00613 0.04485 -0.00100 -0.00481 194 2S -0.21187 -0.01998 0.13958 -0.04372 0.04055 195 2PX 0.26251 0.06506 0.32901 0.00546 -0.06910 196 2PY -0.10115 -0.06602 -0.10155 0.00479 0.06091 197 2PZ -0.06045 -0.03958 -0.06529 0.00248 0.03052 198 3S 1.26566 -0.43448 -1.96921 0.49042 0.06256 199 3PX 0.84852 0.83423 0.38005 -0.12683 -0.33064 200 3PY 0.65701 0.11357 -1.15431 0.15535 -0.16202 201 3PZ 0.32828 0.04752 -0.62174 0.10171 -0.05922 202 4XX -0.13336 0.39910 -0.30552 -0.11768 -0.01771 203 4YY 0.09720 -0.36320 0.10628 0.10657 0.05963 204 4ZZ 0.04595 -0.13308 0.21886 0.03409 -0.00447 205 4XY 0.49320 0.18892 0.40673 0.00313 -0.08793 206 4XZ 0.26775 0.10403 0.23572 -0.00445 -0.04544 207 4YZ 0.02180 -0.21047 -0.11797 0.07414 0.06502 208 19 C 1S 0.03560 0.01387 -0.00651 0.00451 -0.01438 209 2S 0.07489 -0.17148 -0.13263 0.07403 0.03756 210 2PX 0.05993 0.21708 -0.05519 -0.05208 -0.01389 211 2PY -0.14711 0.03862 -0.13323 -0.03854 0.08869 212 2PZ -0.08266 0.01555 -0.07048 -0.01856 0.04926 213 3S -2.59844 -0.23952 0.55767 -0.48864 0.71811 214 3PX 0.84315 -0.16050 -0.28245 0.20929 -0.03565 215 3PY -0.57527 0.16187 0.40247 -0.21615 0.24875 216 3PZ -0.33056 0.08805 0.21993 -0.12918 0.12731 217 4XX -0.21866 0.08366 -0.18499 -0.03156 -0.09219 218 4YY -0.00057 -0.14517 0.13625 0.01325 0.12776 219 4ZZ 0.12676 0.02452 0.01847 0.01435 -0.01684 220 4XY 0.04227 -0.15024 -0.08579 0.05120 0.06438 221 4XZ 0.02976 -0.07234 -0.04166 0.02856 0.03952 222 4YZ -0.12290 -0.13160 0.10895 -0.00975 0.12895 223 20 C 1S -0.02419 0.04145 -0.00741 -0.01468 -0.00029 224 2S -0.25169 0.07825 -0.03928 -0.05868 0.00537 225 2PX 0.07834 0.26145 0.01928 -0.05961 -0.06795 226 2PY -0.05057 -0.33963 0.11363 0.06337 0.15029 227 2PZ -0.02967 -0.19134 0.06099 0.03702 0.08235 228 3S 1.82320 -1.73919 -0.43079 0.89672 -0.28011 229 3PX -1.04198 1.16852 -0.07862 -0.51294 -0.02172 230 3PY -0.97019 -0.31399 -0.22192 -0.11711 0.41937 231 3PZ -0.50744 -0.19599 -0.11558 -0.04861 0.23547 232 4XX -0.23931 -0.27276 -0.30139 0.03065 0.21996 233 4YY 0.22682 0.05129 0.19516 0.02983 -0.15359 234 4ZZ -0.02665 0.19907 0.02646 -0.05014 -0.05362 235 4XY 0.21897 0.50458 -0.16239 -0.07323 -0.18952 236 4XZ 0.12524 0.28508 -0.08273 -0.04396 -0.11127 237 4YZ 0.20715 -0.13713 0.15730 0.06972 -0.08141 238 21 C 1S 0.04336 -0.06229 0.03629 0.02121 0.00650 239 2S 0.29608 0.01943 0.02621 0.05609 -0.11104 240 2PX 0.18611 0.19486 0.07809 -0.02299 -0.07761 241 2PY -0.03376 -0.20980 0.04285 0.03703 0.07981 242 2PZ -0.02292 -0.11975 0.02328 0.01928 0.04588 243 3S -2.64300 2.83530 -1.27868 -1.23624 0.03451 244 3PX 1.28164 0.09712 1.08648 0.15897 -0.31196 245 3PY 1.26866 -0.77712 0.19883 0.50530 -0.31799 246 3PZ 0.66999 -0.43293 0.07996 0.26211 -0.17278 247 4XX -0.35881 0.43158 -0.52500 -0.13891 -0.01146 248 4YY 0.18148 -0.15741 0.31900 0.05184 -0.01675 249 4ZZ 0.21399 -0.28553 0.24209 0.09696 0.02192 250 4XY -0.38630 -0.47799 -0.19539 0.07245 0.22863 251 4XZ -0.18905 -0.29514 -0.08783 0.05430 0.12859 252 4YZ -0.01891 0.14220 0.07713 -0.03253 -0.04213 253 22 H 1S -0.05813 0.08621 -0.11539 -0.03668 0.02562 254 2S -0.38738 0.04466 -0.01948 -0.11195 0.14876 255 23 H 1S 0.08286 -0.06709 0.21150 0.02442 -0.02956 256 2S 0.28549 -0.21085 -0.02086 0.11374 -0.00627 257 24 H 1S 0.10356 -0.01837 0.00362 0.02103 0.01016 258 2S -0.27285 0.06175 0.11299 -0.08092 0.03781 259 25 H 1S -0.08995 0.24980 -0.12422 -0.07611 -0.06048 260 2S 0.23420 -0.01534 -0.24353 0.05462 -0.03784 261 26 H 1S 0.05128 -0.08959 0.06785 0.05555 -0.05972 262 2S -0.52879 -0.17760 0.20381 -0.00459 0.35289 263 27 H 1S 0.00853 -0.06302 0.00572 0.03669 0.05248 264 2S 0.17441 -0.06816 0.24665 0.11131 -0.11653 241 242 243 244 245 V V V V V Eigenvalues -- 2.75717 2.80248 2.84045 2.95330 3.03556 1 1 C 1S 0.00128 -0.00044 0.05078 -0.07785 0.00241 2 2S -0.04135 0.02230 -0.00513 -0.14180 -0.01050 3 2PX 0.00951 -0.22106 -0.03040 0.13975 0.00819 4 2PY 0.00515 0.13216 0.07707 -0.13674 -0.00476 5 2PZ 0.01913 0.08321 0.05450 -0.07365 0.00886 6 3S -0.09473 0.41751 -1.19467 2.52813 -0.23284 7 3PX -0.20638 -1.02645 0.76680 0.90387 -0.18508 8 3PY 0.08397 0.32262 0.11894 -1.25137 0.16807 9 3PZ 0.05352 0.14176 0.08759 -0.82631 0.07433 10 4XX 0.07262 0.34290 -0.40536 0.16004 0.06114 11 4YY -0.08949 -0.33978 0.23465 -0.01469 -0.06243 12 4ZZ 0.02300 -0.11765 0.24536 -0.25068 0.01766 13 4XY 0.08664 0.22329 0.11218 -0.50218 0.06145 14 4XZ -0.08601 0.17825 0.07091 -0.24658 -0.02337 15 4YZ -0.00187 -0.26997 -0.02860 0.25073 -0.00360 16 2 C 1S 0.00774 0.04438 0.00438 0.08156 -0.01663 17 2S -0.04403 -0.09380 -0.07917 0.41792 -0.09439 18 2PX -0.04313 -0.11355 0.22461 0.02709 -0.05612 19 2PY -0.01442 0.06418 0.12860 0.10422 -0.03785 20 2PZ 0.03042 0.01425 0.05653 -0.00894 -0.01982 21 3S -0.00357 -0.84359 0.99571 -2.27917 0.37257 22 3PX 0.03888 -0.56843 0.88260 0.47677 -0.09426 23 3PY 0.03241 -0.05762 0.26201 1.39644 -0.23607 24 3PZ -0.14773 -0.03316 0.03293 0.89554 -0.22758 25 4XX 0.02047 -0.28253 0.38727 -0.04768 -0.01985 26 4YY 0.13905 0.15149 -0.33091 -0.20349 0.14922 27 4ZZ -0.12450 0.26652 -0.01042 0.28733 -0.13495 28 4XY 0.06135 -0.13276 -0.21159 -0.42830 0.14134 29 4XZ -0.15026 -0.02530 -0.06784 -0.20688 -0.06692 30 4YZ -0.21570 0.01466 -0.13973 -0.24643 -0.08160 31 3 H 1S 0.07476 -0.05906 -0.02032 -0.08755 0.01533 32 2S 0.02190 0.02096 0.01497 -0.07439 0.06007 33 4 Br 1S -0.00022 -0.00060 0.00040 0.00064 0.00034 34 2S -0.00228 0.00303 -0.00259 -0.00420 -0.00339 35 3S 0.01006 -0.00207 0.00322 0.00336 0.00611 36 4S -0.00659 -0.01095 0.00664 0.02038 0.00719 37 5S 0.02764 0.11357 -0.08194 0.14725 0.08355 38 6S -0.03555 -0.17572 0.10285 -0.33229 -0.21015 39 7PX -0.00147 -0.00044 -0.00065 -0.00024 -0.00066 40 7PY 0.00153 -0.00069 0.00073 -0.00577 -0.00053 41 7PZ -0.00223 0.00015 -0.00005 0.00121 -0.00135 42 8PX 0.00470 0.00141 0.00230 0.00073 0.00206 43 8PY -0.00493 0.00268 -0.00266 0.01968 0.00182 44 8PZ 0.00718 -0.00080 0.00036 -0.00425 0.00440 45 9PX -0.00966 -0.00225 -0.01484 0.00111 -0.00200 46 9PY 0.01273 -0.03090 0.02643 -0.09628 -0.01383 47 9PZ -0.01890 0.01866 -0.00873 0.02745 -0.01442 48 10PX -0.03124 -0.00269 -0.02156 -0.01766 -0.02082 49 10PY 0.02896 0.06397 -0.04823 -0.00911 0.06929 50 10PZ -0.02037 -0.04850 -0.03305 -0.06315 0.00907 51 11XX -0.00699 -0.00161 -0.00327 -0.00227 -0.00474 52 11YY -0.00711 0.00350 -0.00216 -0.00497 -0.00259 53 11ZZ -0.00306 -0.00095 0.00205 0.00083 -0.00193 54 11XY -0.00527 0.00111 0.00112 -0.00180 -0.00355 55 11XZ 0.00512 0.00257 0.00187 -0.00045 0.00389 56 11YZ -0.00369 -0.00537 0.00236 -0.00310 0.00021 57 12XX -0.00721 0.02537 -0.00209 0.10038 0.05363 58 12YY -0.01225 0.01199 -0.00910 0.19184 0.03056 59 12ZZ -0.03243 0.03208 -0.05514 0.06534 0.03920 60 12XY 0.03926 -0.00944 0.01152 0.01146 0.02506 61 12XZ -0.03563 -0.01614 -0.02608 -0.00196 -0.02406 62 12YZ 0.03092 0.02855 -0.00314 -0.00404 0.00489 63 5 C 1S -0.01363 -0.02634 -0.09046 -0.09619 0.02432 64 2S -0.11097 -0.19350 -0.47819 -0.38516 0.08292 65 2PX -0.01441 -0.00403 0.03967 0.05585 -0.04679 66 2PY -0.04316 0.02722 0.03776 0.11380 -0.11641 67 2PZ 0.14005 -0.03215 0.01072 0.12195 0.36925 68 3S 1.29765 1.81283 5.68487 5.04033 -1.13138 69 3PX -0.42111 -0.31289 -1.32159 0.11367 -0.19410 70 3PY -0.65781 -0.71768 -1.90385 0.01350 -0.36242 71 3PZ 0.34403 -0.35787 -0.34321 -0.20753 1.84931 72 4XX 0.03973 -0.09071 -0.09962 -0.19580 0.11198 73 4YY 0.30089 0.09033 0.17876 0.27837 0.24113 74 4ZZ -0.32450 -0.00337 -0.09415 -0.17345 -0.31801 75 4XY 0.21798 0.09003 0.51982 0.49041 0.04905 76 4XZ -0.33340 0.09825 0.13904 0.10866 -0.43509 77 4YZ -0.50960 0.22411 0.12743 0.14588 -0.65587 78 6 C 1S 0.00730 0.02961 0.06225 0.05079 -0.01384 79 2S 0.29574 0.14508 0.40763 0.16327 -0.00125 80 2PX 0.02927 0.04893 0.06374 0.04424 0.15615 81 2PY 0.01884 0.08593 0.09370 0.10774 0.22035 82 2PZ 0.25509 -0.02536 0.00454 0.02169 0.30666 83 3S -0.80262 -2.31435 -4.80560 -3.48215 0.75058 84 3PX 0.27804 0.42575 0.95529 0.66512 0.59018 85 3PY 0.52356 0.84930 1.68615 1.16147 0.86512 86 3PZ -0.50875 -0.69176 -1.95033 -1.03670 1.53614 87 4XX -0.03362 0.09089 0.18253 0.11188 -0.20702 88 4YY -0.12253 -0.07942 -0.06092 -0.12920 -0.45187 89 4ZZ 0.25293 -0.08167 -0.17235 0.04984 0.65218 90 4XY -0.10552 -0.15220 -0.26656 -0.23688 -0.26864 91 4XZ -0.04715 -0.00120 0.10572 -0.00360 0.03807 92 4YZ -0.10320 0.10653 0.13606 0.03444 -0.01211 93 7 C 1S -0.04608 -0.02845 -0.06223 -0.05188 0.00732 94 2S 0.04180 -0.25229 -0.42322 -0.25434 0.08088 95 2PX -0.05064 0.02962 0.00378 0.05662 0.17971 96 2PY -0.10837 0.05455 0.01561 0.07275 0.30867 97 2PZ 0.26820 -0.01428 0.07170 0.03275 -0.08777 98 3S 2.38911 2.12325 4.79326 3.26251 -0.52521 99 3PX -0.25748 0.44668 0.57356 0.53956 0.72768 100 3PY -0.53275 0.60083 0.73132 0.81609 1.27746 101 3PZ 1.18835 1.10168 2.60915 1.74351 -0.83903 102 4XX -0.17740 -0.05097 -0.15829 -0.09491 0.11120 103 4YY 0.02538 0.08096 0.08064 0.14791 0.19642 104 4ZZ 0.22649 -0.00616 0.12985 -0.06175 -0.30546 105 4XY 0.17752 0.16543 0.26399 0.26852 0.13830 106 4XZ -0.25228 0.11424 0.06587 0.08051 0.25026 107 4YZ -0.46762 0.15190 0.08033 0.13513 0.44555 108 8 C 1S 0.02035 0.02909 0.05958 0.03484 -0.00635 109 2S 0.11627 0.15939 0.36300 0.21513 -0.04121 110 2PX -0.05796 -0.00498 -0.03544 -0.01467 0.03505 111 2PY -0.13388 -0.00067 -0.05357 -0.02643 0.08335 112 2PZ 0.47655 -0.10867 -0.05446 -0.08814 -0.32613 113 3S -1.43358 -2.02216 -4.69906 -2.97699 0.58781 114 3PX -0.54411 -0.58235 -1.36025 -0.86591 0.31611 115 3PY -0.99670 -0.90968 -2.22466 -1.40189 0.64261 116 3PZ 1.16294 -0.65030 -0.74952 -0.73465 -1.46656 117 4XX 0.00276 0.10800 0.18796 0.13187 0.02981 118 4YY -0.26604 0.08416 0.01547 0.10800 0.18879 119 4ZZ 0.25849 -0.18387 -0.22794 -0.26998 -0.21370 120 4XY -0.22679 -0.05543 -0.17456 -0.02505 0.12429 121 4XZ 0.37313 -0.08328 -0.02647 -0.04953 -0.28374 122 4YZ 0.61859 -0.13559 0.00295 -0.04226 -0.46272 123 9 C 1S 0.00534 -0.03107 -0.06630 -0.04884 0.01008 124 2S -0.28015 -0.12666 -0.39455 -0.24650 0.03065 125 2PX 0.00698 -0.00047 0.01287 -0.01515 -0.15301 126 2PY -0.00769 0.00086 0.04307 -0.02537 -0.24121 127 2PZ 0.23850 -0.11498 -0.08938 -0.11858 -0.23272 128 3S 0.51730 2.17781 4.95149 3.19927 -0.68710 129 3PX 0.58210 0.29793 0.95003 0.54832 -0.76121 130 3PY 0.96336 0.55533 1.72133 1.01396 -1.22269 131 3PZ 0.18233 -0.96127 -2.02031 -1.41349 -0.89685 132 4XX 0.13123 -0.09690 -0.19008 -0.13973 -0.11832 133 4YY 0.29728 -0.03586 0.08383 -0.01040 -0.42134 134 4ZZ -0.48590 0.17610 0.15018 0.16138 0.52810 135 4XY 0.16620 0.10283 0.26023 0.15091 -0.31751 136 4XZ -0.14668 0.04522 0.02747 0.05791 0.01081 137 4YZ -0.20252 0.03435 0.01075 0.06087 -0.01678 138 10 C 1S 0.02260 0.01719 0.06676 0.03375 -0.00689 139 2S -0.01256 0.17987 0.40948 0.22539 -0.04462 140 2PX -0.03397 0.03141 0.03800 0.00732 -0.19819 141 2PY -0.06705 0.07533 0.05137 0.02157 -0.33490 142 2PZ 0.22477 -0.04154 0.04800 0.02123 0.13251 143 3S -1.90862 -1.59166 -5.07617 -2.67479 0.50222 144 3PX 0.13112 0.16996 0.45233 0.20762 -0.90381 145 3PY 0.18004 0.26544 0.57396 0.31925 -1.53163 146 3PZ 0.70579 0.88974 2.71862 1.41432 0.20030 147 4XX 0.12686 0.06101 0.20374 0.10554 0.08300 148 4YY 0.11319 -0.01866 0.03325 0.01962 0.23116 149 4ZZ -0.40677 -0.03484 -0.25381 -0.15184 -0.34928 150 4XY -0.00132 -0.05186 -0.21418 -0.09056 0.19503 151 4XZ 0.02633 -0.02938 -0.08042 0.02333 0.30250 152 4YZ 0.06777 -0.09911 -0.03552 0.00081 0.52364 153 11 H 1S 0.15363 0.01081 0.05717 0.01821 0.01649 154 2S -0.22955 -0.20017 -0.64420 -0.28927 0.04963 155 12 H 1S -0.02970 -0.00241 0.00766 0.02974 -0.01062 156 2S 0.15782 0.25520 0.63722 0.41574 -0.07501 157 13 H 1S -0.00432 -0.02389 -0.04422 -0.09167 0.01370 158 2S -0.18039 -0.26138 -0.58778 -0.35986 0.06966 159 14 H 1S 0.01358 -0.00549 -0.00288 0.04634 -0.00727 160 2S 0.21387 0.29084 0.63215 0.44498 -0.10098 161 15 H 1S -0.10733 0.06310 0.09215 0.02548 -0.02421 162 2S -0.11683 -0.26118 -0.69121 -0.32337 0.12476 163 16 C 1S -0.00508 -0.07424 -0.06571 0.08492 -0.00119 164 2S -0.05557 -0.36224 -0.22061 0.22762 -0.01541 165 2PX 0.00291 -0.12608 0.02684 0.12591 0.02495 166 2PY 0.01411 0.05306 0.10452 -0.23722 0.03766 167 2PZ 0.02166 0.02476 0.05823 -0.13922 0.02768 168 3S 0.51687 4.87502 3.05929 -4.94503 0.24220 169 3PX 0.12270 1.09666 0.99133 -0.41305 0.08629 170 3PY 0.09164 -1.16440 -0.54363 -0.68954 0.35990 171 3PZ 0.05743 -0.60490 -0.31071 -0.36925 0.20338 172 4XX 0.13749 0.49231 0.07473 -0.39130 0.14035 173 4YY -0.14215 -0.16401 0.08011 0.14486 -0.12117 174 4ZZ 0.01305 -0.31779 -0.21373 0.28713 -0.00414 175 4XY -0.00769 -0.32053 -0.15597 0.38150 0.01340 176 4XZ -0.05768 -0.19262 -0.09063 0.24486 -0.02132 177 4YZ -0.00971 0.09615 0.26979 -0.18632 -0.04506 178 17 C 1S 0.00010 0.04922 0.04157 -0.04079 -0.00263 179 2S 0.07858 0.46983 0.13108 -0.20566 0.02864 180 2PX 0.01049 0.02454 -0.13032 0.14070 -0.03213 181 2PY 0.03702 0.10550 0.00567 -0.15682 0.06264 182 2PZ 0.02735 0.05837 0.01376 -0.08010 0.03249 183 3S -0.25933 -3.88141 -2.86021 3.24681 -0.08793 184 3PX -0.13857 -2.00521 -1.48629 1.95925 -0.10867 185 3PY 0.00225 -1.25418 -0.15092 -0.37023 0.31841 186 3PZ 0.00239 -0.65183 -0.06613 -0.28362 0.18906 187 4XX -0.04021 -0.11030 -0.28973 0.34498 -0.07961 188 4YY 0.01346 -0.00877 0.06585 -0.11634 0.03901 189 4ZZ 0.02612 0.14665 0.17264 -0.16981 0.00776 190 4XY 0.01584 -0.05668 -0.01334 -0.19100 0.08909 191 4XZ 0.02466 -0.02406 0.01511 -0.12027 0.05489 192 4YZ 0.03642 -0.17208 -0.09172 0.04054 0.03781 193 18 C 1S -0.01214 -0.07294 -0.01991 0.05510 -0.00384 194 2S -0.02116 -0.28407 -0.24019 0.30239 -0.01095 195 2PX 0.06523 0.23414 -0.21127 0.15100 -0.05274 196 2PY 0.03281 0.11080 0.00195 -0.07269 0.01694 197 2PZ 0.01468 0.05352 0.00265 -0.04653 0.01196 198 3S 0.69743 4.70196 1.89480 -3.58320 0.20807 199 3PX 0.22586 1.32452 -0.72474 0.76921 -0.30442 200 3PY 0.23468 2.16584 1.23220 -1.93734 0.11325 201 3PZ 0.12206 1.14829 0.69969 -1.04827 0.05903 202 4XX 0.08709 0.41619 -0.17583 -0.10313 0.00860 203 4YY -0.01275 -0.08516 0.17570 -0.06849 0.01173 204 4ZZ -0.05533 -0.28381 -0.00134 0.15513 -0.01214 205 4XY 0.08155 0.27346 -0.34035 0.35873 -0.09348 206 4XZ 0.02983 0.13370 -0.18275 0.20565 -0.05222 207 4YZ 0.02646 0.16891 0.17554 -0.20784 0.01888 208 19 C 1S 0.00831 0.05728 0.02260 -0.03786 0.00266 209 2S 0.04839 0.31436 0.16160 -0.20089 0.00535 210 2PX 0.05844 0.25496 -0.16170 0.06093 -0.02658 211 2PY 0.05410 0.16485 -0.22480 0.14867 -0.03521 212 2PZ 0.02863 0.08321 -0.11876 0.08045 -0.01852 213 3S -0.53869 -4.28789 -2.12065 3.08059 -0.13689 214 3PX 0.45536 2.63774 0.17261 -0.86082 -0.10333 215 3PY 0.03095 -0.53609 -1.39564 1.59347 -0.23960 216 3PZ 0.00749 -0.35892 -0.76967 0.88030 -0.12322 217 4XX -0.16299 -0.57160 0.36910 -0.20336 0.07345 218 4YY 0.10698 0.27720 -0.35859 0.25660 -0.06219 219 4ZZ 0.05868 0.27796 -0.04208 -0.03102 -0.01025 220 4XY -0.04589 -0.22887 0.10176 0.10216 -0.00319 221 4XZ -0.02682 -0.09322 0.04800 0.06051 -0.00567 222 4YZ 0.03772 0.01681 -0.29015 0.25713 -0.04693 223 20 C 1S -0.00775 -0.05604 -0.03363 0.05281 -0.00304 224 2S -0.07817 -0.44865 -0.14015 0.27411 -0.01977 225 2PX -0.00575 -0.04904 -0.00408 -0.00818 0.02688 226 2PY 0.05282 0.11728 -0.19229 0.16884 -0.05123 227 2PZ 0.02728 0.06666 -0.10650 0.09295 -0.02830 228 3S 0.51987 4.29858 2.29956 -3.29690 0.11610 229 3PX -0.43885 -2.82743 -0.86115 1.62007 0.00763 230 3PY 0.12706 0.14568 -1.24350 1.17729 -0.25211 231 3PZ 0.07452 0.14748 -0.65297 0.60661 -0.14310 232 4XX 0.10356 0.43549 -0.17283 0.08302 -0.05710 233 4YY -0.06034 -0.20694 0.25077 -0.20144 0.04768 234 4ZZ -0.05346 -0.23671 -0.04495 0.10785 0.00310 235 4XY -0.10171 -0.28609 0.28311 -0.09894 0.05802 236 4XZ -0.04757 -0.18075 0.15451 -0.05212 0.03664 237 4YZ -0.01809 0.05224 0.24828 -0.27114 0.03575 238 21 C 1S 0.01038 0.05220 0.03281 -0.03712 0.00201 239 2S 0.01664 0.28480 0.29105 -0.26539 0.00564 240 2PX -0.01466 -0.07554 0.08084 -0.04625 0.05571 241 2PY 0.04707 0.15311 -0.06389 0.00051 -0.00470 242 2PZ 0.02729 0.08462 -0.03541 -0.00278 -0.00400 243 3S -0.74493 -4.60208 -1.97993 2.96859 -0.09884 244 3PX -0.06254 -0.43311 1.03197 -0.92146 0.30021 245 3PY 0.26870 2.25210 0.96554 -1.19924 -0.02481 246 3PZ 0.15516 1.23679 0.49897 -0.63400 -0.01598 247 4XX -0.02570 -0.01919 -0.11609 0.13832 -0.03662 248 4YY -0.02519 -0.25859 0.05791 -0.01366 0.02604 249 4ZZ 0.01542 0.11118 0.12561 -0.10955 0.00930 250 4XY 0.00193 0.00824 -0.18112 0.17022 -0.09525 251 4XZ 0.01088 0.00263 -0.08780 0.08542 -0.05071 252 4YZ -0.06844 -0.32163 -0.05732 0.09018 0.00979 253 22 H 1S 0.02556 0.09477 -0.00507 -0.01067 0.00364 254 2S -0.05773 -0.55979 -0.28820 0.26893 0.00427 255 23 H 1S 0.00447 -0.00182 0.00449 -0.05377 0.00623 256 2S 0.08415 0.59779 0.30341 -0.46294 0.02250 257 24 H 1S -0.01081 -0.06803 0.00726 0.09995 -0.01085 258 2S -0.06912 -0.50344 -0.25089 0.35763 -0.01702 259 25 H 1S -0.01002 0.03552 -0.01747 -0.03322 0.00345 260 2S 0.06598 0.60518 0.31417 -0.48024 0.01322 261 26 H 1S 0.00117 0.02406 0.10125 -0.02206 -0.00397 262 2S 0.03131 -0.58880 -0.37914 0.29759 0.06685 263 27 H 1S 0.00803 0.11518 -0.07728 0.06171 -0.00858 264 2S -0.02297 -0.11132 0.01782 0.09860 -0.00341 246 247 248 249 250 V V V V V Eigenvalues -- 3.10908 3.35184 3.39048 4.02134 4.04768 1 1 C 1S 0.08067 -0.00991 -0.01334 -0.15878 0.14228 2 2S -0.09248 0.23918 0.05472 1.08914 -0.85967 3 2PX -0.05022 0.15235 0.02283 0.06904 -0.03801 4 2PY 0.07639 -0.13822 -0.02116 -0.06818 0.03602 5 2PZ 0.04151 -0.08559 -0.01226 -0.02360 0.00429 6 3S -1.64188 0.73678 0.41079 -0.18866 -0.37412 7 3PX 0.43989 0.29175 0.16156 -0.11385 -0.06723 8 3PY 0.61674 -0.27713 -0.18188 0.23118 -0.02565 9 3PZ 0.41046 -0.16596 -0.12213 0.10367 0.02113 10 4XX -0.56527 -0.04186 0.00947 -0.60465 0.51821 11 4YY 0.46940 0.00944 -0.03693 -0.59652 0.52386 12 4ZZ 0.41262 -0.02728 -0.05839 -0.60852 0.53621 13 4XY 0.26975 -0.20010 -0.08487 -0.04937 0.01634 14 4XZ 0.14741 -0.11703 -0.04601 -0.03488 0.01448 15 4YZ 0.06910 0.04923 0.01691 0.00827 -0.00917 16 2 C 1S -0.06416 -0.00646 0.03799 -0.08815 0.07383 17 2S 0.13014 0.05428 -0.23212 0.35746 -0.32215 18 2PX 0.21631 0.00992 0.07058 0.04819 -0.02983 19 2PY 0.00514 -0.01292 0.10991 -0.01802 0.01241 20 2PZ 0.01333 -0.00581 0.04439 0.00338 -0.00412 21 3S 1.38911 0.08721 -0.93603 0.63135 -0.41294 22 3PX 0.31242 0.12548 0.19729 -0.01270 -0.02142 23 3PY -0.32238 0.00328 0.38043 0.00504 -0.10592 24 3PZ -0.20681 0.01858 0.24237 -0.12384 0.06486 25 4XX 0.26353 0.01626 0.06787 -0.20205 0.18113 26 4YY -0.23377 -0.03747 0.01787 -0.29560 0.25675 27 4ZZ -0.31662 -0.03427 0.19005 -0.30709 0.26203 28 4XY 0.19641 -0.05753 -0.13221 0.00798 -0.01110 29 4XZ 0.09755 -0.02648 -0.08868 0.00883 -0.01182 30 4YZ -0.00086 0.00411 -0.09668 -0.01726 0.01788 31 3 H 1S 0.06515 0.00029 -0.05631 0.02047 -0.02000 32 2S -0.02207 0.02596 0.00130 -0.08604 0.07820 33 4 Br 1S 0.00058 0.00001 -0.00011 0.00071 -0.00052 34 2S -0.00266 0.00017 -0.00182 -0.00875 0.00609 35 3S 0.00150 -0.00049 0.00688 0.01824 -0.01230 36 4S 0.00950 -0.00043 -0.00242 0.01438 -0.01093 37 5S -0.10875 -0.04276 0.00753 0.12907 -0.12854 38 6S 0.15318 0.09658 0.02584 -0.37537 0.36164 39 7PX 0.00039 -0.00032 0.00007 0.00035 -0.00016 40 7PY 0.00089 0.00005 0.00058 -0.00004 0.00026 41 7PZ -0.00017 0.00007 -0.00035 -0.00080 0.00069 42 8PX -0.00116 0.00111 -0.00024 -0.00118 0.00060 43 8PY -0.00345 -0.00024 -0.00175 0.00000 -0.00078 44 8PZ 0.00086 -0.00018 0.00101 0.00276 -0.00237 45 9PX -0.00230 -0.00649 0.00194 0.00942 -0.00799 46 9PY 0.03632 0.00478 -0.00024 -0.00140 0.00636 47 9PZ -0.01798 -0.00300 0.00352 -0.01066 0.00847 48 10PX 0.01015 0.00955 -0.00245 -0.05116 0.04913 49 10PY -0.04182 -0.02524 -0.01918 0.11757 -0.11239 50 10PZ 0.03473 0.02174 -0.01778 -0.06636 0.06454 51 11XX -0.00030 0.00068 -0.00465 -0.00927 0.00597 52 11YY -0.00085 0.00008 -0.00464 -0.00801 0.00513 53 11ZZ 0.00177 0.00038 -0.00291 -0.01025 0.00738 54 11XY 0.00259 0.00030 -0.00059 -0.00258 0.00299 55 11XZ 0.00048 -0.00101 -0.00055 0.00109 -0.00120 56 11YZ 0.00607 0.00142 -0.00298 -0.00206 0.00218 57 12XX -0.01290 -0.01915 -0.00610 0.07182 -0.06593 58 12YY -0.03390 -0.01349 0.00310 0.03924 -0.04131 59 12ZZ -0.03301 -0.01565 -0.01962 0.06686 -0.06402 60 12XY -0.01228 0.00077 0.00097 0.02432 -0.02628 61 12XZ -0.00475 0.00543 0.00236 -0.01415 0.01389 62 12YZ -0.02634 -0.01129 0.01459 0.03705 -0.03457 63 5 C 1S 0.02155 -0.01733 0.05506 -0.04417 0.03854 64 2S -0.18307 0.04842 0.08896 0.30133 -0.24983 65 2PX -0.01597 0.00109 0.06524 0.02831 -0.01488 66 2PY -0.01814 -0.00384 0.09590 0.03166 -0.01727 67 2PZ 0.04186 0.00020 0.03229 0.01281 -0.00961 68 3S -0.45456 0.67243 -3.48004 -0.06350 -0.01239 69 3PX -0.21477 -0.18467 1.35836 -0.10990 0.01882 70 3PY -0.41664 -0.20430 2.16230 -0.17167 0.04610 71 3PZ 0.32856 -0.10868 0.51254 0.07141 -0.08538 72 4XX 0.18141 -0.09260 0.28298 -0.16148 0.13902 73 4YY -0.00899 -0.03873 0.36630 -0.15806 0.13190 74 4ZZ 0.00928 0.05725 -0.63677 -0.20608 0.16492 75 4XY 0.00167 0.01348 0.10072 0.01198 -0.01777 76 4XZ -0.06598 -0.00793 0.15121 0.00482 -0.00578 77 4YZ -0.14848 -0.01881 0.31337 0.00555 -0.00494 78 6 C 1S -0.00307 0.00952 -0.06998 0.00293 0.00925 79 2S -0.10844 0.05369 -0.07671 -0.06385 -0.03994 80 2PX 0.00111 0.01517 -0.04045 0.01511 -0.00458 81 2PY 0.01127 0.01433 -0.06655 0.01857 -0.00320 82 2PZ 0.03023 -0.01149 0.06357 0.02566 -0.01525 83 3S 0.50315 -0.65025 3.84872 0.14314 -0.12757 84 3PX 0.10234 0.06685 -0.74768 -0.00818 0.01093 85 3PY 0.05501 0.15217 -1.41636 -0.02895 0.01949 86 3PZ 0.25523 -0.25179 1.56602 0.04294 -0.05990 87 4XX -0.01909 0.01753 -0.15414 0.02427 0.02886 88 4YY -0.01839 -0.00211 -0.00341 0.02069 0.02581 89 4ZZ 0.12235 -0.03440 0.07336 0.04335 0.01181 90 4XY -0.02459 -0.03381 0.23127 0.00016 -0.00400 91 4XZ 0.04680 -0.04390 0.35351 0.01891 -0.01323 92 4YZ 0.01622 -0.06749 0.54935 0.02085 -0.01702 93 7 C 1S 0.01085 -0.01046 0.07320 0.02944 0.00305 94 2S 0.03656 -0.03045 0.02233 -0.16157 -0.04944 95 2PX 0.02012 -0.00170 -0.02251 -0.00509 0.00172 96 2PY 0.04304 0.00037 -0.02818 0.00327 0.00009 97 2PZ -0.01400 0.01324 -0.10114 0.00252 -0.00525 98 3S -0.42710 0.59052 -3.91106 -0.18839 0.08547 99 3PX 0.01706 0.06697 -0.39071 -0.01110 0.00959 100 3PY 0.07792 0.05992 -0.47211 -0.03690 0.01795 101 3PZ -0.32870 0.32830 -2.05247 -0.08591 0.07599 102 4XX 0.02647 -0.00764 0.08647 0.10860 0.01582 103 4YY -0.00187 0.05140 -0.35361 0.09954 0.02170 104 4ZZ -0.00807 -0.04593 0.39900 0.10320 0.01895 105 4XY -0.04300 0.06517 -0.43915 -0.00976 0.00689 106 4XZ 0.03243 -0.02297 0.18789 0.00306 -0.00020 107 4YZ 0.07322 -0.04461 0.30166 0.00228 -0.00028 108 8 C 1S -0.00707 0.01158 -0.07302 0.01870 0.00762 109 2S -0.00548 0.00377 -0.06673 -0.12175 -0.05018 110 2PX 0.01141 -0.01003 0.04740 -0.00091 -0.00293 111 2PY 0.02553 -0.01431 0.08337 0.00025 -0.00468 112 2PZ -0.03195 -0.00346 0.02745 0.00539 -0.00095 113 3S 0.40793 -0.61361 3.91737 0.04086 -0.08349 114 3PX 0.14022 -0.17462 1.10699 0.01896 -0.01592 115 3PY 0.23397 -0.28234 1.80122 0.04032 -0.03208 116 3PZ -0.11178 -0.07907 0.54914 0.00362 -0.00168 117 4XX -0.02770 0.05156 -0.34181 0.07114 0.02936 118 4YY -0.01806 0.05327 -0.36890 0.06859 0.02956 119 4ZZ 0.04280 -0.08159 0.60767 0.07144 0.02163 120 4XY 0.00719 0.00604 -0.05782 -0.00609 0.00180 121 4XZ -0.04250 0.01851 -0.12282 0.00228 0.00088 122 4YZ -0.07444 0.04087 -0.28411 0.00291 0.00191 123 9 C 1S 0.00899 -0.01111 0.07166 0.01114 0.00852 124 2S 0.01482 -0.01804 0.04170 -0.05148 -0.07189 125 2PX -0.01627 0.00453 -0.03316 0.00239 -0.00292 126 2PY -0.01611 0.01142 -0.06351 0.00867 -0.00701 127 2PZ -0.00668 -0.00932 0.07538 0.00694 -0.00007 128 3S -0.36011 0.62194 -3.89447 -0.09676 0.04133 129 3PX -0.13748 0.12484 -0.70762 -0.01779 0.01277 130 3PY -0.23736 0.21598 -1.28537 -0.04161 0.02971 131 3PZ 0.00856 -0.25402 1.60285 0.02083 -0.01980 132 4XX 0.00381 -0.02452 0.17782 0.04157 0.03304 133 4YY -0.03456 0.00217 0.00962 0.03953 0.03307 134 4ZZ 0.03978 0.01110 -0.07475 0.02648 0.03860 135 4XY -0.06699 0.03803 -0.21604 -0.00327 0.00004 136 4XZ -0.02956 0.04731 -0.35232 -0.00454 0.00104 137 4YZ -0.05037 0.07773 -0.55998 -0.00490 0.00071 138 10 C 1S 0.00471 0.00931 -0.07504 -0.00835 0.01813 139 2S -0.05014 0.03870 -0.05698 0.05473 -0.12561 140 2PX -0.03991 0.00952 -0.01640 0.00976 -0.00495 141 2PY -0.07254 0.00986 -0.02498 0.01674 -0.00692 142 2PZ 0.03306 0.00788 -0.09985 -0.00729 0.00777 143 3S -0.00957 -0.59456 3.97612 -0.04653 0.00058 144 3PX -0.15304 0.06215 -0.33050 -0.02577 0.02307 145 3PY -0.24772 0.08358 -0.44666 -0.04741 0.03163 146 3PZ 0.09104 0.33632 -2.18482 0.02464 -0.00413 147 4XX 0.02343 0.00949 -0.08435 -0.02662 0.06625 148 4YY 0.07676 -0.05478 0.34280 -0.01757 0.05856 149 4ZZ -0.04968 0.03639 -0.37816 -0.03490 0.07286 150 4XY 0.02870 -0.06646 0.44604 0.00893 -0.00667 151 4XZ 0.01012 0.02234 -0.18929 -0.01201 0.00702 152 4YZ 0.06615 0.03820 -0.30476 -0.01564 0.01079 153 11 H 1S 0.01065 -0.03101 0.25770 0.01101 -0.01378 154 2S -0.02497 -0.07113 0.39437 -0.00222 0.00291 155 12 H 1S -0.01851 0.03648 -0.26057 -0.00524 -0.00336 156 2S -0.04316 0.06499 -0.35585 -0.00788 0.01820 157 13 H 1S 0.03039 -0.03706 0.25663 -0.00442 -0.00591 158 2S 0.03733 -0.05762 0.36699 0.01872 0.00107 159 14 H 1S -0.02161 0.03489 -0.25777 -0.01503 0.00114 160 2S -0.07037 0.05989 -0.34288 -0.00769 0.02792 161 15 H 1S -0.01070 -0.01496 0.26698 0.00376 -0.00716 162 2S -0.01640 -0.04440 0.38771 0.01768 -0.02183 163 16 C 1S -0.05963 -0.05333 0.00492 -0.26698 0.16563 164 2S -0.03700 -0.17383 -0.03566 1.74593 -1.01815 165 2PX -0.23330 0.12495 0.04067 0.00968 0.07534 166 2PY -0.08701 -0.08990 -0.02127 -0.01694 -0.04297 167 2PZ -0.03158 -0.05237 -0.01336 -0.01241 -0.02305 168 3S 2.39535 3.14929 -0.08377 0.49850 -0.26554 169 3PX -1.15253 2.03344 0.31142 -0.35150 -0.07386 170 3PY -1.30411 -1.31212 -0.23773 0.37222 0.00247 171 3PZ -0.70875 -0.76101 -0.14214 0.23953 -0.01820 172 4XX -0.70195 0.01704 0.01847 -0.98120 0.62211 173 4YY 0.58077 0.09546 0.01261 -0.99609 0.63537 174 4ZZ -0.00958 -0.12929 0.01597 -1.02298 0.64309 175 4XY -0.28777 0.62134 0.10548 0.02798 0.03055 176 4XZ -0.15608 0.34090 0.06191 0.00923 0.02196 177 4YZ 0.57041 0.16514 -0.00951 0.02949 -0.01391 178 17 C 1S 0.03516 0.06756 0.00792 -0.20478 0.04448 179 2S 0.02948 0.07640 -0.01513 1.28953 -0.16228 180 2PX 0.07765 -0.10737 -0.01041 0.02117 0.09352 181 2PY -0.30258 0.01076 0.00554 0.06501 -0.10374 182 2PZ -0.16907 0.00939 0.00125 0.03458 -0.05904 183 3S -1.64241 -3.77856 -0.36268 0.97960 -0.51720 184 3PX -0.33151 -2.11859 -0.27529 0.33976 -0.28820 185 3PY -1.61160 -0.57638 -0.01752 -0.00063 0.06490 186 3PZ -0.83433 -0.25477 0.00793 -0.01717 0.04986 187 4XX 0.29414 0.30949 0.04475 -0.77995 0.20511 188 4YY -0.29238 -0.31364 -0.02872 -0.69360 0.10593 189 4ZZ 0.03800 0.09122 0.01273 -0.75889 0.15095 190 4XY -0.43581 0.39271 0.07057 0.00985 -0.06387 191 4XZ -0.23394 0.20939 0.03247 0.00416 -0.03491 192 4YZ -0.25302 -0.37652 -0.03905 0.05464 -0.03476 193 18 C 1S -0.01699 -0.07165 -0.00737 -0.12246 -0.19112 194 2S -0.17424 -0.04957 0.00756 0.93463 1.16661 195 2PX 0.24307 0.00109 -0.00846 -0.02900 0.13473 196 2PY -0.07353 0.09777 0.01391 0.04897 -0.00716 197 2PZ -0.04483 0.05282 0.00912 0.02748 -0.00744 198 3S 1.06062 3.97176 0.40406 -0.28563 0.79643 199 3PX 1.26299 0.26787 -0.02616 0.05493 -0.11953 200 3PY 0.61861 1.91159 0.18393 -0.27967 0.17555 201 3PZ 0.29062 1.02725 0.09476 -0.15071 0.09597 202 4XX 0.08949 0.65244 0.07595 -0.45485 -0.63119 203 4YY -0.05450 -0.42219 -0.05225 -0.49264 -0.74018 204 4ZZ -0.06769 -0.32955 -0.03676 -0.48308 -0.73982 205 4XY 0.32908 -0.15566 -0.02780 -0.02798 0.08381 206 4XZ 0.17447 -0.11173 -0.01873 -0.01649 0.04285 207 4YZ -0.00878 -0.07019 -0.01161 -0.00725 -0.00407 208 19 C 1S 0.01180 0.07823 0.00826 -0.09993 -0.31307 209 2S 0.05661 0.04908 -0.00348 0.68642 2.00003 210 2PX 0.13760 0.07195 0.00562 -0.04258 0.01434 211 2PY 0.11253 -0.05484 -0.00444 0.02284 0.00026 212 2PZ 0.05717 -0.03301 -0.00291 0.01406 -0.00089 213 3S -1.13829 -3.91379 -0.32831 0.42778 0.64365 214 3PX 1.12028 1.63937 0.12812 -0.08398 0.05448 215 3PY 0.37077 -1.22336 -0.12490 0.06893 -0.05312 216 3PZ 0.17931 -0.70329 -0.06822 0.03787 -0.02801 217 4XX -0.29606 0.01822 0.01053 -0.36172 -1.19301 218 4YY 0.19921 -0.08696 -0.01106 -0.35862 -1.18915 219 4ZZ 0.08834 0.21488 0.02307 -0.37491 -1.21084 220 4XY -0.10874 -0.57415 -0.06407 0.03944 0.01261 221 4XZ -0.05200 -0.30286 -0.03456 0.02111 0.00573 222 4YZ 0.10166 -0.24556 -0.02806 0.01268 0.01910 223 20 C 1S -0.01698 -0.06955 -0.00630 -0.11564 -0.20861 224 2S -0.01551 -0.07127 0.00775 0.86479 1.29608 225 2PX -0.15098 -0.10199 -0.00812 -0.06628 0.03543 226 2PY 0.18356 -0.02794 -0.00806 0.01859 -0.11156 227 2PZ 0.10259 -0.01285 -0.00370 0.01227 -0.06209 228 3S 1.10912 3.94387 0.33201 -0.19575 0.77376 229 3PX -0.92607 -2.09638 -0.14659 0.25401 -0.17607 230 3PY 0.68475 -0.72611 -0.06470 0.03074 0.04404 231 3PZ 0.39604 -0.34762 -0.03455 0.01195 0.02728 232 4XX 0.21488 -0.34278 -0.04957 -0.44406 -0.84114 233 4YY -0.10334 0.35364 0.04064 -0.43570 -0.70716 234 4ZZ -0.08161 -0.09021 -0.00636 -0.44598 -0.77801 235 4XY -0.32464 -0.35768 -0.03575 -0.03976 0.05424 236 4XZ -0.18402 -0.19532 -0.01868 -0.02213 0.03072 237 4YZ -0.00850 0.41459 0.04368 0.01181 0.06087 238 21 C 1S 0.00822 0.07534 0.00728 -0.18905 0.01557 239 2S 0.10007 0.06267 -0.01546 1.24489 -0.01712 240 2PX -0.35558 -0.01392 0.00713 -0.05717 0.13455 241 2PY 0.02323 0.08773 0.01221 -0.02584 -0.05854 242 2PZ 0.02151 0.04897 0.00560 -0.01296 -0.03465 243 3S -0.78095 -3.92828 -0.28363 0.63873 -0.25873 244 3PX -1.12329 0.40111 0.01868 0.09513 -0.14324 245 3PY 0.53682 1.92451 0.15520 -0.24945 0.21038 246 3PZ 0.31925 1.04671 0.08836 -0.14571 0.12256 247 4XX 0.09061 -0.62587 -0.06936 -0.64738 0.02922 248 4YY -0.06203 0.42012 0.05347 -0.73160 0.07152 249 4ZZ -0.00218 0.33510 0.03743 -0.72723 0.06166 250 4XY 0.50259 0.15430 0.00885 0.04449 -0.09336 251 4XZ 0.27738 0.10695 0.00752 0.02388 -0.05159 252 4YZ -0.08299 0.06667 0.01422 -0.00125 0.01038 253 22 H 1S -0.02383 -0.25940 -0.03186 0.10697 -0.01901 254 2S -0.07520 -0.39090 -0.02808 -0.04448 -0.06996 255 23 H 1S 0.03384 0.26545 0.02690 0.05528 0.09263 256 2S 0.13348 0.38774 0.01812 -0.15680 -0.12271 257 24 H 1S -0.02838 -0.25474 -0.02897 0.05804 0.12619 258 2S -0.11041 -0.35135 -0.02855 -0.06822 -0.25275 259 25 H 1S 0.02535 0.25923 0.02877 0.05747 0.08531 260 2S 0.22437 0.36099 0.02821 -0.17180 -0.10458 261 26 H 1S 0.04929 -0.27955 -0.04478 0.11986 -0.03456 262 2S -0.36361 -0.35808 -0.07825 -0.11139 -0.00842 263 27 H 1S -0.18478 0.05297 0.02279 0.06426 -0.04276 264 2S -0.08802 0.00827 -0.00994 -0.14941 0.12164 251 252 253 254 255 V V V V V Eigenvalues -- 4.07181 4.08642 4.11018 4.13591 4.21211 1 1 C 1S 0.00875 -0.05286 -0.09129 -0.26792 0.15619 2 2S -0.06217 0.31034 0.46242 1.58607 -0.85319 3 2PX 0.02021 -0.02725 0.00151 -0.07841 -0.05921 4 2PY -0.00179 0.00060 0.00652 0.04203 -0.02010 5 2PZ -0.00146 0.01026 0.01037 0.06158 -0.02493 6 3S 0.07024 0.28867 0.78137 0.68659 -0.65996 7 3PX -0.11704 0.21041 0.04208 0.25550 0.41707 8 3PY -0.14285 0.02366 -0.21365 0.14030 0.10424 9 3PZ -0.08651 0.00450 -0.14448 0.03680 0.08845 10 4XX 0.05219 -0.20994 -0.30741 -1.06441 0.63942 11 4YY 0.04102 -0.21088 -0.33112 -1.06745 0.56717 12 4ZZ 0.03639 -0.20047 -0.34372 -1.03690 0.59643 13 4XY -0.01779 0.03080 0.00872 0.11472 -0.00963 14 4XZ -0.00971 0.01289 0.00677 0.05143 -0.00094 15 4YZ 0.00604 -0.00834 0.00590 -0.04146 -0.01276 16 2 C 1S 0.00746 -0.04838 -0.05396 -0.22122 -0.04000 17 2S 0.02422 0.25697 0.31095 0.92399 0.29547 18 2PX -0.01358 0.00763 0.02403 0.03641 -0.05126 19 2PY 0.00121 -0.00581 0.01029 -0.01474 -0.01380 20 2PZ -0.00408 0.00413 0.00430 0.02447 -0.02449 21 3S -0.31940 0.13690 0.13558 1.39794 0.01707 22 3PX 0.00281 0.13246 -0.08609 0.11454 0.27467 23 3PY 0.09214 0.12034 0.16267 0.12479 0.12293 24 3PZ 0.05362 -0.04368 0.05095 -0.29269 0.13200 25 4XX 0.00323 -0.14331 -0.19214 -0.60264 -0.23495 26 4YY 0.01095 -0.17559 -0.23721 -0.73669 -0.11322 27 4ZZ 0.01402 -0.18407 -0.19658 -0.79406 -0.16218 28 4XY -0.00113 0.00946 -0.01778 0.05571 0.02631 29 4XZ 0.00253 0.01455 -0.00670 0.04753 0.01084 30 4YZ 0.00058 0.00014 -0.03443 -0.02073 0.03358 31 3 H 1S 0.00681 0.02410 0.00356 0.07377 0.00567 32 2S -0.00024 -0.02456 -0.10322 -0.17769 -0.03214 33 4 Br 1S 0.00005 0.00013 0.00017 0.00057 -0.00006 34 2S -0.00024 -0.00089 -0.00115 -0.00380 0.00578 35 3S 0.00008 0.00119 0.00152 0.00494 -0.01684 36 4S 0.00138 0.00242 0.00328 0.01082 -0.00138 37 5S 0.00360 0.03844 0.07640 0.24643 -0.07085 38 6S -0.00567 -0.12779 -0.21422 -0.73189 0.13688 39 7PX -0.00002 0.00002 -0.00011 -0.00081 -0.00018 40 7PY -0.00043 0.00023 -0.00016 0.00069 -0.00084 41 7PZ 0.00031 -0.00027 -0.00033 -0.00170 0.00122 42 8PX 0.00006 -0.00008 0.00031 0.00257 0.00075 43 8PY 0.00145 -0.00087 0.00049 -0.00264 0.00267 44 8PZ -0.00102 0.00097 0.00114 0.00594 -0.00396 45 9PX -0.00060 0.00291 0.00273 0.00118 -0.01364 46 9PY -0.00652 0.00520 -0.00375 0.00787 -0.00210 47 9PZ 0.00409 -0.00572 -0.00269 -0.02650 0.01038 48 10PX 0.00210 -0.02764 -0.02400 -0.09428 0.05275 49 10PY -0.00709 0.04189 0.06524 0.26445 -0.04815 50 10PZ 0.00132 -0.02838 -0.05580 -0.14553 0.00614 51 11XX -0.00008 0.00006 0.00022 -0.00140 0.00778 52 11YY -0.00002 -0.00066 -0.00080 0.00178 0.01013 53 11ZZ 0.00009 -0.00066 -0.00105 -0.00568 0.01042 54 11XY 0.00010 -0.00166 -0.00177 -0.00614 0.00594 55 11XZ -0.00000 0.00099 0.00016 0.00306 -0.00122 56 11YZ 0.00040 0.00002 -0.00199 -0.00333 0.00239 57 12XX 0.00459 0.01690 0.03166 0.11671 -0.00259 58 12YY 0.01086 0.01019 0.02882 0.03697 -0.01234 59 12ZZ 0.00496 0.01553 0.03002 0.11639 -0.02392 60 12XY -0.00102 0.01509 0.01494 0.05925 -0.04015 61 12XZ 0.00016 -0.01032 -0.00400 -0.03446 0.01047 62 12YZ -0.00604 0.01059 0.02725 0.07749 -0.01917 63 5 C 1S -0.01065 -0.04114 0.06720 -0.14224 -0.20269 64 2S 0.10096 0.30132 -0.39700 0.85056 1.11087 65 2PX -0.02475 -0.03322 0.03018 0.01375 -0.08368 66 2PY -0.03239 -0.05254 0.05435 0.04270 -0.03657 67 2PZ 0.01142 0.07617 -0.12522 0.01046 -0.02679 68 3S -0.01588 -0.04733 -0.13010 0.07434 0.28198 69 3PX 0.12242 0.13039 0.03584 -0.10700 0.42797 70 3PY 0.17951 0.18761 0.00774 -0.25054 0.46287 71 3PZ 0.05615 0.17033 0.08567 0.35378 0.17533 72 4XX -0.04206 -0.14215 0.26881 -0.53254 -0.75979 73 4YY -0.03463 -0.12350 0.23840 -0.49497 -0.73814 74 4ZZ -0.02300 -0.16780 0.25685 -0.55085 -0.63899 75 4XY 0.00658 0.01949 -0.00729 0.05188 0.01058 76 4XZ -0.00875 -0.03914 0.07404 0.01095 0.00335 77 4YZ -0.01805 -0.06183 0.10685 0.00963 -0.00271 78 6 C 1S -0.02536 0.04646 -0.13841 -0.06814 -0.25981 79 2S 0.19520 -0.27177 0.82794 0.36986 1.42312 80 2PX -0.02995 -0.02027 -0.06324 0.02325 -0.03432 81 2PY -0.04004 -0.02744 -0.08337 0.04079 0.02595 82 2PZ -0.00426 0.04323 -0.09087 0.04537 0.00649 83 3S 0.07483 0.05628 0.36292 0.57418 1.33458 84 3PX 0.01197 0.00117 0.04672 -0.04300 -0.09923 85 3PY 0.00411 -0.04395 0.02460 -0.07861 -0.37900 86 3PZ 0.04849 0.07426 0.08503 0.20253 0.21837 87 4XX -0.09282 0.19892 -0.49414 -0.26329 -0.96561 88 4YY -0.07240 0.20572 -0.42995 -0.25535 -0.93408 89 4ZZ -0.10137 0.20250 -0.58781 -0.17903 -0.89765 90 4XY 0.01890 0.00735 0.07214 -0.00298 0.02417 91 4XZ 0.00661 0.02241 0.01833 0.02442 0.01951 92 4YZ 0.01309 0.03149 0.03048 0.03731 0.03359 93 7 C 1S -0.09872 -0.04487 -0.29237 0.02717 -0.17046 94 2S 0.67046 0.37141 1.80717 -0.07862 1.13059 95 2PX -0.01611 -0.05181 -0.02498 0.03397 0.04600 96 2PY -0.03423 -0.08054 -0.02859 0.05601 0.10733 97 2PZ 0.02823 0.06850 -0.01408 -0.01439 -0.05437 98 3S 0.16997 -0.14713 0.80495 -0.31141 0.13222 99 3PX 0.00013 0.00410 0.02202 -0.06365 -0.14475 100 3PY 0.02301 0.00612 0.01740 -0.08091 -0.21941 101 3PZ -0.05915 -0.17366 0.06343 -0.21660 -0.12721 102 4XX -0.38405 -0.18263 -1.12808 0.09386 -0.66259 103 4YY -0.37825 -0.18323 -1.10603 0.07528 -0.64902 104 4ZZ -0.36998 -0.15293 -1.09414 0.04795 -0.74443 105 4XY -0.00035 -0.01203 0.01626 -0.02144 -0.00381 106 4XZ -0.01914 -0.03995 -0.00979 0.02428 0.04306 107 4YZ -0.03008 -0.07138 -0.02083 0.04897 0.08462 108 8 C 1S -0.13928 -0.21669 -0.20182 0.11653 0.10803 109 2S 0.90455 1.40815 1.26335 -0.72151 -0.60799 110 2PX 0.00856 0.00243 0.00378 0.01875 0.04701 111 2PY 0.01220 0.00024 0.01944 0.03076 0.09334 112 2PZ 0.01282 0.09362 -0.14798 -0.01849 -0.07196 113 3S 0.36574 0.60604 0.60760 -0.19782 -0.33112 114 3PX 0.01313 0.02961 0.01018 0.03420 0.01180 115 3PY 0.01799 0.05692 0.01512 0.06444 0.00584 116 3PZ -0.00528 -0.05457 0.12228 -0.00953 0.10283 117 4XX -0.53825 -0.84428 -0.77303 0.45401 0.42129 118 4YY -0.53575 -0.85617 -0.73926 0.45499 0.44354 119 4ZZ -0.49353 -0.75164 -0.80745 0.45696 0.46826 120 4XY 0.00358 -0.01197 0.02299 -0.00083 0.00963 121 4XZ -0.00089 0.02761 -0.05486 -0.01135 -0.04368 122 4YZ -0.00454 0.03807 -0.09212 -0.01711 -0.07916 123 9 C 1S -0.12623 -0.28736 0.09349 0.06768 0.07255 124 2S 0.83124 1.86000 -0.54779 -0.37727 -0.31571 125 2PX -0.00305 0.00169 -0.05999 0.03662 0.05941 126 2PY -0.00536 0.00724 -0.08651 0.06111 0.10575 127 2PZ -0.03008 -0.01385 -0.14245 0.04464 0.03622 128 3S 0.24111 0.60340 -0.31272 -0.37430 -0.81127 129 3PX -0.00531 -0.01334 0.03861 -0.07123 -0.15943 130 3PY -0.00579 -0.02718 0.04438 -0.13564 -0.29123 131 3PZ 0.03464 0.01217 0.14013 -0.00379 0.13150 132 4XX -0.48828 -1.10611 0.33258 0.27051 0.29338 133 4YY -0.48584 -1.08798 0.27172 0.28638 0.32942 134 4ZZ -0.45298 -1.07512 0.46979 0.19641 0.19161 135 4XY 0.00365 0.01956 -0.06288 0.01639 0.03572 136 4XZ 0.01222 0.01792 0.00744 -0.00621 0.01044 137 4YZ 0.01676 0.02712 0.00411 -0.00453 0.02235 138 10 C 1S -0.07182 -0.19968 0.24339 -0.06778 -0.18184 139 2S 0.49142 1.31105 -1.46706 0.46761 1.11898 140 2PX -0.02606 -0.05284 -0.00442 0.04175 0.04725 141 2PY -0.04220 -0.08377 -0.00237 0.06480 0.10013 142 2PZ -0.00763 0.00258 -0.05614 -0.00973 -0.01093 143 3S 0.19988 0.46454 -0.80114 0.01872 1.06871 144 3PX 0.00738 -0.01359 0.02803 -0.14407 -0.18248 145 3PY 0.01667 -0.02257 0.04576 -0.20062 -0.24778 146 3PZ -0.03678 -0.06216 0.10630 0.04382 -0.32153 147 4XX -0.26943 -0.75141 0.94724 -0.27286 -0.71677 148 4YY -0.25382 -0.71030 0.94983 -0.27763 -0.73507 149 4ZZ -0.29227 -0.80099 0.91517 -0.26187 -0.66634 150 4XY 0.01591 0.04207 0.00266 -0.02084 -0.04818 151 4XZ 0.01128 0.02041 -0.01185 -0.02501 -0.02748 152 4YZ 0.01716 0.03687 -0.01748 -0.04587 -0.06549 153 11 H 1S 0.03442 0.09722 -0.09274 0.04709 0.09622 154 2S -0.04718 -0.12531 0.15180 -0.02049 -0.04774 155 12 H 1S 0.05514 0.12547 -0.03795 -0.02566 -0.02105 156 2S -0.10400 -0.22606 0.04698 0.01766 -0.03512 157 13 H 1S 0.06188 0.09909 0.08524 -0.04015 -0.02252 158 2S -0.10297 -0.16165 -0.14562 0.09744 0.07694 159 14 H 1S 0.04291 0.02253 0.12064 -0.02009 0.07194 160 2S -0.09284 -0.08791 -0.19812 -0.05984 -0.19508 161 15 H 1S 0.01198 -0.00754 0.06069 0.02874 0.11248 162 2S -0.00803 0.04476 -0.08851 0.04175 -0.10337 163 16 C 1S -0.02067 0.01029 -0.01783 0.04419 0.04213 164 2S 0.11657 -0.09699 0.11832 -0.28252 -0.39635 165 2PX 0.09412 -0.07856 -0.06472 -0.15503 0.08809 166 2PY 0.08435 -0.01476 0.01588 0.12750 -0.04368 167 2PZ 0.04353 -0.00582 0.01068 0.07305 -0.01936 168 3S 0.11774 0.28151 0.15877 0.22158 0.47139 169 3PX 0.21141 0.19204 0.58457 0.11823 -0.27528 170 3PY 0.00657 -0.29562 -0.21741 -0.05633 -0.70961 171 3PZ 0.00234 -0.15722 -0.14202 -0.00285 -0.42125 172 4XX 0.04635 0.00500 -0.07832 0.23899 0.22645 173 4YY -0.17196 0.09819 -0.06249 0.15241 0.22980 174 4ZZ -0.10651 0.06128 -0.05928 0.18053 0.18196 175 4XY 0.04549 -0.05117 -0.03722 -0.17639 0.08218 176 4XZ 0.02300 -0.03007 -0.02041 -0.10976 0.04691 177 4YZ -0.05896 0.03426 0.00731 -0.00343 0.03323 178 17 C 1S 0.20311 -0.05827 0.00256 0.18808 -0.04497 179 2S -1.27203 0.41688 0.01477 -1.19049 0.29901 180 2PX 0.00036 0.03790 0.03762 0.01417 0.06109 181 2PY 0.08186 -0.03550 0.01183 0.01948 -0.03024 182 2PZ 0.04577 -0.01560 -0.00666 0.01137 -0.02295 183 3S -0.52817 -0.20226 -0.28103 -0.35463 -0.21634 184 3PX -0.15535 -0.28116 -0.47394 0.19479 -0.41561 185 3PY -0.03425 -0.20428 -0.10852 -0.21801 -0.80371 186 3PZ -0.01886 -0.11636 -0.00942 -0.13373 -0.39434 187 4XX 0.74096 -0.21574 0.00379 0.76212 -0.11335 188 4YY 0.81046 -0.24609 0.01859 0.75530 -0.23512 189 4ZZ 0.79650 -0.23412 0.01071 0.73999 -0.18986 190 4XY 0.04083 -0.05293 -0.02192 -0.07436 -0.06597 191 4XZ 0.02202 -0.03032 -0.00948 -0.04183 -0.03674 192 4YZ 0.00939 -0.00885 0.00855 0.01411 -0.03312 193 18 C 1S 0.20100 -0.11878 -0.04794 0.05786 -0.10974 194 2S -1.24205 0.70263 0.26195 -0.31591 0.68031 195 2PX 0.08091 -0.00668 0.01330 0.14585 -0.05107 196 2PY 0.00927 -0.01407 -0.00698 -0.03349 -0.03890 197 2PZ 0.00305 -0.00900 -0.00090 -0.02167 -0.01955 198 3S -0.48586 0.55711 0.49307 -0.63115 0.48213 199 3PX -0.07247 0.10450 -0.00475 0.04373 0.43483 200 3PY -0.00925 0.19332 0.23060 -0.18699 0.25509 201 3PZ -0.00166 0.11052 0.10357 -0.09960 0.11697 202 4XX 0.76126 -0.44583 -0.17341 0.19824 -0.51977 203 4YY 0.75472 -0.44167 -0.16812 0.18777 -0.42172 204 4ZZ 0.77478 -0.45134 -0.18123 0.20903 -0.41537 205 4XY 0.04698 0.00355 0.00638 0.10479 -0.00917 206 4XZ 0.02577 0.00074 0.00559 0.05698 -0.00017 207 4YZ -0.01950 0.01156 0.00444 -0.02349 -0.00753 208 19 C 1S 0.00938 -0.05102 -0.04041 -0.13835 0.07159 209 2S -0.03895 0.32994 0.27640 0.78118 -0.43121 210 2PX 0.08965 -0.03594 -0.01024 0.05876 -0.05783 211 2PY 0.10196 -0.06034 -0.02958 -0.01532 -0.02077 212 2PZ 0.05345 -0.03179 -0.01662 -0.00939 -0.01052 213 3S -0.13354 -0.02762 -0.09604 0.71534 -0.60904 214 3PX -0.03037 0.11654 0.10523 -0.19337 0.20361 215 3PY -0.12077 0.01983 -0.07081 0.13389 0.09122 216 3PZ -0.06590 0.00474 -0.03213 0.07587 0.04916 217 4XX -0.06611 -0.15687 -0.14981 -0.55961 0.34337 218 4YY 0.10658 -0.24504 -0.19007 -0.52676 0.28009 219 4ZZ 0.05669 -0.21363 -0.16841 -0.52838 0.27079 220 4XY -0.02109 0.00626 -0.00250 -0.02490 0.03835 221 4XZ -0.00830 0.00277 -0.00338 -0.01250 0.01794 222 4YZ 0.04579 -0.02846 -0.01956 0.00271 0.00653 223 20 C 1S -0.20463 0.09344 0.03872 -0.03283 0.05037 224 2S 1.25455 -0.59515 -0.26625 0.18337 -0.28419 225 2PX -0.02358 0.01409 0.00038 0.06333 -0.04839 226 2PY 0.08831 -0.06426 -0.03362 -0.07669 0.05006 227 2PZ 0.04862 -0.03567 -0.01740 -0.04307 0.02831 228 3S 0.70012 -0.14119 0.12623 -0.06992 -0.19334 229 3PX -0.11483 -0.07477 -0.13935 0.01148 0.01041 230 3PY -0.11053 0.02548 -0.03278 0.02952 0.03449 231 3PZ -0.05700 0.01764 -0.02044 0.01700 0.01535 232 4XX -0.72715 0.33052 0.14243 -0.17171 0.22789 233 4YY -0.78819 0.38573 0.17893 -0.10518 0.18336 234 4ZZ -0.79206 0.37068 0.16126 -0.12274 0.19003 235 4XY -0.05826 0.03894 0.01612 0.06509 -0.04096 236 4XZ -0.03389 0.02208 0.00979 0.03685 -0.02291 237 4YZ 0.00593 0.01138 0.01582 0.01329 -0.00467 238 21 C 1S -0.23622 0.13732 0.06133 0.14419 -0.09677 239 2S 1.49770 -0.80487 -0.31439 -0.80133 0.57298 240 2PX 0.07864 -0.03414 -0.01702 0.02102 0.00306 241 2PY 0.01322 -0.00935 -0.00408 -0.02883 0.04216 242 2PZ 0.00544 -0.00428 -0.00233 -0.01624 0.02299 243 3S 0.42380 -0.60240 -0.65505 -0.71343 0.68215 244 3PX 0.02533 0.05274 0.12443 0.19935 -0.17917 245 3PY 0.06275 0.14931 0.22587 -0.01110 0.06763 246 3PZ 0.03356 0.07796 0.12671 -0.01710 0.05103 247 4XX -0.93388 0.52542 0.22650 0.57661 -0.45027 248 4YY -0.90066 0.50577 0.21253 0.53666 -0.38385 249 4ZZ -0.91556 0.52352 0.22633 0.54966 -0.37277 250 4XY -0.03870 0.00672 0.00450 -0.05148 0.00245 251 4XZ -0.02101 0.00423 0.00224 -0.02769 0.00114 252 4YZ 0.01499 -0.01652 -0.01316 -0.00809 -0.01496 253 22 H 1S 0.09343 -0.05376 -0.02386 -0.02429 0.01531 254 2S -0.19908 0.06081 -0.01957 0.15105 -0.14917 255 23 H 1S 0.09037 -0.03540 -0.00981 0.01607 -0.01874 256 2S -0.11036 0.08138 0.06102 -0.02370 0.03512 257 24 H 1S -0.00527 0.02040 0.01167 0.06172 -0.01483 258 2S -0.00822 -0.05483 -0.06202 -0.04260 0.05365 259 25 H 1S -0.08239 0.05658 0.02426 -0.02171 0.06587 260 2S 0.14050 -0.01495 0.03731 0.00091 0.03675 261 26 H 1S -0.08277 0.05253 0.00195 -0.03812 0.06939 262 2S 0.04813 -0.24998 -0.29842 0.10673 -0.73189 263 27 H 1S 0.01386 -0.00043 0.02656 0.05616 -0.05509 264 2S 0.09521 -0.10226 -0.01798 -0.29800 0.03418 256 257 258 259 260 V V V V V Eigenvalues -- 4.28034 4.29569 4.32389 4.38150 4.46293 1 1 C 1S 0.05006 0.00092 -0.00205 0.18422 0.16722 2 2S -0.23843 0.11752 -0.07173 -0.92736 -0.91029 3 2PX -0.08546 -0.13546 0.02753 0.00171 -0.07102 4 2PY -0.00019 0.03944 -0.00294 -0.08000 -0.06081 5 2PZ 0.00075 0.03402 -0.00874 -0.06439 -0.04028 6 3S -0.51361 -0.89393 0.40220 -1.63166 -1.99831 7 3PX 0.27170 0.30424 -0.03321 0.27784 0.31682 8 3PY 0.18128 0.29812 -0.17563 0.41630 0.31669 9 3PZ 0.12981 0.20710 -0.08579 0.27759 0.24115 10 4XX 0.20766 -0.00082 0.03917 0.80011 0.91498 11 4YY 0.14901 -0.09436 0.02504 0.69542 0.61277 12 4ZZ 0.18056 -0.03302 0.00380 0.69534 0.60014 13 4XY 0.03535 0.08088 -0.02303 -0.08044 -0.07856 14 4XZ 0.01694 0.03217 -0.00886 -0.04965 -0.05800 15 4YZ -0.02862 -0.06889 0.02065 0.02227 0.00128 16 2 C 1S -0.12632 -0.26351 0.03992 -0.00764 -0.34350 17 2S 0.56666 1.07998 -0.06758 -0.04062 1.59880 18 2PX -0.02029 -0.02405 0.00979 -0.06608 -0.05624 19 2PY 0.00733 0.01955 0.00270 -0.02301 0.06886 20 2PZ 0.01124 0.03726 -0.01176 -0.02219 0.04929 21 3S 0.94453 2.22883 -0.57386 0.25279 3.14952 22 3PX 0.16023 0.19744 -0.06576 0.29373 0.18434 23 3PY -0.06182 -0.22345 0.21396 -0.14049 -0.37500 24 3PZ -0.10719 -0.36386 0.10694 0.02414 -0.32283 25 4XX -0.48182 -0.92749 0.10006 -0.09423 -1.44926 26 4YY -0.41841 -0.87114 0.08422 0.09252 -1.27472 27 4ZZ -0.44819 -0.92172 0.12843 -0.00137 -1.21155 28 4XY 0.00833 0.01995 -0.02798 0.06385 -0.11849 29 4XZ 0.00369 0.01437 -0.00816 0.00584 -0.04794 30 4YZ 0.00496 -0.00500 -0.01652 0.05002 -0.04424 31 3 H 1S 0.02141 0.05070 -0.01225 -0.00915 0.01688 32 2S -0.08390 -0.17369 -0.00801 0.04687 -0.27401 33 4 Br 1S 0.00002 0.00019 0.00009 0.00011 0.00080 34 2S 0.00350 0.00362 -0.00049 0.00112 -0.00212 35 3S -0.01050 -0.01226 0.00031 -0.00470 -0.00033 36 4S -0.00186 -0.00113 0.00277 0.00232 0.00469 37 5S -0.01760 0.03992 0.01845 -0.08688 -0.05008 38 6S -0.03684 -0.26168 -0.03730 0.20032 -0.11053 39 7PX -0.00045 -0.00125 -0.00030 0.00008 -0.00011 40 7PY 0.00119 0.00290 -0.00136 -0.00067 0.00422 41 7PZ -0.00025 -0.00139 0.00045 0.00105 -0.00162 42 8PX 0.00158 0.00425 0.00100 -0.00007 0.00063 43 8PY -0.00429 -0.01031 0.00465 0.00218 -0.01512 44 8PZ 0.00109 0.00513 -0.00160 -0.00343 0.00618 45 9PX -0.01080 -0.01994 -0.00432 -0.01305 -0.01548 46 9PY 0.02750 0.05682 -0.02082 -0.00242 0.09312 47 9PZ -0.01196 -0.03442 0.01096 0.00845 -0.04842 48 10PX 0.01068 -0.00916 0.01218 0.06561 0.02283 49 10PY 0.03892 0.14719 -0.00870 -0.06447 0.09991 50 10PZ -0.03062 -0.08066 -0.02166 0.04494 -0.06553 51 11XX 0.00586 0.00714 -0.00017 0.00010 0.00189 52 11YY 0.00694 0.01041 -0.00043 0.00501 0.00355 53 11ZZ 0.00606 0.00615 0.00025 0.00347 0.00450 54 11XY 0.00162 -0.00032 0.00118 0.00708 0.00241 55 11XZ -0.00067 -0.00037 -0.00012 -0.00167 -0.00383 56 11YZ 0.00125 0.00140 -0.00187 0.00248 0.00526 57 12XX 0.00357 0.03411 0.01454 -0.00071 0.02000 58 12YY -0.03413 -0.06120 0.03384 -0.02719 -0.08815 59 12ZZ -0.01132 0.01141 0.01120 -0.02038 -0.03749 60 12XY -0.00520 0.01694 -0.00840 -0.04951 -0.00519 61 12XZ 0.00122 -0.00676 0.00241 0.01471 0.01762 62 12YZ 0.01407 0.04640 0.00636 -0.02727 0.03488 63 5 C 1S -0.08101 -0.08838 0.04655 -0.27021 0.13317 64 2S 0.43661 0.53651 -0.34242 1.50376 -0.79537 65 2PX 0.00172 0.05866 -0.01927 -0.01791 0.05726 66 2PY 0.03205 0.09909 0.01037 0.04431 0.06111 67 2PZ -0.01335 -0.03725 -0.17906 -0.01950 0.03122 68 3S 0.15009 0.19646 -0.21643 1.13658 -0.64224 69 3PX -0.00147 -0.39918 0.21309 0.11885 -0.57543 70 3PY -0.06311 -0.56132 0.18443 0.08550 -0.71567 71 3PZ 0.12406 0.30913 0.29423 0.04234 0.04379 72 4XX -0.29280 -0.33768 0.18797 -1.04350 0.54629 73 4YY -0.27578 -0.29597 0.16359 -1.06977 0.68876 74 4ZZ -0.34303 -0.48724 0.35098 -1.14773 0.45276 75 4XY 0.00365 0.01161 0.00334 -0.06541 0.09654 76 4XZ 0.01585 0.03811 0.07335 0.00827 0.02299 77 4YZ 0.04157 0.09322 0.08299 0.04191 0.08174 78 6 C 1S -0.03222 0.03705 -0.32956 -0.03138 0.11109 79 2S 0.12987 -0.19879 1.84647 0.11033 -0.50422 80 2PX 0.01272 0.06284 0.04094 0.04156 -0.00663 81 2PY 0.03190 0.07355 0.11781 0.09497 -0.05783 82 2PZ 0.03335 0.07752 -0.08836 0.12421 -0.02293 83 3S 0.39713 0.24038 2.02214 0.47448 -0.78672 84 3PX -0.08942 -0.10466 -0.07868 -0.19051 0.05889 85 3PY -0.19813 -0.10681 -0.25167 -0.37696 0.22662 86 3PZ 0.04079 0.02481 0.28151 0.01172 -0.24353 87 4XX -0.10021 0.12988 -1.28171 -0.13363 0.44401 88 4YY -0.10149 0.10280 -1.36036 -0.16545 0.48469 89 4ZZ -0.08262 0.18091 -1.34410 0.04616 0.31067 90 4XY 0.00148 -0.03361 -0.09578 -0.03862 0.05195 91 4XZ 0.01924 0.01652 -0.06449 0.00739 0.03968 92 4YZ 0.03273 0.03087 -0.09690 0.01326 0.08129 93 7 C 1S 0.00200 0.16699 0.13463 0.15428 -0.09579 94 2S 0.03318 -0.91462 -0.78304 -0.79838 0.55530 95 2PX -0.01491 -0.01254 0.09180 -0.00856 -0.01075 96 2PY -0.00597 -0.03387 0.15918 -0.02680 -0.01693 97 2PZ 0.01664 0.08367 0.04575 0.11150 -0.08507 98 3S -0.39242 -1.18028 -0.95031 -1.60923 0.99777 99 3PX -0.04968 -0.04500 -0.12745 -0.11239 0.03202 100 3PY -0.10513 -0.05690 -0.18711 -0.11466 -0.00009 101 3PZ -0.15711 -0.35466 -0.13947 -0.49871 0.30449 102 4XX 0.00172 0.63785 0.55972 0.59328 -0.39445 103 4YY 0.00949 0.65924 0.67661 0.67220 -0.51845 104 4ZZ 0.00263 0.66625 0.49006 0.61391 -0.39262 105 4XY 0.00252 0.02280 0.12053 0.06553 -0.11430 106 4XZ -0.00464 -0.02769 0.03183 -0.04521 0.03404 107 4YZ -0.01313 -0.05362 0.05766 -0.07469 0.05343 108 8 C 1S -0.04422 -0.10508 0.10760 -0.18152 0.13039 109 2S 0.26426 0.58834 -0.60465 1.02174 -0.73590 110 2PX -0.00681 -0.03592 0.02011 -0.05415 0.04265 111 2PY -0.00630 -0.06778 0.02460 -0.09228 0.06909 112 2PZ -0.00653 0.05223 0.16876 -0.00330 0.00885 113 3S 0.34778 0.81350 -0.76996 1.65229 -1.25758 114 3PX 0.05995 0.13913 -0.08432 0.27120 -0.16864 115 3PY 0.11063 0.24945 -0.13339 0.44451 -0.26194 116 3PZ 0.03719 -0.05186 -0.19706 0.10143 -0.10008 117 4XX -0.16951 -0.40123 0.39566 -0.67809 0.48273 118 4YY -0.17262 -0.42942 0.38173 -0.71572 0.51023 119 4ZZ -0.18598 -0.46113 0.56447 -0.87613 0.67141 120 4XY -0.00959 -0.02374 -0.01086 -0.03564 0.02664 121 4XZ -0.00028 0.03238 0.04702 0.02330 -0.01941 122 4YZ -0.00027 0.06274 0.06659 0.06014 -0.04915 123 9 C 1S 0.00939 -0.03338 -0.26965 0.09149 -0.07945 124 2S -0.00653 0.22166 1.56770 -0.44251 0.43642 125 2PX -0.00884 -0.04642 -0.05547 -0.01921 -0.00252 126 2PY -0.00480 -0.07309 -0.09898 -0.02512 -0.00652 127 2PZ -0.02377 -0.04531 0.09145 -0.10928 0.08298 128 3S -0.29655 0.04373 1.81920 -1.14326 0.81113 129 3PX -0.04384 0.00053 0.15178 -0.12528 0.04734 130 3PY -0.10199 -0.01714 0.27346 -0.23784 0.08254 131 3PZ 0.07055 0.00531 -0.25576 0.31848 -0.34045 132 4XX 0.02731 -0.15439 -1.05562 0.32775 -0.30137 133 4YY 0.01439 -0.20895 -1.13760 0.31287 -0.33173 134 4ZZ 0.04087 -0.09497 -1.16486 0.43994 -0.39977 135 4XY -0.01316 -0.05707 -0.09919 -0.01267 -0.03323 136 4XZ 0.00113 -0.01503 -0.06976 0.03109 -0.04921 137 4YZ 0.00248 -0.02532 -0.10704 0.04152 -0.06832 138 10 C 1S 0.01871 0.16334 0.15714 0.06812 0.02643 139 2S -0.08569 -0.89395 -0.89493 -0.41780 -0.02265 140 2PX 0.01658 0.01058 -0.08552 0.05700 -0.01430 141 2PY 0.03202 0.00714 -0.13025 0.10569 -0.04448 142 2PZ -0.03229 -0.07697 -0.06482 -0.09946 0.02794 143 3S -0.11224 -1.20703 -1.17612 -0.14567 -0.66839 144 3PX -0.10561 -0.13068 0.11120 -0.19492 -0.05863 145 3PY -0.15095 -0.20783 0.19131 -0.27830 -0.11206 146 3PZ -0.01445 0.28267 0.20526 -0.10460 0.33768 147 4XX 0.07778 0.64623 0.63758 0.26792 0.10612 148 4YY 0.09912 0.71339 0.74775 0.31785 0.11526 149 4ZZ 0.07527 0.61695 0.59217 0.35159 -0.01615 150 4XY 0.01126 0.06203 0.11144 0.03145 0.01138 151 4XZ -0.01915 -0.02770 0.02041 -0.05192 0.01357 152 4YZ -0.03455 -0.03975 0.02217 -0.10522 0.04319 153 11 H 1S 0.01632 -0.02614 -0.05095 0.00306 0.01897 154 2S 0.04118 0.11401 0.09588 0.11638 -0.04640 155 12 H 1S 0.00022 0.01334 0.08908 -0.02796 0.02959 156 2S -0.02820 -0.03700 -0.15538 -0.01897 -0.00603 157 13 H 1S 0.02542 0.04268 -0.03505 0.06840 -0.03395 158 2S -0.01510 -0.03086 0.04584 -0.05267 0.05662 159 14 H 1S 0.00237 -0.06490 -0.03953 -0.04609 0.02392 160 2S -0.04307 0.04867 0.08081 0.01552 -0.03393 161 15 H 1S 0.03459 0.00479 0.09947 0.02270 -0.00366 162 2S 0.00506 0.05274 -0.21524 0.05019 -0.01790 163 16 C 1S 0.08765 0.18924 -0.04270 -0.14081 -0.02141 164 2S -0.61183 -1.18504 0.26994 0.77220 0.16056 165 2PX -0.06602 0.04906 -0.00386 0.07969 0.09109 166 2PY -0.11659 0.03676 -0.01051 -0.04790 -0.06844 167 2PZ -0.05945 0.02043 -0.00184 -0.02552 -0.04416 168 3S 0.00736 -0.69337 0.11519 1.02459 -0.22856 169 3PX -0.03126 -0.40877 0.09304 -0.89229 -0.45900 170 3PY -0.00815 0.30919 -0.25342 -0.14898 0.63809 171 3PZ -0.01948 0.17347 -0.18090 -0.08163 0.35154 172 4XX 0.31351 0.94654 -0.22132 -0.61625 -0.05841 173 4YY 0.48681 0.75250 -0.17064 -0.61674 -0.19341 174 4ZZ 0.38029 0.73166 -0.16301 -0.55517 -0.11743 175 4XY -0.00335 0.01199 0.00360 0.07369 0.11140 176 4XZ -0.00225 -0.00193 0.00683 0.04594 0.06518 177 4YZ 0.08990 0.01837 -0.00061 -0.06809 -0.09041 178 17 C 1S -0.26212 0.04248 -0.00639 0.01514 -0.04793 179 2S 1.54140 -0.23663 0.00005 -0.16802 0.21443 180 2PX -0.14193 0.04712 -0.00373 -0.03429 -0.04873 181 2PY 0.00692 -0.10674 0.03668 0.08122 0.04132 182 2PZ 0.00533 -0.05943 0.00240 0.04707 0.02396 183 3S 1.51514 -0.15377 0.15228 0.28533 0.77293 184 3PX 0.14518 0.15300 -0.06919 0.54874 0.40244 185 3PY -0.19770 0.22037 -0.31063 -0.49050 0.53592 186 3PZ -0.10008 0.11458 -0.10458 -0.28024 0.27476 187 4XX -1.08745 0.23348 -0.00573 0.08824 -0.22842 188 4YY -1.16404 0.13663 -0.01935 0.09263 -0.16613 189 4ZZ -1.03579 0.15293 -0.01849 0.07198 -0.17360 190 4XY 0.07289 -0.08048 0.00184 0.05483 0.11804 191 4XZ 0.04465 -0.04391 0.00351 0.03055 0.06598 192 4YZ -0.11578 -0.01020 0.00269 0.01725 -0.00016 193 18 C 1S 0.17472 -0.16747 0.03272 0.12421 0.11587 194 2S -1.01744 0.98007 -0.15105 -0.61904 -0.64825 195 2PX -0.12826 -0.04303 0.01558 0.07533 0.02645 196 2PY 0.10661 -0.08482 0.00955 0.04629 0.07770 197 2PZ 0.06103 -0.04495 0.00930 0.02190 0.04121 198 3S -1.07468 0.98399 -0.39963 -1.66857 -1.12414 199 3PX 0.23653 0.03378 0.09999 0.14705 -0.37191 200 3PY -0.10786 0.10404 -0.05737 -0.46835 -0.38927 201 3PZ -0.06808 0.05599 -0.06621 -0.25397 -0.19891 202 4XX 0.80053 -0.82538 0.13632 0.59479 0.64156 203 4YY 0.71509 -0.65553 0.11963 0.43709 0.44388 204 4ZZ 0.67208 -0.63296 0.11501 0.44625 0.42211 205 4XY -0.10326 0.00311 0.00476 0.03703 -0.01936 206 4XZ -0.05929 0.00782 0.00577 0.01606 -0.01717 207 4YZ 0.04116 -0.02064 -0.00582 -0.00861 0.02111 208 19 C 1S 0.08221 0.14362 -0.03382 -0.16891 -0.14044 209 2S -0.47668 -0.85368 0.17632 0.90556 0.77267 210 2PX 0.07371 -0.10214 0.01841 0.08272 0.07316 211 2PY 0.13586 -0.00405 -0.00388 -0.05620 -0.05234 212 2PZ 0.07209 0.00055 -0.00391 -0.03304 -0.03041 213 3S -0.70144 -0.91807 0.30134 1.68177 1.56892 214 3PX 0.03716 0.13332 -0.06155 -0.41015 -0.46459 215 3PY -0.18135 -0.06894 0.09260 0.43160 0.18009 216 3PZ -0.09875 -0.04227 0.06561 0.24424 0.10714 217 4XX 0.23919 0.67468 -0.14342 -0.72524 -0.62344 218 4YY 0.44221 0.59234 -0.13299 -0.72240 -0.63779 219 4ZZ 0.34526 0.54979 -0.12666 -0.64271 -0.53985 220 4XY 0.01373 0.08136 -0.01399 -0.09484 -0.09936 221 4XZ 0.00930 0.04023 -0.00963 -0.04834 -0.05067 222 4YZ 0.08668 0.03382 -0.00521 -0.06655 -0.08368 223 20 C 1S -0.26810 0.00422 0.00876 0.12186 0.12471 224 2S 1.54073 -0.02646 -0.03366 -0.62185 -0.65388 225 2PX 0.16074 -0.04120 0.00222 -0.03482 -0.06105 226 2PY 0.01014 0.09748 -0.01838 -0.08231 -0.05932 227 2PZ 0.00133 0.05361 -0.00917 -0.04483 -0.03212 228 3S 1.78482 -0.18265 -0.07736 -1.49508 -1.58165 229 3PX -0.41167 0.08084 0.03344 0.49464 0.54148 230 3PY -0.09617 -0.18464 0.10585 0.26631 0.02680 231 3PZ -0.04254 -0.09935 0.04828 0.13460 0.00825 232 4XX -1.10101 0.07511 0.01917 0.43435 0.47541 233 4YY -1.17270 -0.02089 0.03692 0.55309 0.59490 234 4ZZ -1.05144 0.00397 0.03390 0.47307 0.48890 235 4XY 0.08897 -0.05220 0.00722 0.00034 -0.02441 236 4XZ 0.05122 -0.03067 0.00529 0.00025 -0.01561 237 4YZ -0.11270 -0.01944 0.00292 0.07114 0.09702 238 21 C 1S 0.17209 -0.15528 0.02619 0.01386 -0.06034 239 2S -0.95187 0.95972 -0.17953 -0.20541 0.27228 240 2PX 0.13128 0.06267 -0.01525 -0.09206 -0.04769 241 2PY -0.10666 0.07204 -0.01400 0.00764 0.05081 242 2PZ -0.06064 0.04067 -0.00795 0.00617 0.03263 243 3S -1.25582 1.02718 -0.09327 0.83121 1.04184 244 3PX -0.06746 0.10819 -0.10446 -0.07559 0.27035 245 3PY 0.28957 -0.26053 0.06325 -0.36061 -0.50386 246 3PZ 0.16200 -0.15113 0.05013 -0.19237 -0.29171 247 4XX 0.77439 -0.79054 0.14960 0.12141 -0.30707 248 4YY 0.68871 -0.61793 0.10733 0.08171 -0.21968 249 4ZZ 0.65476 -0.59065 0.09957 0.06757 -0.21206 250 4XY -0.12455 -0.03956 0.01230 0.05287 0.02700 251 4XZ -0.07330 -0.01688 0.00379 0.02692 0.01713 252 4YZ 0.03415 -0.02411 0.00379 0.00835 -0.00732 253 22 H 1S -0.05706 0.06865 -0.01752 -0.00357 0.03956 254 2S 0.08712 -0.07891 -0.00039 0.08909 0.05020 255 23 H 1S 0.09313 0.00186 -0.00712 -0.04460 -0.03733 256 2S -0.14345 0.01704 -0.01601 -0.01748 0.01137 257 24 H 1S -0.02372 -0.04134 0.01405 0.06721 0.04281 258 2S 0.04423 0.09797 0.00084 -0.00494 -0.03103 259 25 H 1S -0.04953 0.04931 -0.00426 -0.02521 -0.04932 260 2S 0.16065 -0.14027 0.03097 0.01071 -0.02018 261 26 H 1S 0.10172 -0.03215 0.01229 0.01453 -0.01476 262 2S -0.38903 0.26884 -0.29897 -0.01078 0.36760 263 27 H 1S -0.02490 0.00159 0.00158 -0.05521 -0.02515 264 2S -0.07648 -0.09271 0.04355 0.01072 0.09128 261 262 263 264 V V V V Eigenvalues -- 4.66419 4.69567 8.61666 73.51206 1 1 C 1S 0.12539 -0.10029 0.00572 0.00627 2 2S -0.63616 0.63327 0.01473 0.01656 3 2PX 0.04234 -0.03154 0.00966 0.01278 4 2PY -0.08806 0.06365 -0.01152 -0.01445 5 2PZ -0.06163 0.04672 -0.01129 -0.01672 6 3S -0.96670 0.66650 -0.14429 -0.17345 7 3PX 0.14359 -0.08034 0.07343 0.11376 8 3PY 0.24958 -0.00433 0.08397 0.10791 9 3PZ 0.16338 -0.02540 0.12034 0.15684 10 4XX 0.63004 -0.65186 0.00335 0.00491 11 4YY 0.49747 -0.42260 0.00802 0.01075 12 4ZZ 0.46425 -0.36564 0.00760 0.00876 13 4XY -0.08124 0.10311 0.00342 -0.00046 14 4XZ -0.05723 0.06072 0.00397 0.00739 15 4YZ 0.04592 -0.04880 -0.00631 -0.00847 16 2 C 1S -0.02691 0.15765 -0.00665 -0.01041 17 2S 0.04357 -0.83966 -0.07022 -0.05761 18 2PX -0.06370 0.02239 -0.01237 -0.01666 19 2PY -0.01413 -0.05862 0.02813 0.04251 20 2PZ -0.00543 -0.02163 -0.01426 -0.02347 21 3S 0.67808 -1.13364 0.27297 0.36228 22 3PX 0.11924 -0.02173 0.02671 0.03801 23 3PY -0.24504 0.06664 -0.14519 -0.19534 24 3PZ -0.09347 0.04550 -0.05125 -0.04390 25 4XX -0.17461 0.75561 0.01163 0.00552 26 4YY -0.01539 0.66638 0.03999 0.02838 27 4ZZ -0.06090 0.57647 0.00887 -0.00189 28 4XY 0.02728 0.13062 0.00308 0.00431 29 4XZ -0.00699 0.04549 0.00390 0.00263 30 4YZ 0.02135 0.04091 -0.02713 -0.02210 31 3 H 1S -0.00635 0.00948 0.00653 0.00293 32 2S 0.02664 0.15831 -0.04534 -0.07777 33 4 Br 1S 0.00022 -0.00080 0.11421 -0.93825 34 2S -0.00232 0.00690 -1.83239 -3.31430 35 3S 0.00491 -0.01379 5.58850 10.15081 36 4S 0.00284 -0.00767 -2.01269 19.73932 37 5S -0.04809 0.02010 2.27868 8.21573 38 6S 0.09838 0.06105 3.35716 5.51205 39 7PX 0.00021 -0.00039 -0.00092 -0.00108 40 7PY 0.00026 -0.00157 0.00483 0.00565 41 7PZ 0.00017 0.00074 -0.00188 -0.00211 42 8PX -0.00055 0.00114 0.00309 0.00379 43 8PY -0.00098 0.00578 -0.01615 -0.01974 44 8PZ -0.00046 -0.00284 0.00623 0.00734 45 9PX -0.00636 0.00305 -0.01423 -0.01846 46 9PY 0.00887 -0.04084 0.07053 0.09133 47 9PZ -0.00371 0.02172 -0.02568 -0.03298 48 10PX 0.03486 -0.01713 0.02766 0.03878 49 10PY -0.01935 -0.03213 -0.11691 -0.16645 50 10PZ 0.03115 0.03405 0.05200 0.07558 51 11XX -0.00416 0.00526 -1.99060 -15.13768 52 11YY -0.00014 0.00609 -1.99135 -15.13955 53 11ZZ -0.00191 0.00333 -1.99065 -15.13825 54 11XY 0.00363 -0.00186 0.00014 0.00040 55 11XZ -0.00124 0.00289 -0.00124 -0.00175 56 11YZ 0.00207 -0.00252 -0.00046 0.00018 57 12XX 0.00367 -0.01709 -1.67744 -3.13817 58 12YY -0.03082 0.02030 -1.67648 -3.13025 59 12ZZ -0.01129 0.01556 -1.67494 -3.13169 60 12XY -0.02437 0.01000 -0.00132 -0.00313 61 12XZ 0.00940 -0.01679 0.00835 0.01187 62 12YZ -0.01350 -0.01604 0.00127 -0.00318 63 5 C 1S -0.15410 -0.23142 0.00151 0.00235 64 2S 0.74735 1.14060 0.02470 0.02680 65 2PX 0.03617 0.02191 -0.00239 -0.00448 66 2PY 0.07002 0.05367 0.00305 0.00194 67 2PZ 0.02281 0.01697 -0.00315 -0.00191 68 3S 2.15037 3.18769 0.02617 0.03127 69 3PX -0.55696 -0.40590 -0.12734 -0.16002 70 3PY -0.83188 -0.73567 -0.19923 -0.25655 71 3PZ -0.24559 -0.33038 -0.20386 -0.27172 72 4XX -0.56265 -0.85301 -0.00288 -0.00261 73 4YY -0.57264 -0.97012 -0.01857 -0.02159 74 4ZZ -0.79095 -1.08855 0.00531 0.00870 75 4XY -0.04506 -0.10076 -0.01020 -0.01139 76 4XZ 0.00894 -0.00119 0.00115 0.00294 77 4YZ 0.05302 0.00678 0.00696 0.00847 78 6 C 1S 0.14778 0.13944 0.00342 0.00416 79 2S -0.66856 -0.67268 0.02212 0.02927 80 2PX -0.02520 -0.04297 -0.00147 -0.00272 81 2PY -0.05904 -0.06626 0.00889 0.01083 82 2PZ 0.08824 0.10113 0.01115 0.01464 83 3S -2.26227 -2.65571 -0.12999 -0.16271 84 3PX 0.25433 0.36203 -0.01379 -0.01337 85 3PY 0.51960 0.64487 -0.04485 -0.05633 86 3PZ -0.69520 -0.79694 -0.26693 -0.35684 87 4XX 0.54485 0.51344 0.01220 0.01263 88 4YY 0.60543 0.57751 0.00229 -0.00030 89 4ZZ 0.65477 0.69325 -0.01062 -0.01244 90 4XY 0.07484 0.08390 -0.00157 -0.00220 91 4XZ 0.06683 0.07019 -0.00171 -0.00234 92 4YZ 0.10320 0.09291 0.00043 -0.00058 93 7 C 1S -0.11789 -0.14700 -0.00002 0.00012 94 2S 0.56545 0.66144 0.00457 0.00367 95 2PX -0.01470 -0.02003 0.00126 0.00174 96 2PY -0.02694 -0.02230 -0.00141 -0.00156 97 2PZ -0.08874 -0.09996 -0.00135 -0.00169 98 3S 2.00558 2.57287 -0.01080 -0.01436 99 3PX 0.14295 0.20142 -0.04564 -0.05972 100 3PY 0.18062 0.25417 -0.06161 -0.07845 101 3PZ 0.80759 1.05756 0.08561 0.11549 102 4XX -0.45717 -0.55728 -0.00232 -0.00225 103 4YY -0.57715 -0.66461 -0.00289 -0.00202 104 4ZZ -0.45571 -0.56015 -0.00042 0.00042 105 4XY -0.12003 -0.11392 -0.00325 -0.00338 106 4XZ 0.02650 0.02694 -0.00013 0.00015 107 4YZ 0.05079 0.05526 0.00149 0.00241 108 8 C 1S 0.12340 0.13721 0.00051 0.00059 109 2S -0.58195 -0.60560 0.00272 0.00344 110 2PX 0.04741 0.05446 0.00014 0.00009 111 2PY 0.07557 0.08859 0.00016 0.00000 112 2PZ 0.02474 0.02785 0.00021 0.00041 113 3S -2.02820 -2.49060 -0.06314 -0.08050 114 3PX -0.41387 -0.55917 -0.01727 -0.02225 115 3PY -0.67985 -0.91775 -0.03569 -0.04644 116 3PZ -0.21415 -0.25422 0.04328 0.05647 117 4XX 0.43368 0.47444 0.00092 0.00094 118 4YY 0.45801 0.50275 -0.00037 -0.00056 119 4ZZ 0.64033 0.69762 0.00107 0.00084 120 4XY 0.02461 0.02446 -0.00064 -0.00071 121 4XZ -0.01796 -0.01938 -0.00032 -0.00044 122 4YZ -0.04859 -0.05351 0.00136 0.00161 123 9 C 1S -0.12156 -0.14540 -0.00007 -0.00000 124 2S 0.58588 0.66080 -0.00022 -0.00043 125 2PX -0.03262 -0.03997 0.00112 0.00132 126 2PY -0.06206 -0.07324 0.00295 0.00355 127 2PZ 0.06627 0.06906 -0.00074 -0.00122 128 3S 1.95696 2.58793 0.09281 0.11443 129 3PX 0.25159 0.38112 0.03530 0.04482 130 3PY 0.46648 0.69268 0.04926 0.06149 131 3PZ -0.63218 -0.75359 0.02958 0.04035 132 4XX -0.45651 -0.53823 0.00156 0.00202 133 4YY -0.52579 -0.60956 0.00072 0.00104 134 4ZZ -0.54965 -0.63587 -0.00192 -0.00167 135 4XY -0.08113 -0.08701 0.00082 0.00112 136 4XZ -0.06343 -0.06538 0.00057 0.00085 137 4YZ -0.09755 -0.10337 0.00065 0.00091 138 10 C 1S 0.13501 0.15392 0.00035 0.00014 139 2S -0.63313 -0.75953 -0.00101 -0.00044 140 2PX -0.00671 -0.01841 0.00128 0.00145 141 2PY -0.00964 -0.01856 -0.00450 -0.00563 142 2PZ -0.10065 -0.13014 -0.00023 0.00031 143 3S -2.12109 -2.57713 -0.06725 -0.07721 144 3PX 0.08014 0.21303 0.05715 0.07118 145 3PY 0.09281 0.31303 0.11671 0.15018 146 3PZ 0.85196 1.03036 0.05669 0.06664 147 4XX 0.52369 0.59185 0.00002 -0.00102 148 4YY 0.63771 0.73248 0.00369 0.00374 149 4ZZ 0.51902 0.64043 0.00150 0.00034 150 4XY 0.11823 0.14699 0.00097 0.00067 151 4XZ -0.03296 -0.04118 -0.00220 -0.00210 152 4YZ -0.05914 -0.08460 -0.00458 -0.00536 153 11 H 1S -0.04318 -0.07575 -0.00975 -0.01154 154 2S -0.06676 -0.09586 -0.02186 -0.02624 155 12 H 1S 0.05046 0.05977 -0.00174 -0.00232 156 2S 0.06557 0.10453 -0.00165 -0.00300 157 13 H 1S -0.04609 -0.06072 0.00014 0.00009 158 2S -0.06450 -0.12050 -0.00617 -0.00827 159 14 H 1S 0.04765 0.06457 0.00596 0.00742 160 2S 0.07030 0.10834 0.02503 0.03563 161 15 H 1S -0.05208 -0.07094 0.01333 0.01553 162 2S -0.05667 -0.08708 -0.16119 -0.22851 163 16 C 1S -0.20858 0.15899 0.00526 0.00518 164 2S 1.01909 -0.84680 -0.01098 0.00095 165 2PX -0.00024 -0.01536 -0.01061 -0.01421 166 2PY 0.00480 0.01060 0.01183 0.01625 167 2PZ -0.00007 0.01017 -0.00417 -0.00626 168 3S 3.02526 -1.88773 0.00380 0.00106 169 3PX 0.44038 -0.58245 -0.04464 -0.05433 170 3PY -0.59620 0.29082 -0.04144 -0.07598 171 3PZ -0.32687 0.18510 -0.01551 -0.02893 172 4XX -0.90770 0.71947 0.02433 0.02215 173 4YY -0.94851 0.77651 0.02158 0.01956 174 4ZZ -0.79049 0.61920 0.01464 0.01156 175 4XY -0.02190 -0.00315 -0.00273 -0.00292 176 4XZ -0.00405 -0.01222 0.00275 0.00355 177 4YZ -0.15150 0.15064 -0.00368 -0.00462 178 17 C 1S 0.16430 -0.11702 -0.00076 -0.00058 179 2S -0.77472 0.56003 0.00226 0.00089 180 2PX 0.11271 -0.08896 0.00297 0.00376 181 2PY 0.03362 -0.03605 -0.00308 -0.00295 182 2PZ 0.02162 -0.00858 -0.00189 -0.00215 183 3S -2.74786 2.00535 -0.05059 -0.07307 184 3PX -0.85243 0.80433 -0.04934 -0.06393 185 3PY -0.39936 -0.00127 0.00677 -0.00365 186 3PZ -0.21545 -0.05004 -0.00016 -0.00714 187 4XX 0.65331 -0.45150 -0.00297 -0.00191 188 4YY 0.77371 -0.57973 -0.00344 -0.00236 189 4ZZ 0.61992 -0.44642 -0.00516 -0.00457 190 4XY -0.04815 0.00446 0.00100 0.00031 191 4XZ -0.02753 0.00610 0.00071 0.00032 192 4YZ 0.13603 -0.11731 -0.00208 -0.00232 193 18 C 1S -0.14313 0.10143 -0.00077 -0.00085 194 2S 0.65108 -0.42917 -0.00535 -0.00562 195 2PX -0.00303 0.00397 -0.00128 -0.00146 196 2PY -0.09806 0.06297 0.00060 0.00058 197 2PZ -0.05549 0.03148 0.00018 0.00027 198 3S 2.41232 -1.97546 0.06795 0.08057 199 3PX 0.17572 0.09788 -0.00412 0.00030 200 3PY 0.89967 -0.71796 0.03098 0.03762 201 3PZ 0.49562 -0.37573 0.01910 0.02296 202 4XX -0.73689 0.50149 0.00167 0.00127 203 4YY -0.52950 0.36169 0.00025 0.00018 204 4ZZ -0.49481 0.34837 -0.00105 -0.00101 205 4XY 0.04046 -0.01491 -0.00090 -0.00069 206 4XZ 0.02876 -0.01433 -0.00054 -0.00046 207 4YZ -0.02875 0.01551 0.00159 0.00146 208 19 C 1S 0.13369 -0.09052 0.00029 0.00033 209 2S -0.61752 0.40132 0.00160 0.00192 210 2PX -0.07335 0.05244 0.00044 0.00038 211 2PY 0.05508 -0.03990 0.00032 0.00047 212 2PZ 0.03188 -0.02227 0.00033 0.00050 213 3S -2.35683 1.63999 -0.02429 -0.02781 214 3PX 0.76338 -0.52289 0.02305 0.03010 215 3PY -0.52814 0.47237 -0.00676 -0.00491 216 3PZ -0.31098 0.26382 -0.00624 -0.00594 217 4XX 0.57978 -0.39285 -0.00046 -0.00058 218 4YY 0.58406 -0.38802 0.00025 0.00040 219 4ZZ 0.48986 -0.32737 0.00018 0.00021 220 4XY 0.10576 -0.07305 -0.00047 -0.00039 221 4XZ 0.05496 -0.03616 -0.00019 -0.00015 222 4YZ 0.07938 -0.05009 -0.00025 -0.00019 223 20 C 1S -0.14007 0.09491 -0.00071 -0.00079 224 2S 0.63858 -0.42060 -0.00428 -0.00468 225 2PX 0.11840 -0.08117 -0.00031 -0.00047 226 2PY 0.01342 -0.00347 -0.00012 -0.00030 227 2PZ 0.00344 0.00010 -0.00061 -0.00071 228 3S 2.34604 -1.71558 0.05453 0.06833 229 3PX -0.95682 0.68595 -0.02329 -0.02801 230 3PY -0.31886 0.26909 0.01468 0.02328 231 3PZ -0.14719 0.13210 0.01282 0.01872 232 4XX -0.55634 0.37694 0.00058 0.00037 233 4YY -0.65354 0.43895 0.00030 0.00014 234 4ZZ -0.52797 0.35403 -0.00124 -0.00116 235 4XY 0.08458 -0.06148 -0.00071 -0.00073 236 4XZ 0.04785 -0.03491 -0.00100 -0.00106 237 4YZ -0.11769 0.07874 0.00156 0.00151 238 21 C 1S 0.15728 -0.10887 -0.00028 -0.00017 239 2S -0.78461 0.55096 0.00138 0.00079 240 2PX -0.01114 0.01005 0.00428 0.00461 241 2PY -0.09987 0.07063 0.00082 0.00068 242 2PZ -0.05410 0.03730 0.00155 0.00154 243 3S -2.34084 1.76638 -0.00190 -0.00084 244 3PX 0.16603 -0.17964 -0.05729 -0.08003 245 3PY 0.82850 -0.61047 0.01115 0.01641 246 3PZ 0.44641 -0.33153 -0.00153 -0.00130 247 4XX 0.83511 -0.59385 -0.00353 -0.00212 248 4YY 0.59839 -0.41577 -0.00183 -0.00173 249 4ZZ 0.55602 -0.38294 -0.00134 -0.00090 250 4XY -0.04060 0.02622 -0.00060 -0.00073 251 4XZ -0.02900 0.02045 0.00179 0.00215 252 4YZ 0.03880 -0.03001 -0.00018 -0.00031 253 22 H 1S -0.06328 0.04443 -0.00494 -0.00640 254 2S -0.06860 0.06195 0.01603 0.02151 255 23 H 1S 0.06032 -0.04022 -0.00100 -0.00141 256 2S 0.10179 -0.08022 0.00181 0.00090 257 24 H 1S -0.05208 0.04304 -0.00168 -0.00188 258 2S -0.08514 0.08212 -0.00553 -0.00679 259 25 H 1S 0.06531 -0.03562 0.00024 0.00047 260 2S 0.09498 -0.07114 0.00914 0.01144 261 26 H 1S -0.07584 0.06926 -0.00389 -0.00390 262 2S 0.05127 -0.04989 -0.01339 -0.02255 263 27 H 1S -0.03660 0.01204 0.00542 0.00663 264 2S 0.02724 -0.10780 -0.11168 -0.15976 Density Matrix: 1 2 3 4 5 1 1 C 1S 2.05620 2 2S -0.07593 0.36561 3 2PX -0.00535 0.00090 0.44543 4 2PY -0.00137 -0.00213 0.00518 0.40131 5 2PZ -0.00447 0.00924 -0.00836 0.11089 0.29132 6 3S -0.19415 0.33409 0.06152 -0.00726 -0.00902 7 3PX 0.00255 -0.00458 0.14815 0.00517 0.00546 8 3PY -0.00272 0.01034 -0.00170 0.17981 0.02111 9 3PZ -0.00122 0.01154 -0.01197 0.02416 0.15614 10 4XX -0.01683 -0.00218 -0.01255 -0.00710 -0.00317 11 4YY -0.01694 -0.00376 0.01013 0.00853 0.01035 12 4ZZ -0.01299 -0.01194 0.00291 0.00558 -0.00285 13 4XY -0.00097 0.00148 -0.00514 0.01467 0.00764 14 4XZ -0.00058 0.00068 -0.00386 0.00692 0.00814 15 4YZ -0.00465 0.01017 0.00745 0.00903 0.00330 16 2 C 1S 0.01292 -0.02715 0.06878 0.01010 0.00614 17 2S -0.02456 0.04784 -0.14599 -0.02048 -0.01210 18 2PX -0.07431 0.16144 -0.32731 -0.04267 -0.01185 19 2PY 0.00434 -0.00965 0.00547 0.03282 -0.03307 20 2PZ 0.00279 -0.00488 0.00957 -0.03898 0.06746 21 3S 0.00965 -0.00785 -0.10922 -0.04377 -0.02866 22 3PX -0.01332 0.03783 -0.12820 -0.00976 0.00770 23 3PY -0.00269 -0.00364 0.01173 0.01737 -0.00714 24 3PZ 0.00415 -0.00764 0.00333 -0.01422 0.03196 25 4XX -0.00795 0.01516 -0.01218 -0.00087 0.00036 26 4YY 0.00328 -0.00766 0.01154 0.00278 -0.00079 27 4ZZ 0.00301 -0.00712 0.00965 -0.00031 0.00096 28 4XY -0.00070 0.00074 -0.00072 0.01176 0.00049 29 4XZ -0.00094 0.00201 -0.00056 0.00269 0.00966 30 4YZ 0.00054 -0.00063 0.00166 -0.00021 0.00283 31 3 H 1S 0.01144 -0.02707 0.03520 -0.02169 0.00996 32 2S 0.01232 -0.02612 0.05273 -0.02077 -0.00888 33 4 Br 1S -0.00044 0.00277 -0.00119 0.00093 -0.00153 34 2S 0.00318 -0.01619 0.00856 -0.00727 0.00917 35 3S -0.00407 0.01642 -0.01092 0.01026 -0.00970 36 4S -0.00825 0.02870 -0.02136 0.01852 -0.01649 37 5S 0.00382 -0.01819 0.02252 -0.02383 0.01122 38 6S 0.01909 -0.02054 0.01822 -0.01346 0.02396 39 7PX 0.00264 -0.00669 0.00579 0.00630 -0.01549 40 7PY -0.00213 -0.00044 -0.00746 -0.00444 0.00432 41 7PZ 0.00138 -0.00116 0.00313 0.00127 -0.00847 42 8PX -0.00746 0.02575 -0.01673 -0.01936 0.04669 43 8PY 0.00457 -0.00975 0.02298 0.01548 -0.01179 44 8PZ -0.00401 0.00736 -0.00991 -0.00444 0.02598 45 9PX 0.01376 -0.04992 0.03180 0.03276 -0.08372 46 9PY -0.00788 0.02294 -0.04517 -0.02771 0.01922 47 9PZ 0.00771 -0.01572 0.01964 0.00648 -0.04749 48 10PX 0.01894 -0.05355 0.04192 0.02293 -0.06519 49 10PY -0.01125 0.02157 -0.03923 -0.01516 -0.00119 50 10PZ 0.00825 -0.01294 0.01767 -0.00173 -0.02836 51 11XX 0.00240 -0.00891 0.00482 -0.00515 0.00384 52 11YY 0.00145 -0.00731 0.00589 -0.00401 0.00702 53 11ZZ 0.00095 -0.00757 0.00337 -0.00389 0.00333 54 11XY -0.00161 0.00123 -0.00580 0.00149 -0.00323 55 11XZ 0.00136 -0.00189 0.00437 -0.00275 0.00067 56 11YZ -0.00029 -0.00151 -0.00173 0.00197 -0.00307 57 12XX -0.00315 0.00207 -0.00103 0.00085 0.00026 58 12YY -0.00073 -0.00351 -0.00143 -0.00310 -0.00276 59 12ZZ -0.00077 -0.00388 0.00427 -0.00497 0.00235 60 12XY 0.00070 -0.00257 0.01211 -0.00355 0.00954 61 12XZ -0.00127 0.00318 -0.00910 0.00674 -0.00226 62 12YZ -0.00187 0.00283 0.00230 -0.00308 0.00596 63 5 C 1S -0.00277 0.00450 -0.00989 -0.00647 -0.00321 64 2S 0.00523 -0.01110 0.02499 0.01544 0.00409 65 2PX 0.01241 -0.03373 0.04755 0.00945 0.01951 66 2PY 0.00475 -0.01091 0.03033 0.01943 0.00634 67 2PZ 0.00137 -0.00551 0.00884 0.01261 -0.00623 68 3S 0.00542 -0.00846 0.01985 0.03657 0.02579 69 3PX 0.00597 -0.01815 0.02980 0.01685 0.02443 70 3PY -0.00556 0.01185 -0.01009 0.02557 0.02159 71 3PZ -0.00541 0.00717 -0.00291 0.00978 -0.00697 72 4XX -0.00155 0.00299 -0.00671 -0.00226 -0.00098 73 4YY 0.00069 -0.00203 0.00415 0.00142 -0.00067 74 4ZZ -0.00024 0.00027 0.00004 -0.00061 -0.00000 75 4XY -0.00066 0.00120 -0.00375 -0.00029 -0.00060 76 4XZ -0.00020 0.00033 -0.00111 -0.00114 0.00150 77 4YZ 0.00054 -0.00118 0.00210 -0.00071 0.00140 78 6 C 1S 0.00015 -0.00066 0.00097 0.00220 -0.00130 79 2S 0.00012 0.00150 -0.00221 -0.00541 0.00331 80 2PX 0.00662 -0.01567 0.03076 0.00236 0.00893 81 2PY -0.00385 0.01238 -0.02300 -0.00605 0.00002 82 2PZ -0.00075 0.00435 -0.00558 -0.00707 0.00460 83 3S -0.00636 0.01335 -0.01576 -0.00861 -0.00042 84 3PX 0.00599 -0.01585 0.03187 0.00468 -0.00357 85 3PY -0.00135 0.00231 -0.00468 -0.00444 -0.00499 86 3PZ -0.00427 0.00528 -0.00236 0.00121 0.00015 87 4XX 0.00026 -0.00061 0.00036 0.00010 -0.00023 88 4YY 0.00002 0.00008 0.00021 0.00020 0.00008 89 4ZZ -0.00013 0.00045 -0.00082 -0.00027 -0.00009 90 4XY 0.00007 -0.00027 0.00042 0.00011 -0.00022 91 4XZ 0.00049 -0.00127 0.00215 0.00045 0.00056 92 4YZ 0.00002 0.00002 0.00053 0.00047 -0.00001 93 7 C 1S -0.00008 0.00085 -0.00142 -0.00104 0.00038 94 2S 0.00022 -0.00113 0.00264 0.00216 -0.00083 95 2PX -0.00182 0.00369 -0.00143 0.00151 -0.00187 96 2PY 0.00176 -0.00584 0.00788 0.00348 -0.00045 97 2PZ 0.00036 -0.00115 0.00227 0.00115 -0.00131 98 3S 0.00299 -0.01029 0.01944 0.00684 -0.00407 99 3PX -0.00175 0.00286 0.00064 0.00103 -0.00031 100 3PY 0.00217 -0.00765 0.01250 0.00582 -0.00243 101 3PZ 0.00148 -0.00261 0.00257 -0.00036 0.00005 102 4XX 0.00037 -0.00090 0.00171 0.00022 0.00051 103 4YY -0.00033 0.00083 -0.00165 -0.00015 -0.00047 104 4ZZ -0.00002 0.00014 -0.00032 -0.00028 0.00013 105 4XY 0.00020 -0.00064 0.00127 0.00018 0.00027 106 4XZ -0.00009 0.00023 -0.00037 -0.00015 -0.00006 107 4YZ 0.00001 0.00000 -0.00010 -0.00028 0.00010 108 8 C 1S -0.00005 0.00015 -0.00021 -0.00031 -0.00002 109 2S 0.00019 -0.00037 0.00077 0.00050 -0.00022 110 2PX -0.00571 0.01451 -0.02490 -0.00154 -0.00786 111 2PY 0.00372 -0.00944 0.01623 0.00176 0.00469 112 2PZ 0.00030 -0.00131 0.00165 0.00069 0.00046 113 3S -0.00046 0.00051 0.00087 0.00365 0.00292 114 3PX -0.00490 0.01271 -0.02307 -0.00162 -0.00487 115 3PY 0.00202 -0.00488 0.00927 0.00172 0.00463 116 3PZ 0.00035 -0.00048 0.00027 0.00016 0.00230 117 4XX 0.00002 -0.00003 0.00019 0.00005 -0.00009 118 4YY 0.00003 -0.00012 0.00015 -0.00009 0.00002 119 4ZZ -0.00002 0.00007 -0.00014 -0.00007 0.00006 120 4XY -0.00000 -0.00001 0.00015 0.00004 -0.00003 121 4XZ 0.00007 -0.00016 0.00019 0.00004 -0.00002 122 4YZ 0.00003 -0.00005 0.00014 -0.00020 0.00030 123 9 C 1S -0.00037 0.00103 -0.00213 0.00021 -0.00133 124 2S 0.00094 -0.00196 0.00435 -0.00061 0.00307 125 2PX 0.00033 -0.00036 0.00223 0.00210 -0.00295 126 2PY 0.00190 -0.00455 0.00963 -0.00342 0.00852 127 2PZ 0.00017 -0.00014 0.00119 -0.00006 0.00094 128 3S 0.00360 -0.01163 0.02329 -0.00003 0.00020 129 3PX 0.00036 -0.00134 0.00342 0.00281 -0.00486 130 3PY 0.00215 -0.00675 0.01339 -0.00096 0.00494 131 3PZ 0.00074 -0.00173 0.00408 0.00080 0.00480 132 4XX 0.00035 -0.00079 0.00144 0.00030 0.00008 133 4YY -0.00039 0.00098 -0.00175 -0.00040 -0.00041 134 4ZZ -0.00003 0.00009 -0.00016 0.00008 -0.00012 135 4XY 0.00014 -0.00042 0.00083 0.00016 -0.00004 136 4XZ 0.00029 -0.00076 0.00139 0.00017 0.00045 137 4YZ -0.00009 0.00021 -0.00027 0.00000 0.00013 138 10 C 1S 0.00073 -0.00188 0.00341 -0.00150 0.00310 139 2S -0.00155 0.00437 -0.00795 0.00343 -0.00842 140 2PX 0.00641 -0.01624 0.02717 0.01025 -0.00123 141 2PY -0.00681 0.01711 -0.03171 0.00162 -0.01317 142 2PZ 0.00103 -0.00280 0.00504 0.00110 0.00398 143 3S -0.00373 0.01093 -0.02272 0.00549 0.00176 144 3PX 0.00591 -0.01605 0.03070 0.00437 0.00432 145 3PY -0.00207 0.00340 -0.00753 -0.00184 -0.00614 146 3PZ 0.00212 -0.00482 0.00869 -0.00137 -0.00870 147 4XX 0.00029 -0.00075 0.00091 -0.00034 0.00080 148 4YY 0.00025 -0.00036 0.00098 0.00048 -0.00014 149 4ZZ -0.00027 0.00071 -0.00153 -0.00026 -0.00040 150 4XY 0.00032 -0.00082 0.00136 0.00018 0.00072 151 4XZ -0.00032 0.00076 -0.00126 -0.00044 -0.00025 152 4YZ 0.00016 -0.00046 0.00065 -0.00027 0.00017 153 11 H 1S -0.00067 0.00193 -0.00460 0.00069 -0.00316 154 2S -0.00181 0.00389 -0.00775 -0.00279 0.00400 155 12 H 1S -0.00060 0.00155 -0.00319 0.00018 -0.00205 156 2S -0.00105 0.00233 -0.00525 -0.00019 -0.00440 157 13 H 1S 0.00008 -0.00009 0.00052 -0.00024 0.00034 158 2S -0.00006 0.00022 0.00008 -0.00019 0.00118 159 14 H 1S -0.00018 0.00081 -0.00178 -0.00148 0.00091 160 2S -0.00008 0.00096 -0.00294 -0.00324 0.00124 161 15 H 1S -0.00036 0.00177 -0.00419 -0.00247 0.00032 162 2S -0.00292 0.00486 -0.00782 0.00075 -0.00038 163 16 C 1S 0.01731 -0.03487 -0.05243 0.05152 0.03221 164 2S -0.03519 0.06332 0.10576 -0.10451 -0.06568 165 2PX 0.06307 -0.12733 -0.15059 0.16239 0.10556 166 2PY -0.04808 0.10068 0.13144 -0.05282 -0.16697 167 2PZ -0.02585 0.05304 0.08461 -0.17118 0.12781 168 3S 0.00709 0.00749 0.05484 -0.09480 -0.06491 169 3PX -0.00068 -0.01318 0.00441 0.00127 0.00048 170 3PY -0.00015 0.00115 -0.00458 0.02491 -0.05839 171 3PZ 0.00061 -0.00311 0.00267 -0.06449 0.09231 172 4XX -0.00182 0.00259 -0.00954 -0.00607 -0.00346 173 4YY -0.00082 -0.00001 0.00319 0.01103 0.00170 174 4ZZ 0.00067 -0.00227 -0.00197 0.00382 0.00699 175 4XY 0.00531 -0.01071 -0.00798 0.00413 0.00520 176 4XZ 0.00335 -0.00673 -0.00409 0.00489 -0.00140 177 4YZ -0.00210 0.00357 0.00519 0.00194 0.00395 178 17 C 1S -0.00368 0.00872 0.00613 -0.01358 -0.00788 179 2S 0.00762 -0.01783 -0.01133 0.02809 0.01628 180 2PX -0.00439 0.01252 0.00988 -0.01424 -0.00392 181 2PY 0.01270 -0.03178 -0.02588 0.05950 0.00027 182 2PZ 0.00857 -0.02280 -0.00930 -0.01167 0.06676 183 3S 0.00969 -0.03418 -0.04361 0.08844 0.04956 184 3PX 0.00046 -0.00264 -0.02391 0.02886 0.02291 185 3PY 0.00385 -0.01286 -0.00662 0.03354 0.00041 186 3PZ 0.00364 -0.01100 0.00074 -0.00947 0.03831 187 4XX 0.00013 -0.00013 -0.00121 0.00093 0.00034 188 4YY -0.00067 0.00137 0.00145 0.00012 -0.00749 189 4ZZ -0.00034 0.00083 0.00136 -0.00540 0.00456 190 4XY 0.00189 -0.00378 -0.00461 0.00563 0.00422 191 4XZ 0.00104 -0.00207 -0.00237 0.00359 0.00120 192 4YZ -0.00013 0.00019 0.00089 -0.00440 0.00326 193 18 C 1S 0.00186 -0.00487 -0.00454 0.00688 0.00412 194 2S -0.00519 0.01136 0.01093 -0.01627 -0.00982 195 2PX 0.00634 -0.01761 -0.01423 0.02264 0.01181 196 2PY -0.00596 0.01340 0.01655 -0.03031 0.00927 197 2PZ -0.00426 0.00901 0.00771 0.01496 -0.04540 198 3S -0.00512 0.01785 0.04239 -0.05027 -0.03060 199 3PX 0.00492 -0.01109 -0.01371 0.02553 0.01299 200 3PY 0.00005 0.00455 0.01316 -0.02698 0.00571 201 3PZ -0.00090 0.00402 0.00603 0.01042 -0.03729 202 4XX -0.00013 0.00029 0.00035 -0.00033 -0.00060 203 4YY 0.00058 -0.00125 -0.00115 0.00164 0.00107 204 4ZZ 0.00010 -0.00048 -0.00020 0.00029 0.00050 205 4XY -0.00003 -0.00022 0.00009 -0.00164 0.00184 206 4XZ -0.00013 0.00021 -0.00029 0.00234 -0.00388 207 4YZ 0.00044 -0.00080 -0.00073 0.00098 0.00070 208 19 C 1S 0.00023 -0.00005 -0.00041 0.00180 0.00126 209 2S -0.00052 0.00000 0.00231 -0.00493 -0.00343 210 2PX 0.00126 -0.00008 -0.00440 0.00320 0.00081 211 2PY 0.00114 -0.00342 0.00249 -0.03313 0.03828 212 2PZ -0.00151 0.00349 -0.00415 0.04616 -0.07853 213 3S -0.00389 0.00369 -0.00453 -0.00543 -0.00260 214 3PX -0.00008 0.00266 0.01100 0.00001 -0.00226 215 3PY 0.00046 -0.00220 -0.00296 -0.01521 0.02916 216 3PZ -0.00126 0.00278 -0.00591 0.03425 -0.04920 217 4XX -0.00021 0.00051 0.00042 -0.00061 -0.00031 218 4YY -0.00008 0.00021 0.00030 -0.00021 0.00066 219 4ZZ -0.00006 0.00016 0.00029 0.00023 -0.00068 220 4XY 0.00035 -0.00087 -0.00095 0.00084 -0.00025 221 4XZ 0.00021 -0.00049 -0.00050 -0.00035 0.00117 222 4YZ -0.00003 0.00011 -0.00000 0.00039 -0.00025 223 20 C 1S 0.00249 -0.00559 -0.00785 0.00205 0.00149 224 2S -0.00587 0.01238 0.01676 -0.00696 -0.00449 225 2PX 0.00954 -0.02015 -0.02511 0.01391 0.00772 226 2PY -0.00589 0.01303 0.01911 -0.01481 0.01659 227 2PZ -0.00380 0.00899 0.00911 0.01943 -0.03689 228 3S -0.01329 0.03064 0.07793 -0.00796 -0.01084 229 3PX 0.00572 -0.01371 -0.03558 0.00442 0.00473 230 3PY -0.00698 0.01464 0.02504 -0.00924 0.01481 231 3PZ -0.00417 0.00928 0.01297 0.01821 -0.03051 232 4XX 0.00061 -0.00117 -0.00183 0.00181 0.00103 233 4YY -0.00005 -0.00002 -0.00019 0.00132 -0.00362 234 4ZZ 0.00012 -0.00043 0.00001 -0.00264 0.00290 235 4XY 0.00022 -0.00052 -0.00022 -0.00023 0.00069 236 4XZ 0.00005 -0.00011 -0.00022 0.00070 -0.00087 237 4YZ 0.00004 -0.00014 0.00036 -0.00175 0.00219 238 21 C 1S -0.00522 0.01119 0.01590 -0.00134 -0.00127 239 2S 0.01068 -0.02423 -0.03433 -0.00039 0.00047 240 2PX -0.01815 0.03912 0.04901 -0.02304 -0.01251 241 2PY 0.00402 -0.01054 -0.01248 0.00656 -0.04028 242 2PZ 0.00477 -0.01181 -0.00255 -0.04633 0.05392 243 3S 0.02331 -0.04445 -0.11419 0.01853 0.02076 244 3PX -0.00154 0.00038 0.00272 -0.02773 -0.01435 245 3PY -0.00320 0.00640 0.03554 -0.00893 -0.03646 246 3PZ -0.00017 0.00004 0.02282 -0.03586 0.02710 247 4XX -0.00156 0.00362 0.00777 -0.00358 -0.00281 248 4YY 0.00078 -0.00160 -0.00278 0.00093 0.00130 249 4ZZ -0.00016 0.00027 -0.00027 -0.00003 -0.00020 250 4XY 0.00171 -0.00358 -0.00541 -0.00010 0.00539 251 4XZ 0.00085 -0.00178 -0.00356 0.00560 -0.00602 252 4YZ 0.00065 -0.00135 -0.00212 0.00158 0.00059 253 22 H 1S 0.00820 -0.01932 -0.02583 -0.00108 0.00069 254 2S 0.00503 -0.01288 -0.02976 0.01754 0.01163 255 23 H 1S 0.00284 -0.00574 -0.00750 0.00775 0.00455 256 2S 0.00488 -0.00948 -0.01315 0.01101 0.00653 257 24 H 1S -0.00116 0.00362 0.00203 -0.00033 -0.00003 258 2S -0.00184 0.00501 0.00105 0.00049 0.00080 259 25 H 1S 0.00329 -0.00678 -0.00766 0.00802 0.00613 260 2S 0.00563 -0.01087 -0.01083 0.01467 0.00977 261 26 H 1S 0.00507 -0.01220 -0.00866 0.01826 0.00917 262 2S 0.00533 -0.01204 -0.01664 0.02576 0.01866 263 27 H 1S -0.06064 0.12073 0.09111 0.22640 0.14123 264 2S -0.00478 0.01292 0.06455 0.14449 0.09193 6 7 8 9 10 6 3S 0.37722 7 3PX 0.00561 0.07744 8 3PY 0.00139 -0.00455 0.09372 9 3PZ -0.00570 0.00098 -0.00260 0.09315 10 4XX -0.00572 -0.00179 -0.00251 -0.00046 0.00140 11 4YY -0.00114 0.00229 0.00241 0.00456 -0.00067 12 4ZZ -0.00869 0.00046 0.00260 -0.00233 -0.00008 13 4XY 0.00214 -0.00100 0.00585 0.00248 -0.00024 14 4XZ 0.00114 -0.00053 0.00199 0.00438 -0.00019 15 4YZ 0.01028 0.00152 0.00390 0.00097 -0.00057 16 2 C 1S 0.02943 0.00035 -0.00440 -0.00368 -0.00671 17 2S -0.02576 -0.02190 -0.00115 0.00042 0.01186 18 2PX 0.11962 -0.11270 -0.01482 0.00358 0.00706 19 2PY -0.03861 -0.00696 0.01756 -0.00883 0.00116 20 2PZ -0.04115 -0.00839 -0.01095 0.02881 0.00190 21 3S -0.08962 0.01802 -0.01023 -0.00022 0.01522 22 3PX 0.00693 -0.02861 -0.00681 0.00672 0.00391 23 3PY -0.02108 0.00251 0.00205 -0.00216 0.00043 24 3PZ -0.02165 -0.00468 -0.00652 0.00861 0.00059 25 4XX 0.01618 -0.00642 0.00069 0.00082 0.00007 26 4YY -0.00616 0.00526 -0.00068 -0.00149 -0.00041 27 4ZZ -0.00782 0.00326 0.00045 0.00095 -0.00013 28 4XY 0.00192 -0.00080 0.00666 -0.00101 -0.00024 29 4XZ 0.00309 -0.00006 -0.00020 0.00589 -0.00019 30 4YZ -0.00233 0.00059 0.00024 0.00083 0.00007 31 3 H 1S -0.06934 0.01583 -0.00175 0.00436 0.00366 32 2S -0.04153 0.01648 -0.00153 -0.00533 0.00016 33 4 Br 1S -0.00668 0.00374 0.00524 0.00558 0.00010 34 2S 0.02975 -0.01652 -0.02690 -0.02487 -0.00059 35 3S -0.01627 0.00879 0.02163 0.01349 0.00056 36 4S -0.02180 0.01146 0.03477 0.01846 0.00108 37 5S -0.01494 0.01212 -0.01654 0.01316 -0.00060 38 6S -0.00789 0.00007 -0.00541 0.01219 -0.00251 39 7PX -0.01820 0.00193 0.00674 -0.00774 -0.00060 40 7PY 0.04348 -0.01971 -0.01281 -0.01668 0.00009 41 7PZ -0.01786 0.01706 -0.00551 -0.00248 -0.00032 42 8PX 0.03665 -0.00259 -0.02817 0.03394 0.00192 43 8PY -0.03584 0.02914 0.01428 0.01700 0.00052 44 8PZ 0.02578 -0.01522 0.01702 0.01846 -0.00083 45 9PX -0.06153 0.00409 0.05291 -0.06490 -0.00349 46 9PY 0.03239 -0.04269 -0.01702 -0.01965 -0.00112 47 9PZ -0.03709 0.01401 -0.03167 -0.03759 0.00201 48 10PX -0.06150 0.00924 0.04123 -0.05177 -0.00332 49 10PY 0.02610 -0.03290 -0.01099 -0.02369 0.00006 50 10PZ -0.02461 0.01066 -0.03041 -0.02712 0.00080 51 11XX 0.00278 -0.00303 -0.01529 -0.00832 -0.00023 52 11YY 0.01306 -0.00512 -0.01283 -0.01054 -0.00025 53 11ZZ 0.01838 -0.01058 -0.00768 -0.00924 -0.00036 54 11XY 0.00741 -0.00058 0.00194 -0.00413 -0.00003 55 11XZ 0.00019 0.00417 -0.00649 0.00002 -0.00004 56 11YZ 0.00549 -0.00154 -0.00031 -0.00331 0.00018 57 12XX 0.00843 -0.00279 -0.00220 -0.00397 -0.00018 58 12YY 0.00127 0.00014 -0.00492 -0.00225 0.00045 59 12ZZ -0.00167 0.00041 -0.00690 -0.00194 0.00024 60 12XY -0.00033 0.00358 -0.00323 0.00551 -0.00028 61 12XZ 0.00164 -0.00323 0.00367 -0.00188 0.00008 62 12YZ 0.00659 -0.00101 -0.00091 0.00206 -0.00056 63 5 C 1S 0.01055 -0.01265 -0.00870 -0.00315 -0.00006 64 2S -0.01160 0.01669 0.01393 0.00178 -0.00013 65 2PX -0.06690 0.06714 -0.02068 -0.00132 0.00010 66 2PY 0.01190 0.00197 0.01924 0.00473 0.00086 67 2PZ 0.02377 0.00181 0.00433 -0.01933 0.00036 68 3S -0.00694 0.01173 0.00980 0.00494 -0.00138 69 3PX -0.04022 0.03518 -0.01178 0.00314 -0.00135 70 3PY 0.02402 -0.01861 0.01515 0.00950 -0.00077 71 3PZ 0.00988 -0.00050 0.00501 -0.00760 -0.00004 72 4XX 0.00328 -0.00277 -0.00097 -0.00048 0.00017 73 4YY -0.00271 0.00277 0.00008 -0.00045 0.00009 74 4ZZ -0.00044 -0.00068 0.00031 0.00015 -0.00008 75 4XY 0.00090 -0.00067 0.00014 -0.00035 0.00022 76 4XZ -0.00047 0.00008 -0.00073 0.00090 0.00010 77 4YZ -0.00228 0.00102 -0.00010 0.00051 0.00011 78 6 C 1S -0.00089 -0.00130 0.00076 -0.00149 0.00008 79 2S -0.00794 -0.00090 0.00153 0.00480 -0.00028 80 2PX -0.04307 0.02702 -0.00589 0.00288 -0.00088 81 2PY 0.00366 -0.01707 0.00362 0.00748 -0.00007 82 2PZ -0.01271 -0.00443 0.00364 0.01560 -0.00014 83 3S -0.00401 -0.00726 -0.00127 0.00192 -0.00014 84 3PX -0.02845 0.02296 -0.00085 -0.00412 -0.00070 85 3PY 0.00467 -0.00705 0.00306 0.00240 0.00008 86 3PZ -0.00258 -0.00193 0.00500 0.00529 -0.00026 87 4XX -0.00089 0.00131 -0.00075 -0.00057 0.00003 88 4YY 0.00135 -0.00053 0.00045 0.00009 0.00004 89 4ZZ -0.00017 -0.00053 0.00016 0.00016 -0.00002 90 4XY -0.00037 0.00089 -0.00017 -0.00028 -0.00001 91 4XZ -0.00252 0.00257 -0.00064 0.00011 -0.00002 92 4YZ 0.00109 -0.00043 0.00076 0.00036 0.00003 93 7 C 1S -0.00666 -0.00170 0.00112 0.00187 -0.00004 94 2S 0.00622 0.00247 0.00067 -0.00179 0.00006 95 2PX 0.01968 -0.01830 0.01100 -0.00071 0.00032 96 2PY 0.00243 0.01342 -0.00611 -0.00718 0.00012 97 2PZ -0.00082 0.00178 0.00330 0.00091 -0.00011 98 3S 0.00173 0.00901 0.00456 -0.00230 -0.00020 99 3PX 0.01401 -0.01252 0.00836 0.00160 0.00010 100 3PY -0.00582 0.01312 -0.00173 -0.00451 -0.00021 101 3PZ -0.00173 0.00089 0.00038 0.00079 -0.00009 102 4XX -0.00191 0.00179 -0.00059 -0.00007 -0.00003 103 4YY 0.00171 -0.00174 0.00055 -0.00006 0.00003 104 4ZZ -0.00032 -0.00021 -0.00006 0.00034 -0.00001 105 4XY -0.00094 0.00125 -0.00037 -0.00016 -0.00004 106 4XZ 0.00039 -0.00086 0.00033 0.00024 0.00002 107 4YZ -0.00016 0.00022 -0.00027 0.00013 0.00000 108 8 C 1S -0.00145 -0.00042 -0.00008 0.00018 -0.00001 109 2S 0.00046 0.00018 0.00138 0.00025 -0.00005 110 2PX 0.02955 -0.04127 0.01897 0.00488 0.00057 111 2PY -0.02030 0.02275 -0.00627 0.00039 -0.00062 112 2PZ 0.00391 -0.00206 0.00089 -0.00216 0.00004 113 3S 0.00060 0.00056 0.00206 0.00102 -0.00016 114 3PX 0.02377 -0.03076 0.01208 0.00305 0.00053 115 3PY -0.01327 0.01612 -0.00644 -0.00025 -0.00037 116 3PZ 0.00152 -0.00059 -0.00007 0.00055 0.00002 117 4XX 0.00010 -0.00029 0.00020 0.00002 0.00001 118 4YY -0.00003 0.00071 -0.00043 -0.00016 0.00001 119 4ZZ -0.00002 -0.00016 -0.00001 0.00005 -0.00001 120 4XY 0.00023 -0.00009 0.00012 0.00001 0.00001 121 4XZ -0.00044 0.00018 -0.00015 0.00007 0.00000 122 4YZ -0.00007 0.00009 -0.00013 0.00011 0.00001 123 9 C 1S 0.00127 -0.00183 0.00066 -0.00095 -0.00001 124 2S -0.00422 0.00331 -0.00059 0.00235 0.00004 125 2PX -0.00345 -0.00818 0.00575 0.00523 0.00021 126 2PY -0.01227 0.01504 -0.00598 0.00526 -0.00004 127 2PZ -0.00485 0.00532 -0.00274 0.00091 -0.00001 128 3S -0.01204 0.01142 0.00056 -0.00107 -0.00001 129 3PX -0.00028 -0.00675 0.00598 0.00090 0.00015 130 3PY -0.00939 0.01234 -0.00302 0.00116 -0.00013 131 3PZ -0.00257 0.00345 -0.00085 0.00231 -0.00010 132 4XX -0.00162 0.00157 -0.00056 -0.00017 -0.00003 133 4YY 0.00187 -0.00153 0.00037 -0.00005 0.00003 134 4ZZ 0.00030 -0.00033 0.00027 -0.00004 -0.00001 135 4XY -0.00103 0.00094 -0.00027 -0.00006 -0.00002 136 4XZ -0.00154 0.00178 -0.00060 0.00005 -0.00003 137 4YZ 0.00047 -0.00080 0.00049 0.00040 0.00002 138 10 C 1S -0.00480 0.00129 -0.00296 0.00102 0.00015 139 2S 0.00648 -0.00435 0.00723 -0.00211 -0.00031 140 2PX -0.03067 0.02822 -0.00690 -0.00652 -0.00084 141 2PY 0.04407 -0.03195 0.01381 -0.01046 0.00010 142 2PZ -0.00882 0.00168 0.00388 0.00784 -0.00015 143 3S 0.01613 -0.01426 0.00390 0.00279 -0.00073 144 3PX -0.02644 0.02587 -0.00707 -0.00040 -0.00069 145 3PY 0.01868 -0.01479 0.00752 -0.00421 0.00008 146 3PZ -0.00452 0.00447 0.00229 -0.00262 0.00016 147 4XX -0.00159 0.00193 -0.00119 -0.00009 0.00002 148 4YY 0.00077 -0.00059 0.00075 -0.00012 0.00004 149 4ZZ 0.00013 -0.00097 0.00039 0.00037 -0.00002 150 4XY -0.00109 0.00157 -0.00032 -0.00003 -0.00001 151 4XZ 0.00137 -0.00142 0.00038 0.00027 0.00002 152 4YZ -0.00147 0.00077 -0.00039 0.00030 0.00001 153 11 H 1S -0.00048 -0.00400 0.00561 0.00279 -0.00023 154 2S -0.00258 -0.00476 0.00198 0.00681 -0.00007 155 12 H 1S 0.00247 -0.00107 -0.00038 -0.00242 -0.00001 156 2S 0.00369 -0.00256 -0.00003 -0.00345 0.00001 157 13 H 1S 0.00067 0.00248 -0.00248 -0.00111 0.00014 158 2S 0.00097 0.00229 -0.00260 -0.00053 0.00017 159 14 H 1S -0.00037 -0.00060 -0.00188 0.00087 0.00003 160 2S -0.00253 -0.00209 -0.00183 0.00218 0.00002 161 15 H 1S -0.00286 -0.00106 -0.00083 -0.00129 -0.00023 162 2S 0.00241 -0.00313 0.00127 -0.00200 -0.00022 163 16 C 1S -0.00379 -0.00722 0.00986 0.00748 -0.00209 164 2S 0.01941 0.01939 -0.02673 -0.01863 0.00261 165 2PX -0.17327 -0.01489 0.07397 0.05265 0.01216 166 2PY 0.12131 0.07626 -0.00604 -0.08919 0.00643 167 2PZ 0.05313 0.05168 -0.09157 0.09076 0.00344 168 3S -0.03580 -0.01203 -0.01372 -0.01601 0.00242 169 3PX -0.00368 0.01094 -0.00474 -0.00208 0.00174 170 3PY -0.00611 -0.00669 0.02018 -0.03498 0.00160 171 3PZ -0.01343 0.00083 -0.03758 0.05970 0.00079 172 4XX 0.00238 -0.00255 -0.00261 -0.00130 0.00072 173 4YY 0.00153 0.00097 0.00484 -0.00071 -0.00057 174 4ZZ -0.00122 0.00012 0.00032 0.00365 -0.00023 175 4XY -0.01382 -0.00228 0.00144 0.00279 0.00042 176 4XZ -0.00836 -0.00111 0.00262 -0.00117 0.00020 177 4YZ 0.00325 0.00175 0.00040 0.00223 -0.00032 178 17 C 1S 0.00591 0.00420 -0.00489 -0.00239 0.00144 179 2S -0.00405 -0.00432 0.00844 0.00381 -0.00278 180 2PX 0.04065 0.03293 -0.01293 -0.00470 -0.00134 181 2PY -0.07345 -0.05295 0.03019 0.00106 -0.00601 182 2PZ -0.04414 -0.03339 -0.00299 0.03346 -0.00319 183 3S -0.03064 -0.02985 0.03563 0.01754 -0.00355 184 3PX -0.00468 -0.00436 0.01408 0.01168 0.00040 185 3PY -0.02817 -0.01461 0.01072 -0.00232 -0.00297 186 3PZ -0.01786 -0.00957 -0.00680 0.01764 -0.00159 187 4XX 0.00135 0.00088 -0.00024 -0.00028 0.00037 188 4YY -0.00033 -0.00153 0.00178 -0.00404 -0.00012 189 4ZZ -0.00027 0.00037 -0.00278 0.00359 0.00003 190 4XY -0.00648 -0.00253 0.00261 0.00248 0.00021 191 4XZ -0.00339 -0.00170 0.00223 0.00014 0.00011 192 4YZ -0.00118 -0.00056 -0.00207 0.00266 -0.00012 193 18 C 1S -0.01302 -0.00876 0.00450 0.00262 -0.00027 194 2S 0.02876 0.01719 -0.01159 -0.00693 0.00048 195 2PX -0.04174 -0.04410 0.00653 0.00233 -0.00003 196 2PY 0.05707 0.03291 -0.03696 0.00417 0.00076 197 2PZ 0.04058 0.00787 0.01037 -0.04509 0.00045 198 3S 0.02598 0.03154 -0.02689 -0.01546 -0.00033 199 3PX -0.02229 -0.01737 0.01290 0.00576 0.00026 200 3PY 0.01661 0.01777 -0.02269 0.00616 0.00017 201 3PZ 0.01642 0.00221 0.01025 -0.03194 0.00007 202 4XX 0.00120 0.00017 -0.00046 -0.00053 0.00015 203 4YY -0.00303 -0.00070 0.00100 0.00114 -0.00018 204 4ZZ -0.00131 -0.00084 0.00067 0.00012 -0.00006 205 4XY -0.00127 -0.00062 -0.00093 0.00131 0.00006 206 4XZ -0.00034 -0.00053 0.00158 -0.00260 0.00004 207 4YZ -0.00136 -0.00026 0.00079 0.00018 -0.00011 208 19 C 1S 0.00158 -0.00212 0.00173 0.00119 -0.00001 209 2S 0.00134 0.00630 -0.00568 -0.00383 0.00013 210 2PX -0.01795 0.00968 0.01576 0.00858 -0.00064 211 2PY 0.00234 0.03257 -0.02489 0.02986 -0.00030 212 2PZ 0.01125 0.00829 0.03497 -0.06146 0.00001 213 3S 0.00945 0.00285 -0.00656 -0.00385 0.00018 214 3PX -0.00566 0.01006 0.00502 0.00152 -0.00046 215 3PY 0.00056 0.01247 -0.01306 0.02109 -0.00011 216 3PZ 0.00718 0.00085 0.02425 -0.03866 0.00007 217 4XX 0.00116 0.00026 -0.00052 -0.00023 0.00008 218 4YY 0.00037 -0.00026 0.00008 0.00062 -0.00011 219 4ZZ -0.00022 -0.00008 0.00047 -0.00036 -0.00003 220 4XY -0.00283 -0.00064 0.00093 -0.00022 0.00011 221 4XZ -0.00187 0.00003 -0.00037 0.00128 0.00006 222 4YZ 0.00030 0.00006 0.00028 -0.00022 -0.00007 223 20 C 1S -0.01682 0.00209 0.00347 0.00246 0.00115 224 2S 0.03524 0.00014 -0.00786 -0.00545 -0.00241 225 2PX -0.08582 -0.00264 0.02482 0.01561 0.00420 226 2PY 0.03634 -0.02713 -0.01724 0.00963 -0.00233 227 2PZ 0.01957 -0.01527 0.01254 -0.03107 -0.00123 228 3S 0.05262 0.01721 -0.00498 -0.00751 -0.00365 229 3PX -0.03858 -0.00964 0.00854 0.00696 0.00219 230 3PY 0.02799 0.00045 -0.00990 0.00908 -0.00136 231 3PZ 0.01509 0.00002 0.01198 -0.02368 -0.00072 232 4XX -0.00264 -0.00147 0.00125 0.00080 0.00037 233 4YY 0.00001 0.00059 0.00090 -0.00270 -0.00008 234 4ZZ -0.00130 0.00063 -0.00159 0.00232 0.00002 235 4XY -0.00225 0.00042 0.00031 0.00062 0.00014 236 4XZ -0.00079 0.00015 0.00049 -0.00025 0.00006 237 4YZ 0.00017 0.00074 -0.00152 0.00144 -0.00010 238 21 C 1S 0.01736 -0.00005 0.00270 0.00100 -0.00263 239 2S -0.02740 0.00163 -0.00932 -0.00442 0.00589 240 2PX 0.11714 -0.02125 -0.03285 -0.02128 -0.01372 241 2PY -0.03373 0.01378 0.00302 -0.02533 -0.00058 242 2PZ -0.03604 0.01540 -0.02692 0.03433 0.00004 243 3S -0.06771 -0.01780 0.00306 0.00962 0.00813 244 3PX 0.01992 -0.01644 -0.01825 -0.01032 -0.00412 245 3PY 0.01249 0.01752 -0.00514 -0.02316 -0.00100 246 3PZ -0.00336 0.01516 -0.02114 0.01834 -0.00041 247 4XX 0.00232 0.00211 -0.00033 -0.00062 0.00022 248 4YY -0.00165 -0.00031 -0.00017 0.00009 -0.00026 249 4ZZ 0.00072 -0.00043 -0.00006 0.00010 -0.00025 250 4XY -0.00774 -0.00126 0.00017 0.00377 0.00039 251 4XZ -0.00371 -0.00113 0.00376 -0.00387 0.00020 252 4YZ -0.00132 0.00009 -0.00008 -0.00010 -0.00003 253 22 H 1S -0.03258 0.00670 -0.00868 -0.00426 0.00006 254 2S -0.02598 -0.00246 0.00378 0.00285 -0.00145 255 23 H 1S -0.03044 -0.00911 0.01075 0.00695 0.00171 256 2S -0.03283 -0.00828 0.01080 0.00705 0.00241 257 24 H 1S 0.00087 -0.00312 0.00374 0.00237 -0.00043 258 2S 0.01084 -0.00224 0.00169 0.00128 -0.00058 259 25 H 1S -0.03116 -0.00949 0.01311 0.00878 -0.00082 260 2S -0.03285 -0.01023 0.01379 0.00891 -0.00116 261 26 H 1S -0.01636 -0.00460 0.00737 0.00314 0.00188 262 2S -0.02438 -0.00545 0.01098 0.00922 0.00293 263 27 H 1S 0.12013 0.03023 0.09390 0.05803 -0.00852 264 2S 0.01842 0.01919 0.05284 0.03334 -0.00674 11 12 13 14 15 11 4YY 0.00121 12 4ZZ 0.00029 0.00079 13 4XY 0.00022 0.00019 0.00126 14 4XZ 0.00047 -0.00020 0.00026 0.00101 15 4YZ 0.00038 -0.00003 0.00048 -0.00006 0.00088 16 2 C 1S 0.00271 0.00162 -0.00059 0.00011 0.00096 17 2S -0.00606 -0.00373 0.00152 -0.00001 -0.00179 18 2PX -0.00982 -0.00755 0.00177 0.00293 -0.00269 19 2PY -0.00080 0.00064 -0.01189 -0.00172 -0.00206 20 2PZ -0.00196 0.00101 -0.00129 -0.01341 0.00105 21 3S -0.00800 -0.00260 0.00033 -0.00018 -0.00424 22 3PX -0.00368 -0.00273 0.00079 0.00124 -0.00216 23 3PY 0.00082 -0.00019 -0.00586 -0.00036 -0.00057 24 3PZ -0.00054 0.00065 0.00012 -0.00684 0.00066 25 4XX -0.00037 -0.00046 0.00028 0.00016 0.00026 26 4YY 0.00064 0.00018 -0.00018 0.00038 -0.00004 27 4ZZ 0.00011 0.00037 -0.00045 -0.00051 -0.00007 28 4XY 0.00026 0.00012 0.00053 0.00044 0.00016 29 4XZ 0.00037 -0.00013 0.00044 0.00052 0.00022 30 4YZ -0.00004 0.00011 0.00043 -0.00060 0.00023 31 3 H 1S -0.00176 0.00141 -0.00350 -0.00883 -0.00015 32 2S -0.00100 0.00201 -0.00286 -0.00665 0.00004 33 4 Br 1S 0.00006 0.00016 0.00027 0.00002 0.00000 34 2S 0.00005 -0.00065 -0.00155 0.00009 -0.00040 35 3S -0.00070 0.00021 0.00155 -0.00045 0.00099 36 4S -0.00145 0.00013 0.00259 -0.00079 0.00187 37 5S 0.00222 0.00037 -0.00244 0.00176 -0.00253 38 6S 0.00166 0.00152 0.00206 -0.00198 -0.00068 39 7PX 0.00045 -0.00000 -0.00069 0.00030 -0.00126 40 7PY -0.00082 -0.00097 0.00031 -0.00026 0.00051 41 7PZ 0.00034 -0.00063 -0.00082 0.00022 -0.00018 42 8PX -0.00156 0.00037 0.00376 -0.00206 0.00434 43 8PY 0.00004 0.00099 -0.00370 0.00347 -0.00116 44 8PZ -0.00212 0.00188 0.00371 -0.00232 0.00068 45 9PX 0.00304 -0.00067 -0.00751 0.00409 -0.00815 46 9PY 0.00042 -0.00138 0.00768 -0.00718 0.00200 47 9PZ 0.00431 -0.00335 -0.00717 0.00477 -0.00134 48 10PX 0.00302 -0.00017 -0.00625 0.00307 -0.00686 49 10PY 0.00012 -0.00147 0.00491 -0.00439 0.00132 50 10PZ 0.00389 -0.00276 -0.00449 0.00353 -0.00083 51 11XX 0.00029 -0.00015 -0.00092 0.00015 -0.00058 52 11YY 0.00035 -0.00013 -0.00058 -0.00014 -0.00008 53 11ZZ -0.00010 -0.00038 -0.00077 0.00041 -0.00035 54 11XY -0.00043 -0.00038 -0.00039 0.00026 -0.00028 55 11XZ 0.00003 0.00017 0.00001 -0.00046 0.00024 56 11YZ -0.00018 -0.00038 -0.00057 0.00047 -0.00036 57 12XX 0.00004 -0.00019 -0.00012 0.00026 -0.00005 58 12YY 0.00001 -0.00028 -0.00096 0.00129 -0.00057 59 12ZZ 0.00022 -0.00027 -0.00114 0.00008 -0.00032 60 12XY 0.00045 0.00010 0.00023 -0.00031 0.00037 61 12XZ -0.00005 -0.00016 -0.00003 0.00044 -0.00015 62 12YZ 0.00003 0.00010 0.00092 -0.00060 0.00040 63 5 C 1S -0.00107 -0.00070 -0.00166 -0.00076 -0.00024 64 2S 0.00197 0.00092 0.00314 0.00144 0.00070 65 2PX 0.00228 0.00013 0.00651 0.00171 0.00142 66 2PY 0.00147 0.00038 0.00568 0.00317 0.00143 67 2PZ 0.00090 -0.00021 0.00182 0.00161 -0.00009 68 3S 0.00403 -0.00013 0.00389 0.00277 0.00134 69 3PX 0.00244 0.00025 0.00244 0.00010 0.00127 70 3PY 0.00115 -0.00004 0.00194 0.00073 0.00117 71 3PZ 0.00039 -0.00055 -0.00061 0.00126 -0.00048 72 4XX -0.00025 -0.00017 0.00006 0.00007 -0.00008 73 4YY 0.00007 0.00004 -0.00003 0.00010 0.00001 74 4ZZ -0.00005 0.00006 -0.00025 -0.00029 -0.00003 75 4XY -0.00009 -0.00010 0.00025 0.00019 -0.00003 76 4XZ -0.00004 -0.00004 0.00018 -0.00011 0.00002 77 4YZ -0.00002 0.00005 0.00017 -0.00025 0.00008 78 6 C 1S 0.00007 -0.00008 0.00034 0.00048 -0.00002 79 2S -0.00006 0.00023 -0.00067 -0.00100 -0.00008 80 2PX 0.00107 0.00078 0.00002 -0.00078 0.00066 81 2PY -0.00039 0.00014 -0.00107 -0.00113 -0.00036 82 2PZ -0.00053 0.00048 -0.00131 -0.00160 0.00002 83 3S -0.00043 -0.00031 -0.00221 -0.00185 -0.00033 84 3PX 0.00061 0.00082 -0.00005 -0.00024 0.00036 85 3PY -0.00032 0.00011 -0.00041 0.00006 -0.00041 86 3PZ -0.00052 0.00038 -0.00101 -0.00097 -0.00001 87 4XX 0.00001 -0.00002 0.00010 0.00003 -0.00001 88 4YY -0.00001 -0.00002 0.00008 0.00013 0.00001 89 4ZZ 0.00001 0.00001 -0.00012 -0.00005 -0.00004 90 4XY 0.00003 -0.00001 0.00007 0.00005 -0.00000 91 4XZ 0.00008 0.00002 0.00016 0.00004 0.00005 92 4YZ 0.00002 0.00001 0.00013 0.00013 0.00004 93 7 C 1S -0.00005 0.00007 -0.00021 -0.00026 -0.00007 94 2S 0.00011 -0.00014 0.00056 0.00055 0.00007 95 2PX -0.00031 -0.00017 0.00024 0.00113 0.00017 96 2PY 0.00024 -0.00025 0.00102 0.00074 0.00003 97 2PZ 0.00006 -0.00010 0.00056 0.00015 -0.00012 98 3S 0.00037 0.00039 0.00088 0.00118 0.00007 99 3PX -0.00016 -0.00001 0.00011 0.00086 0.00013 100 3PY 0.00033 0.00018 0.00073 0.00048 0.00005 101 3PZ 0.00013 0.00001 0.00010 0.00009 -0.00008 102 4XX 0.00006 0.00003 0.00003 -0.00001 0.00003 103 4YY -0.00005 -0.00002 -0.00002 0.00001 -0.00003 104 4ZZ -0.00001 0.00002 -0.00007 -0.00005 -0.00000 105 4XY 0.00004 0.00002 0.00002 -0.00001 0.00002 106 4XZ -0.00003 -0.00000 -0.00004 -0.00001 -0.00000 107 4YZ -0.00002 0.00001 -0.00004 -0.00004 -0.00000 108 8 C 1S -0.00004 -0.00003 -0.00003 -0.00004 -0.00001 109 2S 0.00011 0.00007 0.00008 0.00009 0.00000 110 2PX -0.00092 -0.00033 -0.00045 0.00041 -0.00044 111 2PY 0.00067 0.00025 0.00051 -0.00028 0.00021 112 2PZ -0.00002 0.00007 -0.00013 0.00034 0.00006 113 3S 0.00020 0.00008 0.00060 0.00013 0.00024 114 3PX -0.00080 -0.00036 -0.00027 0.00030 -0.00031 115 3PY 0.00042 0.00009 0.00042 -0.00025 0.00029 116 3PZ 0.00003 0.00001 0.00008 0.00005 0.00010 117 4XX -0.00000 -0.00000 0.00001 0.00001 0.00000 118 4YY -0.00000 -0.00001 0.00004 0.00001 0.00000 119 4ZZ 0.00000 0.00001 -0.00002 -0.00002 0.00000 120 4XY -0.00001 -0.00000 0.00002 0.00002 0.00001 121 4XZ 0.00000 -0.00000 0.00001 -0.00002 -0.00000 122 4YZ -0.00001 0.00000 0.00002 0.00001 0.00002 123 9 C 1S -0.00002 0.00002 -0.00032 0.00006 -0.00011 124 2S 0.00004 0.00001 0.00075 -0.00007 0.00027 125 2PX -0.00015 -0.00008 0.00055 -0.00022 -0.00002 126 2PY 0.00000 -0.00002 0.00137 0.00013 0.00059 127 2PZ 0.00009 -0.00008 0.00038 -0.00029 0.00005 128 3S 0.00049 0.00030 0.00076 -0.00006 0.00010 129 3PX -0.00004 0.00005 0.00015 -0.00020 -0.00013 130 3PY 0.00035 0.00010 0.00064 0.00018 0.00023 131 3PZ 0.00017 0.00010 0.00067 -0.00023 0.00028 132 4XX 0.00005 0.00002 0.00001 -0.00003 0.00001 133 4YY -0.00006 -0.00003 -0.00008 0.00003 -0.00004 134 4ZZ 0.00001 0.00001 -0.00002 0.00000 -0.00001 135 4XY 0.00003 0.00001 -0.00002 -0.00002 -0.00000 136 4XZ 0.00005 0.00002 0.00005 -0.00000 0.00003 137 4YZ -0.00002 -0.00000 0.00004 0.00004 0.00001 138 10 C 1S -0.00005 -0.00002 0.00049 -0.00023 0.00023 139 2S -0.00000 0.00003 -0.00101 0.00054 -0.00052 140 2PX 0.00142 0.00048 -0.00032 -0.00037 -0.00013 141 2PY -0.00048 -0.00011 -0.00221 0.00081 -0.00093 142 2PZ 0.00005 0.00017 0.00091 0.00033 0.00029 143 3S -0.00016 0.00007 -0.00113 0.00010 0.00002 144 3PX 0.00116 0.00043 -0.00004 -0.00035 0.00004 145 3PY -0.00032 0.00020 -0.00085 0.00011 -0.00034 146 3PZ 0.00001 0.00003 0.00033 0.00071 -0.00023 147 4XX 0.00002 -0.00001 0.00017 0.00001 0.00004 148 4YY 0.00001 0.00003 0.00018 -0.00000 0.00005 149 4ZZ -0.00006 0.00002 -0.00020 -0.00005 -0.00004 150 4XY 0.00006 0.00002 0.00018 0.00001 0.00005 151 4XZ -0.00007 -0.00002 -0.00005 0.00000 -0.00001 152 4YZ -0.00003 -0.00000 0.00002 -0.00003 0.00001 153 11 H 1S -0.00013 0.00016 -0.00064 0.00016 -0.00025 154 2S -0.00026 0.00002 -0.00077 -0.00037 -0.00014 155 12 H 1S 0.00005 -0.00003 -0.00039 -0.00020 -0.00018 156 2S -0.00002 -0.00007 -0.00085 -0.00012 -0.00037 157 13 H 1S -0.00002 -0.00004 0.00012 0.00006 0.00007 158 2S -0.00008 -0.00010 0.00029 0.00007 0.00012 159 14 H 1S -0.00009 0.00010 -0.00046 -0.00026 0.00005 160 2S -0.00017 0.00013 -0.00074 -0.00051 -0.00002 161 15 H 1S 0.00004 0.00010 -0.00052 -0.00045 -0.00019 162 2S -0.00038 0.00025 -0.00054 -0.00080 -0.00008 163 16 C 1S -0.00050 0.00100 0.00493 0.00311 -0.00177 164 2S -0.00029 -0.00274 -0.00946 -0.00601 0.00301 165 2PX -0.00280 0.00204 0.00643 0.00433 -0.00586 166 2PY -0.01192 -0.00117 -0.00240 -0.00877 -0.00002 167 2PZ 0.00214 -0.00948 -0.00864 0.00654 -0.00621 168 3S -0.00089 -0.00076 -0.00976 -0.00573 -0.00018 169 3PX -0.00074 -0.00012 -0.00000 0.00061 -0.00129 170 3PY -0.00362 0.00186 0.00109 -0.00397 0.00076 171 3PZ 0.00335 -0.00428 -0.00407 0.00516 -0.00364 172 4XX -0.00069 -0.00025 -0.00010 -0.00004 -0.00043 173 4YY 0.00051 0.00021 0.00044 0.00018 0.00038 174 4ZZ 0.00023 0.00011 0.00036 0.00033 0.00001 175 4XY 0.00007 0.00020 0.00022 0.00011 -0.00029 176 4XZ -0.00005 0.00025 0.00006 0.00012 -0.00015 177 4YZ 0.00036 -0.00004 0.00002 0.00006 0.00040 178 17 C 1S -0.00168 -0.00066 -0.00025 -0.00027 -0.00099 179 2S 0.00364 0.00136 0.00045 0.00050 0.00220 180 2PX -0.00005 0.00021 -0.00024 -0.00013 -0.00047 181 2PY 0.00578 0.00436 0.00115 -0.00142 0.00651 182 2PZ 0.00764 -0.00229 -0.00230 0.00338 -0.00020 183 3S 0.00511 0.00229 0.00327 0.00220 0.00272 184 3PX 0.00025 0.00030 0.00120 0.00068 -0.00009 185 3PY 0.00217 0.00218 0.00159 -0.00054 0.00316 186 3PZ 0.00387 -0.00161 -0.00085 0.00193 -0.00059 187 4XX -0.00030 -0.00009 0.00012 0.00006 -0.00021 188 4YY -0.00009 0.00017 -0.00008 -0.00044 0.00027 189 4ZZ 0.00011 -0.00024 -0.00026 0.00024 -0.00018 190 4XY 0.00010 0.00010 0.00016 0.00012 0.00002 191 4XZ 0.00009 0.00002 0.00008 0.00006 -0.00002 192 4YZ 0.00030 -0.00013 -0.00031 0.00011 0.00003 193 18 C 1S 0.00058 0.00014 0.00009 0.00011 0.00040 194 2S -0.00138 -0.00051 -0.00034 -0.00028 -0.00080 195 2PX 0.00146 0.00010 0.00022 0.00022 0.00123 196 2PY -0.00179 -0.00062 -0.00077 0.00063 -0.00105 197 2PZ -0.00102 -0.00050 0.00089 -0.00173 -0.00051 198 3S -0.00132 -0.00084 -0.00164 -0.00122 -0.00046 199 3PX 0.00077 0.00031 0.00059 0.00048 0.00042 200 3PY -0.00057 -0.00040 -0.00095 0.00039 -0.00050 201 3PZ -0.00064 -0.00001 0.00060 -0.00158 0.00001 202 4XX -0.00015 -0.00005 0.00000 -0.00001 -0.00007 203 4YY 0.00019 0.00015 0.00006 -0.00001 0.00017 204 4ZZ 0.00014 -0.00003 -0.00003 0.00005 0.00000 205 4XY 0.00006 -0.00013 -0.00010 0.00009 -0.00008 206 4XZ -0.00018 0.00015 0.00012 -0.00019 0.00015 207 4YZ 0.00017 0.00002 0.00001 0.00005 0.00004 208 19 C 1S 0.00010 0.00012 0.00003 0.00002 -0.00001 209 2S -0.00017 -0.00028 -0.00016 -0.00011 0.00010 210 2PX 0.00043 0.00061 0.00030 0.00006 -0.00004 211 2PY 0.00161 -0.00111 -0.00131 0.00155 -0.00077 212 2PZ -0.00217 0.00215 0.00208 -0.00317 0.00214 213 3S -0.00047 -0.00036 0.00022 0.00002 -0.00002 214 3PX 0.00035 0.00016 -0.00006 -0.00011 0.00031 215 3PY 0.00101 -0.00075 -0.00058 0.00133 -0.00069 216 3PZ -0.00160 0.00154 0.00173 -0.00215 0.00146 217 4XX -0.00011 -0.00003 -0.00001 -0.00001 -0.00007 218 4YY 0.00011 -0.00001 0.00002 -0.00003 0.00003 219 4ZZ -0.00001 0.00004 -0.00003 0.00002 0.00004 220 4XY 0.00000 -0.00003 0.00001 -0.00002 -0.00001 221 4XZ -0.00002 0.00002 -0.00003 0.00004 0.00002 222 4YZ 0.00002 0.00004 -0.00000 0.00003 0.00005 223 20 C 1S -0.00040 -0.00008 -0.00000 -0.00001 -0.00036 224 2S 0.00073 0.00009 -0.00015 -0.00007 0.00074 225 2PX -0.00150 -0.00036 -0.00001 -0.00007 -0.00123 226 2PY 0.00123 -0.00061 0.00001 0.00013 -0.00016 227 2PZ -0.00118 0.00138 0.00009 0.00000 0.00127 228 3S 0.00151 -0.00021 -0.00084 -0.00049 0.00205 229 3PX -0.00100 -0.00004 0.00027 0.00010 -0.00102 230 3PY 0.00102 -0.00078 -0.00001 0.00024 0.00023 231 3PZ -0.00103 0.00109 0.00035 -0.00042 0.00128 232 4XX -0.00017 -0.00003 -0.00000 -0.00000 -0.00014 233 4YY -0.00005 0.00011 0.00013 -0.00017 0.00013 234 4ZZ 0.00010 -0.00010 -0.00013 0.00018 -0.00010 235 4XY -0.00002 -0.00006 -0.00008 0.00006 -0.00005 236 4XZ -0.00007 0.00003 0.00008 -0.00014 0.00004 237 4YZ 0.00013 -0.00006 -0.00007 0.00014 -0.00002 238 21 C 1S 0.00138 0.00028 0.00019 0.00012 0.00116 239 2S -0.00287 -0.00063 -0.00056 -0.00033 -0.00239 240 2PX 0.00581 0.00149 0.00151 0.00124 0.00432 241 2PY -0.00061 0.00113 0.00235 -0.00252 0.00141 242 2PZ 0.00230 -0.00221 -0.00307 0.00508 -0.00180 243 3S -0.00410 -0.00043 0.00179 0.00083 -0.00384 244 3PX 0.00168 0.00068 -0.00089 -0.00017 0.00056 245 3PY -0.00040 0.00042 0.00021 -0.00215 0.00101 246 3PZ 0.00129 -0.00135 -0.00259 0.00285 -0.00092 247 4XX -0.00018 -0.00014 -0.00036 -0.00026 0.00003 248 4YY 0.00023 0.00006 0.00011 0.00018 0.00007 249 4ZZ 0.00010 0.00006 0.00011 -0.00002 0.00008 250 4XY 0.00010 -0.00012 -0.00008 0.00019 -0.00021 251 4XZ -0.00029 0.00029 0.00022 -0.00029 0.00014 252 4YZ 0.00007 0.00006 0.00014 -0.00001 0.00007 253 22 H 1S 0.00051 0.00019 0.00090 0.00050 0.00010 254 2S 0.00165 0.00057 0.00163 0.00093 0.00103 255 23 H 1S -0.00079 -0.00025 -0.00005 -0.00003 -0.00059 256 2S -0.00101 -0.00026 0.00003 0.00003 -0.00082 257 24 H 1S -0.00004 0.00013 0.00012 0.00007 -0.00016 258 2S -0.00005 0.00018 0.00022 0.00012 -0.00018 259 25 H 1S 0.00117 0.00048 0.00014 0.00012 0.00064 260 2S 0.00171 0.00070 0.00038 0.00029 0.00096 261 26 H 1S -0.00056 -0.00020 0.00078 0.00046 -0.00039 262 2S -0.00125 -0.00035 0.00118 0.00054 -0.00080 263 27 H 1S 0.00916 -0.00102 0.00961 0.00564 0.01088 264 2S 0.00775 0.00137 0.00684 0.00371 0.00625 16 17 18 19 20 16 2 C 1S 2.05385 17 2S -0.05983 0.32601 18 2PX 0.00618 -0.00669 0.40745 19 2PY 0.00999 -0.02750 0.02164 0.35819 20 2PZ -0.01233 0.02252 -0.02349 0.07735 0.39643 21 3S -0.22472 0.34326 -0.06712 -0.03204 -0.00495 22 3PX -0.00136 -0.00440 0.15801 0.00837 0.00077 23 3PY 0.00646 -0.01197 0.00376 0.17250 0.02931 24 3PZ 0.00658 -0.00026 -0.00613 0.02187 0.19589 25 4XX -0.01548 -0.00366 0.01825 -0.00358 -0.00345 26 4YY -0.01466 -0.00686 -0.00994 0.00019 -0.01058 27 4ZZ -0.01641 -0.00270 -0.01079 0.01160 0.01371 28 4XY -0.00070 0.00185 -0.00248 -0.00765 -0.00754 29 4XZ 0.00143 -0.00310 0.00133 -0.00634 -0.00789 30 4YZ -0.00217 0.00514 -0.00551 -0.00823 0.01383 31 3 H 1S -0.05778 0.11238 -0.09969 0.10117 0.23969 32 2S -0.00544 0.01623 -0.06276 0.06801 0.15892 33 4 Br 1S -0.00077 -0.00114 0.00018 -0.00050 0.00121 34 2S 0.00454 0.00231 -0.00200 0.00550 -0.00909 35 3S -0.00461 0.00417 0.00334 -0.00924 0.01214 36 4S -0.00896 0.01168 0.00753 -0.01740 0.02126 37 5S 0.00143 -0.01685 -0.00928 0.03414 -0.03502 38 6S 0.03735 -0.06253 0.00083 -0.05583 0.04756 39 7PX -0.00092 0.00081 -0.00555 0.00302 0.00098 40 7PY 0.00760 -0.00131 0.00992 -0.03614 0.02588 41 7PZ -0.00475 0.00201 -0.00568 0.02475 -0.02465 42 8PX 0.00235 -0.00445 0.01698 -0.01023 -0.00190 43 8PY -0.01918 0.02467 -0.03017 0.11403 -0.08479 44 8PZ 0.01183 -0.01998 0.01704 -0.07867 0.07702 45 9PX -0.00360 0.00815 -0.03310 0.01826 0.00391 46 9PY 0.02992 -0.04646 0.05495 -0.20793 0.15432 47 9PZ -0.01773 0.03686 -0.03016 0.14164 -0.14216 48 10PX -0.00094 0.00305 -0.04587 0.00756 0.01176 49 10PY 0.00647 -0.00873 0.03576 -0.13847 0.08386 50 10PZ -0.00153 0.00900 -0.01725 0.07580 -0.10694 51 11XX -0.00030 0.00387 -0.00416 0.00807 -0.00757 52 11YY 0.00465 -0.00441 0.00024 0.00342 0.00427 53 11ZZ 0.00259 -0.00083 0.00041 -0.00117 -0.01226 54 11XY -0.00080 0.00151 0.00625 0.00266 -0.00311 55 11XZ 0.00041 -0.00125 -0.00463 -0.00237 0.00226 56 11YZ -0.00434 0.00878 -0.00211 0.00982 -0.00513 57 12XX 0.00049 -0.00235 0.00592 -0.00122 -0.00503 58 12YY -0.00571 0.01313 -0.00295 0.01287 -0.03173 59 12ZZ -0.00336 0.00623 -0.00391 0.02094 0.00295 60 12XY 0.00107 -0.00263 -0.01345 -0.00664 0.00773 61 12XZ -0.00058 0.00130 0.00957 0.00485 -0.00634 62 12YZ 0.00637 -0.01418 0.00493 -0.02332 0.01428 63 5 C 1S 0.01355 -0.02546 0.03289 0.05509 0.02575 64 2S -0.02643 0.04702 -0.06822 -0.11069 -0.05229 65 2PX -0.03662 0.07023 -0.05590 -0.15978 -0.05364 66 2PY -0.06169 0.13137 -0.14662 -0.17894 -0.11327 67 2PZ -0.01604 0.03499 -0.04011 -0.08013 -0.01407 68 3S 0.00641 0.00802 -0.04044 -0.10563 -0.06726 69 3PX 0.00786 -0.00523 -0.00595 -0.03569 0.00994 70 3PY 0.00899 0.00495 -0.01170 -0.03223 -0.00722 71 3PZ -0.00478 0.00387 0.00449 0.00305 -0.01502 72 4XX -0.00058 0.00120 0.00692 -0.00199 -0.00161 73 4YY -0.00391 0.00655 -0.00753 0.00102 -0.00269 74 4ZZ 0.00226 -0.00535 0.00339 0.00750 0.00837 75 4XY -0.00389 0.00794 -0.00093 -0.00797 -0.00534 76 4XZ -0.00168 0.00368 -0.00095 -0.00443 0.00261 77 4YZ -0.00308 0.00613 -0.00592 -0.00413 0.00591 78 6 C 1S -0.00389 0.00830 -0.00647 -0.01129 -0.01061 79 2S 0.00720 -0.01694 0.01266 0.02191 0.02318 80 2PX 0.00688 -0.02135 0.00184 0.01600 0.02336 81 2PY 0.00928 -0.01951 0.02187 0.02234 0.01711 82 2PZ 0.00883 -0.02226 0.01981 0.04863 0.02023 83 3S 0.00913 -0.02742 0.04066 0.06477 0.05492 84 3PX 0.00170 -0.00730 -0.01545 0.00558 0.00358 85 3PY 0.00066 -0.00122 -0.00363 -0.00087 -0.01341 86 3PZ 0.00433 -0.01208 0.01424 0.03720 0.02430 87 4XX -0.00088 0.00146 -0.00048 -0.00286 -0.00105 88 4YY -0.00141 0.00251 -0.00233 -0.00254 -0.00281 89 4ZZ 0.00100 -0.00210 0.00192 0.00254 0.00133 90 4XY -0.00063 0.00123 -0.00093 -0.00235 -0.00156 91 4XZ -0.00092 0.00139 -0.00167 -0.00350 -0.00188 92 4YZ -0.00183 0.00355 -0.00387 -0.00430 -0.00485 93 7 C 1S 0.00186 -0.00488 0.00444 0.00704 0.00548 94 2S -0.00566 0.01142 -0.01006 -0.01720 -0.01252 95 2PX -0.00573 0.01371 -0.01332 -0.00880 -0.01834 96 2PY -0.00826 0.01907 -0.01561 -0.02951 -0.01646 97 2PZ -0.00339 0.00552 -0.00647 -0.01441 -0.00321 98 3S -0.00412 0.01503 -0.03279 -0.03208 -0.03653 99 3PX -0.00278 0.00754 -0.01150 -0.00585 -0.01713 100 3PY -0.00374 0.00988 -0.01604 -0.02130 -0.01548 101 3PZ 0.00315 -0.00211 -0.00303 -0.00377 -0.00379 102 4XX -0.00009 -0.00039 -0.00042 0.00001 0.00068 103 4YY 0.00004 0.00025 0.00041 -0.00019 -0.00029 104 4ZZ 0.00046 -0.00119 0.00115 0.00204 0.00089 105 4XY 0.00027 -0.00035 -0.00043 -0.00002 0.00048 106 4XZ 0.00016 -0.00024 0.00034 0.00129 0.00024 107 4YZ 0.00029 -0.00048 0.00061 0.00149 0.00066 108 8 C 1S 0.00001 0.00019 0.00023 0.00166 0.00092 109 2S 0.00002 -0.00096 -0.00083 -0.00396 -0.00225 110 2PX -0.00119 0.00515 0.00277 0.00227 -0.01103 111 2PY 0.00055 -0.00563 -0.00321 -0.00950 0.00599 112 2PZ 0.00026 -0.00094 0.00014 0.00038 -0.00531 113 3S -0.00297 0.00318 -0.00307 -0.01215 -0.00117 114 3PX -0.00126 0.00435 0.00704 0.00185 -0.00714 115 3PY -0.00073 -0.00292 0.00124 -0.00314 0.00677 116 3PZ 0.00015 0.00001 0.00012 -0.00075 0.00039 117 4XX -0.00022 0.00043 -0.00054 -0.00014 -0.00031 118 4YY -0.00044 0.00092 -0.00057 -0.00110 -0.00047 119 4ZZ 0.00024 -0.00049 0.00041 0.00056 0.00045 120 4XY -0.00027 0.00065 -0.00057 -0.00037 -0.00039 121 4XZ -0.00012 0.00035 -0.00035 -0.00016 0.00014 122 4YZ -0.00024 0.00055 -0.00044 -0.00033 -0.00022 123 9 C 1S 0.00250 -0.00592 0.00567 0.00624 0.00117 124 2S -0.00634 0.01336 -0.01266 -0.01594 -0.00352 125 2PX -0.00705 0.01738 -0.01741 -0.00849 -0.00522 126 2PY -0.01074 0.02232 -0.01952 -0.02545 -0.00998 127 2PZ -0.00212 0.00579 -0.00472 -0.00593 0.00326 128 3S -0.00974 0.02501 -0.04138 -0.03205 -0.00390 129 3PX -0.00421 0.01198 -0.01641 -0.00594 -0.00143 130 3PY -0.00478 0.01244 -0.01902 -0.01858 -0.00390 131 3PZ -0.00286 0.00723 -0.00962 -0.01310 0.00473 132 4XX 0.00006 -0.00051 -0.00022 0.00031 0.00064 133 4YY 0.00030 -0.00044 0.00121 0.00125 -0.00030 134 4ZZ 0.00026 -0.00071 0.00047 0.00010 0.00001 135 4XY 0.00026 -0.00043 0.00001 0.00102 0.00067 136 4XZ -0.00017 0.00024 -0.00076 -0.00081 -0.00020 137 4YZ -0.00043 0.00100 -0.00078 -0.00092 -0.00143 138 10 C 1S -0.00531 0.01184 -0.01000 -0.01015 0.00103 139 2S 0.00962 -0.02386 0.02111 0.02128 -0.00530 140 2PX 0.01078 -0.02823 0.00974 0.01291 0.01927 141 2PY 0.01656 -0.03606 0.03694 0.02827 0.00113 142 2PZ -0.00397 0.00733 -0.00894 -0.01577 -0.02100 143 3S 0.02789 -0.05091 0.05225 0.04871 0.01024 144 3PX 0.00529 -0.01099 -0.01123 0.00383 0.01399 145 3PY 0.00588 -0.00686 -0.00026 0.00535 0.00468 146 3PZ -0.00859 0.01221 -0.01723 -0.02104 -0.02964 147 4XX -0.00107 0.00183 -0.00089 -0.00393 -0.00055 148 4YY -0.00203 0.00430 -0.00527 -0.00568 -0.00126 149 4ZZ 0.00191 -0.00388 0.00427 0.00585 0.00152 150 4XY -0.00080 0.00177 -0.00218 -0.00496 -0.00024 151 4XZ -0.00012 0.00041 0.00024 0.00107 -0.00056 152 4YZ -0.00035 0.00041 0.00006 0.00065 0.00019 153 11 H 1S 0.00737 -0.01820 0.01656 0.01826 -0.00491 154 2S 0.00666 -0.01528 0.02050 0.02757 0.01206 155 12 H 1S 0.00339 -0.00711 0.00709 0.00722 0.00737 156 2S 0.00615 -0.01242 0.01286 0.01711 0.00797 157 13 H 1S -0.00178 0.00485 -0.00272 -0.00141 -0.00164 158 2S -0.00326 0.00790 -0.00383 -0.00354 -0.00183 159 14 H 1S 0.00288 -0.00563 0.00602 0.01253 0.00433 160 2S 0.00600 -0.01092 0.01049 0.02129 0.01005 161 15 H 1S 0.00644 -0.01425 0.01250 0.01086 0.01927 162 2S 0.00703 -0.01543 0.01938 0.01866 0.03218 163 16 C 1S -0.00290 0.00732 0.01427 -0.00551 -0.00525 164 2S 0.00658 -0.01498 -0.03203 0.01234 0.01001 165 2PX -0.01423 0.03324 0.06169 -0.01340 -0.01582 166 2PY 0.00113 -0.00707 -0.02299 0.00375 0.01743 167 2PZ 0.00401 -0.01208 -0.01266 0.00579 -0.01300 168 3S -0.00287 -0.00452 -0.03108 0.04787 0.04040 169 3PX 0.00551 -0.00384 0.00044 -0.01330 -0.02087 170 3PY -0.00583 0.00879 0.00432 0.01546 0.03255 171 3PZ -0.00102 -0.00054 0.00397 0.01502 -0.00862 172 4XX -0.00210 0.00396 0.00984 -0.00099 -0.00102 173 4YY 0.00094 -0.00157 -0.00424 0.00062 -0.00185 174 4ZZ 0.00024 -0.00031 -0.00060 -0.00085 0.00071 175 4XY -0.00032 0.00099 0.00087 -0.00022 0.00105 176 4XZ -0.00019 0.00052 -0.00019 0.00150 -0.00202 177 4YZ 0.00082 -0.00155 -0.00293 -0.00069 0.00060 178 17 C 1S -0.00138 0.00202 0.00508 -0.00220 -0.00006 179 2S 0.00313 -0.00490 -0.01187 0.00461 -0.00046 180 2PX -0.00151 0.00058 0.00119 -0.01026 -0.00199 181 2PY 0.00400 -0.00623 -0.01747 -0.00116 0.00834 182 2PZ 0.00339 -0.00497 -0.01128 0.00823 -0.01554 183 3S 0.00157 0.00203 -0.00800 0.00911 0.00349 184 3PX -0.00413 0.00664 0.01287 0.00418 0.00637 185 3PY 0.00101 -0.00351 -0.00642 -0.00321 0.00696 186 3PZ 0.00113 -0.00267 -0.00572 0.00319 -0.00772 187 4XX -0.00043 0.00087 0.00156 -0.00036 -0.00037 188 4YY 0.00005 -0.00024 -0.00089 0.00028 0.00093 189 4ZZ 0.00006 -0.00030 -0.00015 0.00005 -0.00058 190 4XY -0.00021 0.00059 0.00127 0.00028 0.00003 191 4XZ -0.00011 0.00034 0.00055 0.00050 -0.00026 192 4YZ 0.00018 -0.00046 -0.00065 0.00042 -0.00017 193 18 C 1S 0.00034 -0.00021 -0.00074 0.00097 -0.00012 194 2S -0.00063 0.00059 0.00136 -0.00151 0.00043 195 2PX 0.00087 0.00126 -0.00054 0.00402 -0.00016 196 2PY -0.00045 0.00006 0.00169 -0.00273 -0.00151 197 2PZ -0.00087 0.00270 0.00037 -0.00018 0.00304 198 3S 0.00240 -0.00743 -0.01042 -0.00858 -0.00300 199 3PX 0.00027 0.00178 0.00076 0.00193 -0.00148 200 3PY 0.00054 -0.00209 -0.00195 -0.00397 -0.00271 201 3PZ -0.00009 0.00074 -0.00150 -0.00122 0.00155 202 4XX -0.00002 0.00008 0.00024 0.00032 0.00013 203 4YY 0.00010 -0.00024 -0.00038 -0.00028 0.00013 204 4ZZ 0.00008 -0.00011 -0.00028 0.00024 -0.00031 205 4XY 0.00003 -0.00002 0.00006 0.00037 -0.00047 206 4XZ -0.00007 0.00017 0.00014 -0.00023 0.00095 207 4YZ 0.00003 -0.00008 -0.00017 -0.00007 -0.00027 208 19 C 1S -0.00006 0.00016 0.00013 -0.00067 -0.00033 209 2S 0.00029 -0.00071 -0.00095 0.00157 0.00058 210 2PX -0.00045 -0.00111 0.00025 -0.00223 -0.00004 211 2PY 0.00083 -0.00357 -0.00157 0.00182 -0.00677 212 2PZ -0.00129 0.00242 0.00035 -0.00290 0.01368 213 3S -0.00064 0.00174 0.00382 0.00344 0.00329 214 3PX 0.00196 -0.00399 -0.00682 -0.00240 -0.00200 215 3PY 0.00018 -0.00050 0.00137 0.00149 -0.00497 216 3PZ -0.00109 0.00266 0.00217 -0.00272 0.01061 217 4XX -0.00009 0.00017 0.00033 -0.00016 -0.00003 218 4YY 0.00014 -0.00025 -0.00044 -0.00004 -0.00003 219 4ZZ 0.00004 -0.00011 -0.00024 0.00003 -0.00001 220 4XY -0.00011 0.00023 0.00045 0.00021 0.00003 221 4XZ -0.00004 0.00004 0.00027 0.00002 0.00000 222 4YZ 0.00004 -0.00008 -0.00022 0.00001 0.00002 223 20 C 1S -0.00111 0.00198 0.00527 -0.00031 -0.00041 224 2S 0.00217 -0.00426 -0.01087 0.00072 0.00115 225 2PX -0.00462 0.00749 0.01882 -0.00004 -0.00126 226 2PY 0.00283 -0.00356 -0.01050 0.00019 -0.00110 227 2PZ 0.00035 -0.00018 -0.00662 0.00056 0.00394 228 3S 0.01209 -0.02026 -0.04693 -0.00099 -0.00499 229 3PX -0.00596 0.00993 0.02347 -0.00052 0.00156 230 3PY 0.00435 -0.00587 -0.01306 -0.00137 -0.00313 231 3PZ 0.00149 -0.00188 -0.00813 -0.00118 0.00261 232 4XX -0.00024 0.00075 0.00155 -0.00030 -0.00035 233 4YY -0.00000 -0.00005 -0.00020 -0.00005 0.00083 234 4ZZ 0.00000 -0.00013 0.00004 0.00028 -0.00066 235 4XY -0.00016 0.00015 0.00034 0.00018 -0.00027 236 4XZ -0.00008 0.00011 0.00024 -0.00018 0.00045 237 4YZ 0.00011 -0.00028 -0.00042 0.00026 -0.00043 238 21 C 1S 0.00240 -0.00569 -0.01180 0.00074 0.00083 239 2S -0.00550 0.01234 0.02552 -0.00099 -0.00209 240 2PX 0.01077 -0.02111 -0.04619 0.00349 0.00458 241 2PY -0.00121 -0.00005 0.00247 0.00004 0.01118 242 2PZ -0.00037 -0.00244 0.00010 0.00821 -0.01433 243 3S -0.01525 0.03049 0.07438 -0.00818 -0.00051 244 3PX -0.00168 -0.00203 -0.00871 0.01050 0.00902 245 3PY 0.00681 -0.01086 -0.02222 -0.00129 0.00191 246 3PZ 0.00414 -0.00760 -0.01375 0.00547 -0.01234 247 4XX 0.00054 -0.00113 -0.00283 0.00026 0.00035 248 4YY -0.00011 0.00003 0.00048 0.00006 -0.00031 249 4ZZ 0.00004 -0.00026 -0.00023 -0.00009 0.00017 250 4XY -0.00039 0.00103 0.00300 -0.00003 -0.00063 251 4XZ -0.00037 0.00090 0.00171 -0.00022 0.00069 252 4YZ -0.00009 0.00020 0.00061 -0.00024 0.00013 253 22 H 1S -0.00211 0.00263 0.00911 0.00040 0.00022 254 2S -0.00242 0.00308 0.00954 -0.00098 0.00025 255 23 H 1S -0.00181 0.00346 0.00742 -0.00034 -0.00098 256 2S -0.00213 0.00455 0.01082 -0.00083 -0.00175 257 24 H 1S 0.00004 -0.00039 -0.00089 -0.00097 -0.00003 258 2S -0.00028 0.00038 0.00014 -0.00147 0.00038 259 25 H 1S 0.00040 -0.00123 -0.00157 -0.00014 -0.00030 260 2S 0.00063 -0.00130 -0.00238 -0.00128 -0.00128 261 26 H 1S 0.00016 0.00094 0.00359 0.00513 0.00077 262 2S -0.00307 0.00386 0.01462 0.00806 0.00527 263 27 H 1S 0.01261 -0.02822 -0.04084 -0.01752 -0.01281 264 2S 0.01480 -0.02698 -0.06355 -0.03518 -0.01658 21 22 23 24 25 21 3S 0.45413 22 3PX -0.02288 0.08075 23 3PY -0.02766 0.00883 0.09844 24 3PZ -0.02609 0.00612 0.01156 0.10611 25 4XX -0.00743 0.00446 -0.00245 -0.00175 0.00184 26 4YY -0.00501 -0.00183 0.00278 -0.00358 -0.00071 27 4ZZ 0.00118 -0.00352 0.00413 0.00536 -0.00073 28 4XY -0.00002 -0.00137 -0.00385 -0.00339 0.00025 29 4XZ -0.00363 0.00032 -0.00245 -0.00388 0.00039 30 4YZ 0.00431 -0.00130 -0.00338 0.00686 -0.00022 31 3 H 1S 0.12354 -0.03167 0.04422 0.10832 -0.00841 32 2S 0.02152 -0.01775 0.02537 0.07032 -0.00571 33 4 Br 1S 0.01723 0.00154 -0.00652 -0.00270 0.00063 34 2S -0.08799 -0.00657 0.02901 0.01368 -0.00356 35 3S 0.06978 0.00305 -0.01559 -0.01077 0.00339 36 4S 0.11443 0.00396 -0.02109 -0.01773 0.00576 37 5S -0.02960 0.00428 -0.00627 -0.00340 -0.00409 38 6S -0.09007 0.00940 -0.04672 0.04202 -0.00026 39 7PX -0.00089 0.00552 0.00374 -0.00421 -0.00136 40 7PY -0.07417 -0.00410 -0.00334 0.03761 0.00277 41 7PZ 0.03215 0.00933 0.02698 -0.01569 -0.00168 42 8PX 0.00460 -0.00736 -0.00190 0.00359 0.00390 43 8PY 0.10154 -0.01243 0.03341 -0.07074 -0.00480 44 8PZ -0.01984 -0.00718 -0.07947 0.02998 0.00254 45 9PX -0.00880 0.00919 -0.00053 -0.00236 -0.00702 46 9PY -0.13672 0.03149 -0.06781 0.11191 0.00790 47 9PZ 0.00350 0.00540 0.14167 -0.04869 -0.00387 48 10PX -0.00756 0.00192 -0.00434 0.00221 -0.00696 49 10PY -0.07585 0.01923 -0.03733 0.06708 0.00570 50 10PZ -0.02357 0.00904 0.09686 -0.03110 -0.00227 51 11XX -0.02283 -0.00104 0.01982 0.00126 -0.00209 52 11YY -0.05545 0.00083 0.01333 0.01786 -0.00148 53 11ZZ -0.03779 -0.00681 -0.00043 -0.00113 -0.00150 54 11XY 0.00312 0.00585 0.00158 -0.00531 0.00010 55 11XZ 0.00188 -0.00419 -0.00197 0.00187 -0.00021 56 11YZ 0.01791 -0.00546 0.01173 -0.00410 -0.00064 57 12XX -0.01410 0.00124 0.00166 0.00015 -0.00020 58 12YY 0.00872 -0.00304 0.00770 -0.01523 -0.00103 59 12ZZ -0.00404 -0.00117 0.01454 0.00358 -0.00140 60 12XY -0.00172 -0.00554 -0.00216 0.00381 -0.00019 61 12XZ -0.00144 0.00397 0.00248 -0.00271 0.00034 62 12YZ -0.01719 0.00211 -0.01198 0.00818 0.00077 63 5 C 1S -0.00355 -0.00095 0.01101 0.00583 -0.00003 64 2S 0.00656 -0.00867 -0.02743 -0.01363 -0.00103 65 2PX 0.12225 0.01524 -0.06255 -0.01475 -0.01326 66 2PY 0.16330 -0.08431 -0.09670 -0.06872 0.00176 67 2PZ 0.04424 -0.03477 -0.04655 0.01058 0.00080 68 3S -0.04802 0.00629 -0.00845 -0.01082 0.00022 69 3PX -0.00545 0.02813 0.00094 0.01859 -0.00773 70 3PY -0.02633 -0.01232 -0.01198 -0.00179 0.00406 71 3PZ -0.00366 0.00216 0.00472 -0.00545 0.00048 72 4XX 0.00217 0.00140 -0.00209 -0.00128 0.00049 73 4YY 0.01190 -0.00359 0.00006 -0.00201 -0.00057 74 4ZZ -0.00772 0.00208 0.00318 0.00413 0.00003 75 4XY 0.00914 -0.00098 -0.00374 -0.00286 0.00015 76 4XZ 0.00412 -0.00008 -0.00228 0.00210 -0.00003 77 4YZ 0.00815 -0.00251 -0.00229 0.00206 -0.00035 78 6 C 1S 0.01743 -0.00622 -0.00933 -0.00682 -0.00015 79 2S -0.02095 0.01006 0.01068 0.01270 0.00020 80 2PX -0.03599 0.03023 0.02869 0.00420 -0.00702 81 2PY -0.08381 0.02796 0.02615 0.01419 0.00429 82 2PZ -0.05450 0.02439 0.03701 0.00090 0.00035 83 3S -0.05280 0.02833 0.03847 0.02712 0.00076 84 3PX 0.00251 0.00750 0.00868 -0.00673 -0.00531 85 3PY -0.01349 -0.00054 -0.00169 -0.00602 0.00215 86 3PZ -0.02558 0.01269 0.01813 0.00524 -0.00031 87 4XX 0.00294 0.00057 -0.00143 0.00006 -0.00021 88 4YY 0.00499 -0.00299 -0.00242 -0.00226 0.00008 89 4ZZ -0.00664 0.00225 0.00299 0.00120 0.00012 90 4XY 0.00272 -0.00011 -0.00147 -0.00052 -0.00009 91 4XZ 0.00283 0.00093 -0.00095 -0.00047 -0.00049 92 4YZ 0.00423 -0.00275 -0.00231 -0.00299 0.00015 93 7 C 1S -0.01247 0.00591 0.00574 0.00234 0.00000 94 2S 0.03084 -0.01210 -0.01498 -0.00782 -0.00017 95 2PX 0.04065 -0.04173 -0.01865 -0.02328 0.00139 96 2PY 0.06466 -0.01450 -0.03056 0.00602 -0.00105 97 2PZ 0.03467 -0.00970 -0.01844 -0.01233 -0.00028 98 3S 0.03946 -0.02156 -0.02511 -0.02127 -0.00117 99 3PX 0.01913 -0.02675 -0.01097 -0.02053 0.00122 100 3PY 0.03229 -0.00454 -0.01725 -0.00097 -0.00156 101 3PZ 0.00590 -0.00306 -0.00476 -0.00380 -0.00008 102 4XX 0.00033 0.00108 0.00056 0.00029 -0.00035 103 4YY -0.00029 -0.00109 -0.00060 -0.00001 0.00036 104 4ZZ -0.00340 0.00131 0.00159 0.00069 0.00000 105 4XY 0.00102 0.00027 -0.00003 0.00021 -0.00022 106 4XZ -0.00052 -0.00067 0.00059 -0.00003 0.00007 107 4YZ -0.00040 0.00055 0.00076 0.00056 -0.00000 108 8 C 1S 0.00345 -0.00034 0.00123 0.00000 0.00010 109 2S -0.00318 -0.00008 -0.00457 -0.00121 -0.00021 110 2PX -0.00532 -0.03419 -0.00956 -0.01592 0.00533 111 2PY 0.01068 0.01769 -0.00652 0.00116 -0.00355 112 2PZ 0.00481 -0.00792 -0.01057 0.00871 -0.00041 113 3S 0.00474 -0.00181 -0.01072 -0.00134 -0.00035 114 3PX -0.00490 -0.02183 -0.00553 -0.00987 0.00439 115 3PY 0.00779 0.01384 -0.00028 0.00418 -0.00245 116 3PZ 0.00343 -0.00325 -0.00534 0.00417 -0.00021 117 4XX 0.00091 -0.00087 -0.00008 -0.00043 0.00000 118 4YY 0.00264 -0.00014 -0.00076 -0.00026 -0.00001 119 4ZZ -0.00190 0.00057 0.00068 0.00049 0.00001 120 4XY 0.00201 -0.00101 -0.00050 -0.00064 -0.00000 121 4XZ 0.00072 -0.00005 -0.00010 0.00086 -0.00003 122 4YZ 0.00171 -0.00055 -0.00041 -0.00056 -0.00001 123 9 C 1S -0.01427 0.00315 0.00348 0.00327 0.00023 124 2S 0.03225 -0.00793 -0.01049 -0.00612 -0.00057 125 2PX 0.03969 -0.02245 -0.00850 -0.00344 0.00039 126 2PY 0.07566 -0.00827 -0.01955 -0.02746 -0.00139 127 2PZ 0.00197 0.00718 0.00922 -0.00644 0.00002 128 3S 0.04414 -0.01699 -0.01650 -0.00527 -0.00196 129 3PX 0.01815 -0.01672 -0.00584 0.00190 0.00046 130 3PY 0.03606 -0.00510 -0.01211 -0.01173 -0.00163 131 3PZ 0.01107 -0.00224 -0.00515 -0.00059 -0.00037 132 4XX -0.00026 0.00112 0.00073 0.00109 -0.00030 133 4YY -0.00117 -0.00048 0.00052 -0.00090 0.00036 134 4ZZ -0.00211 0.00030 -0.00014 0.00029 0.00001 135 4XY 0.00037 0.00058 0.00084 0.00048 -0.00017 136 4XZ 0.00180 0.00083 -0.00061 0.00012 -0.00028 137 4YZ 0.00227 -0.00157 -0.00145 -0.00132 0.00009 138 10 C 1S 0.01664 -0.00358 -0.00382 0.00023 -0.00069 139 2S -0.02345 0.00577 0.00464 -0.00557 0.00144 140 2PX -0.04849 0.03056 0.01931 0.04152 -0.00642 141 2PY -0.10274 0.00478 0.01317 0.01121 0.00655 142 2PZ 0.01707 -0.00278 -0.02352 -0.02015 -0.00151 143 3S -0.06743 0.01735 0.01803 0.00784 0.00275 144 3PX -0.00612 0.01198 0.00610 0.02363 -0.00529 145 3PY -0.02346 -0.01127 -0.00450 0.00078 0.00283 146 3PZ 0.02588 -0.00875 -0.01611 -0.02024 -0.00069 147 4XX 0.00333 0.00092 -0.00131 -0.00018 -0.00033 148 4YY 0.00494 -0.00355 -0.00282 -0.00062 0.00015 149 4ZZ -0.00664 0.00234 0.00257 0.00088 0.00008 150 4XY 0.00308 -0.00017 -0.00217 -0.00006 -0.00022 151 4XZ 0.00120 -0.00116 -0.00070 -0.00120 0.00027 152 4YZ 0.00354 -0.00008 -0.00078 -0.00059 -0.00026 153 11 H 1S -0.02504 0.00780 -0.00226 -0.00521 -0.00003 154 2S -0.02593 0.01177 0.00586 0.00396 -0.00027 155 12 H 1S -0.02811 0.00935 0.01227 0.00719 0.00041 156 2S -0.03492 0.01106 0.01659 0.00757 0.00064 157 13 H 1S 0.00636 -0.00087 0.00206 0.00021 0.00003 158 2S 0.01769 -0.00398 -0.00090 -0.00150 0.00005 159 14 H 1S -0.02563 0.00899 0.01364 0.00720 0.00007 160 2S -0.03225 0.01137 0.01749 0.00932 0.00013 161 15 H 1S -0.02929 0.01225 0.00755 0.01389 0.00038 162 2S -0.03088 0.01288 0.00816 0.01851 0.00038 163 16 C 1S 0.00127 0.00689 -0.00363 -0.00205 0.00014 164 2S -0.00563 -0.01447 0.01035 0.00470 -0.00025 165 2PX 0.07729 0.06108 -0.00779 -0.00309 -0.00141 166 2PY 0.04015 -0.00339 -0.00468 0.00813 0.00074 167 2PZ 0.01717 0.00663 0.01146 -0.01671 -0.00046 168 3S -0.00348 -0.01868 0.01863 0.01382 -0.00078 169 3PX 0.00504 0.00672 -0.00343 -0.00698 -0.00083 170 3PY 0.00858 0.00022 0.00259 0.01684 -0.00023 171 3PZ -0.00020 0.00598 0.01275 -0.00936 -0.00065 172 4XX 0.00386 0.00388 -0.00067 -0.00050 0.00039 173 4YY -0.00264 -0.00210 0.00033 -0.00042 -0.00009 174 4ZZ -0.00039 0.00016 -0.00027 -0.00007 -0.00004 175 4XY 0.00231 0.00182 -0.00003 0.00104 -0.00020 176 4XZ 0.00181 0.00082 0.00066 -0.00117 -0.00017 177 4YZ -0.00202 -0.00113 0.00016 0.00006 0.00001 178 17 C 1S 0.01040 0.00305 -0.00346 -0.00202 -0.00015 179 2S -0.01995 -0.00631 0.00718 0.00346 0.00030 180 2PX 0.02372 0.00722 -0.00574 -0.00199 -0.00077 181 2PY -0.04388 -0.01797 0.00177 0.00310 -0.00095 182 2PZ -0.03147 -0.01498 0.00596 -0.00075 -0.00101 183 3S -0.02751 -0.00898 0.00654 0.00602 0.00090 184 3PX 0.01089 0.00466 -0.00033 0.00127 0.00036 185 3PY -0.01746 -0.00310 0.00145 0.00274 -0.00152 186 3PZ -0.01359 -0.00504 0.00348 0.00209 -0.00128 187 4XX 0.00136 0.00119 0.00010 0.00005 0.00006 188 4YY -0.00098 -0.00141 -0.00040 0.00069 0.00005 189 4ZZ 0.00038 0.00009 0.00012 -0.00092 -0.00002 190 4XY -0.00009 0.00095 0.00028 0.00008 0.00001 191 4XZ -0.00017 0.00010 0.00009 0.00017 0.00000 192 4YZ -0.00106 -0.00038 0.00056 -0.00036 -0.00002 193 18 C 1S -0.00557 -0.00198 0.00049 0.00014 -0.00000 194 2S 0.00935 0.00353 0.00009 0.00026 0.00008 195 2PX -0.03045 -0.01008 0.00501 0.00263 -0.00033 196 2PY 0.01027 0.00890 0.00649 -0.00347 -0.00003 197 2PZ 0.00126 -0.00610 -0.00269 0.01313 0.00021 198 3S 0.00986 0.00408 -0.00195 -0.00130 -0.00153 199 3PX -0.00674 -0.00259 0.00055 -0.00020 0.00033 200 3PY 0.00538 0.00602 0.00253 -0.00379 -0.00050 201 3PZ -0.00061 -0.00462 -0.00310 0.00798 -0.00006 202 4XX -0.00012 0.00007 0.00027 0.00016 0.00004 203 4YY -0.00035 0.00001 -0.00017 -0.00015 -0.00004 204 4ZZ -0.00048 -0.00043 -0.00004 -0.00003 -0.00002 205 4XY -0.00042 -0.00004 0.00035 -0.00019 -0.00001 206 4XZ 0.00006 -0.00010 -0.00027 0.00049 0.00003 207 4YZ -0.00011 -0.00004 -0.00008 0.00001 -0.00003 208 19 C 1S -0.00076 -0.00082 -0.00121 -0.00078 -0.00010 209 2S 0.00129 0.00185 0.00311 0.00177 0.00011 210 2PX 0.01741 0.00467 -0.00723 -0.00359 0.00011 211 2PY 0.01606 0.01241 0.00634 -0.00459 -0.00015 212 2PZ 0.01080 -0.00069 -0.00555 0.01250 0.00051 213 3S 0.00126 0.00074 0.00306 0.00264 0.00073 214 3PX 0.00701 0.00059 -0.00306 -0.00226 -0.00025 215 3PY 0.00780 0.00601 0.00307 -0.00393 0.00009 216 3PZ 0.00583 -0.00119 -0.00474 0.00878 0.00047 217 4XX 0.00046 0.00016 -0.00011 -0.00007 -0.00001 218 4YY -0.00087 -0.00054 -0.00012 0.00022 0.00000 219 4ZZ 0.00004 -0.00010 -0.00006 -0.00034 -0.00000 220 4XY 0.00067 0.00040 -0.00002 0.00021 0.00000 221 4XZ 0.00058 0.00062 0.00017 -0.00040 -0.00000 222 4YZ -0.00022 -0.00011 0.00007 -0.00018 0.00001 223 20 C 1S 0.01021 0.00594 -0.00084 -0.00031 0.00004 224 2S -0.01877 -0.01100 0.00236 0.00118 -0.00003 225 2PX 0.04361 0.02327 -0.00643 -0.00454 0.00002 226 2PY -0.04016 -0.02205 0.00023 0.00158 -0.00034 227 2PZ -0.01464 -0.01125 -0.00057 -0.00363 -0.00003 228 3S -0.02957 -0.02671 0.00127 -0.00314 -0.00081 229 3PX 0.02027 0.01518 -0.00274 -0.00029 0.00039 230 3PY -0.01577 -0.01185 -0.00017 -0.00027 -0.00003 231 3PZ -0.00369 -0.00600 -0.00116 -0.00213 0.00010 232 4XX 0.00086 0.00086 -0.00024 -0.00015 -0.00000 233 4YY 0.00052 -0.00010 -0.00025 0.00076 0.00002 234 4ZZ 0.00067 0.00053 0.00031 -0.00072 -0.00002 235 4XY 0.00134 0.00082 0.00015 -0.00032 -0.00001 236 4XZ 0.00050 0.00029 -0.00019 0.00050 0.00001 237 4YZ -0.00010 0.00009 0.00041 -0.00041 -0.00002 238 21 C 1S -0.01238 -0.00917 -0.00088 -0.00145 -0.00003 239 2S 0.02556 0.01987 0.00255 0.00270 -0.00005 240 2PX -0.08920 -0.05418 0.00427 0.00147 0.00007 241 2PY 0.02513 0.00857 -0.00478 0.01035 0.00035 242 2PZ 0.02245 0.01358 0.00802 -0.01886 -0.00042 243 3S 0.04887 0.04463 -0.00376 0.00316 0.00159 244 3PX -0.02767 -0.01495 0.00581 0.00389 -0.00060 245 3PY -0.00174 -0.00923 -0.00181 0.00499 -0.00034 246 3PZ 0.00515 0.00021 0.00597 -0.01409 -0.00055 247 4XX 0.00011 -0.00104 0.00009 -0.00003 -0.00008 248 4YY -0.00001 0.00033 0.00013 -0.00021 0.00002 249 4ZZ -0.00100 -0.00052 -0.00020 0.00014 0.00003 250 4XY 0.00263 0.00240 0.00002 -0.00031 0.00001 251 4XZ 0.00172 0.00105 -0.00053 0.00053 0.00005 252 4YZ 0.00036 0.00055 0.00004 0.00039 0.00001 253 22 H 1S 0.01872 0.01167 0.00062 0.00119 0.00013 254 2S 0.00864 0.00755 -0.00109 0.00037 0.00039 255 23 H 1S 0.01085 0.00625 -0.00276 -0.00219 -0.00004 256 2S 0.01273 0.00892 -0.00227 -0.00176 0.00001 257 24 H 1S -0.00096 -0.00254 -0.00293 -0.00153 0.00004 258 2S -0.00264 -0.00291 -0.00247 -0.00092 0.00004 259 25 H 1S -0.00060 -0.00076 -0.00296 -0.00189 -0.00015 260 2S -0.00288 -0.00077 -0.00233 -0.00164 -0.00027 261 26 H 1S -0.00561 0.00431 0.00578 0.00251 0.00002 262 2S 0.00491 0.00942 0.00562 0.00244 -0.00062 263 27 H 1S -0.05906 -0.01951 -0.00176 -0.00490 0.00235 264 2S -0.04411 -0.02335 -0.00808 -0.00257 -0.00165 26 27 28 29 30 26 4YY 0.00174 27 4ZZ -0.00011 0.00155 28 4XY 0.00009 -0.00047 0.00106 29 4XZ 0.00004 -0.00041 0.00009 0.00084 30 4YZ -0.00052 0.00031 -0.00003 -0.00008 0.00128 31 3 H 1S -0.00565 0.01243 -0.00490 -0.00749 0.00903 32 2S -0.00385 0.00988 -0.00376 -0.00509 0.00596 33 4 Br 1S 0.00087 0.00008 0.00031 -0.00001 -0.00046 34 2S -0.00313 -0.00020 -0.00181 0.00031 0.00103 35 3S 0.00026 -0.00019 0.00185 -0.00066 0.00147 36 4S -0.00080 -0.00058 0.00324 -0.00132 0.00356 37 5S 0.00765 0.00154 -0.00294 0.00164 -0.00903 38 6S 0.00217 0.00073 -0.00062 0.00165 -0.00105 39 7PX 0.00019 0.00038 0.00216 -0.00225 -0.00051 40 7PY 0.00025 0.00021 0.00037 -0.00050 0.00433 41 7PZ 0.00287 -0.00288 -0.00048 0.00028 -0.00268 42 8PX -0.00156 -0.00196 -0.00699 0.00679 0.00063 43 8PY 0.00059 0.00529 -0.00135 0.00020 -0.00923 44 8PZ -0.01056 0.00637 0.00146 0.00016 0.00441 45 9PX 0.00303 0.00380 0.01273 -0.01224 -0.00073 46 9PY -0.00113 -0.01100 0.00262 0.00010 0.01522 47 9PZ 0.01940 -0.01115 -0.00264 -0.00057 -0.00669 48 10PX 0.00293 0.00389 0.01047 -0.01028 -0.00003 49 10PY 0.00038 -0.00938 0.00238 -0.00017 0.01042 50 10PZ 0.01578 -0.01029 -0.00181 0.00028 -0.00431 51 11XX -0.00167 -0.00039 -0.00093 0.00016 0.00029 52 11YY -0.00021 0.00064 -0.00132 -0.00004 -0.00024 53 11ZZ -0.00064 -0.00027 -0.00042 0.00058 -0.00032 54 11XY -0.00032 -0.00029 0.00017 -0.00013 -0.00012 55 11XZ 0.00014 0.00023 -0.00007 0.00006 0.00011 56 11YZ -0.00098 -0.00066 0.00011 -0.00028 0.00054 57 12XX -0.00016 -0.00032 -0.00003 -0.00002 -0.00028 58 12YY 0.00051 -0.00013 -0.00025 0.00037 -0.00185 59 12ZZ 0.00060 0.00051 -0.00104 -0.00041 -0.00054 60 12XY -0.00006 0.00028 -0.00035 0.00055 0.00074 61 12XZ 0.00012 -0.00042 0.00045 -0.00017 -0.00053 62 12YZ -0.00083 -0.00019 0.00017 0.00029 0.00128 63 5 C 1S -0.00351 0.00192 -0.00455 -0.00173 -0.00229 64 2S 0.00573 -0.00411 0.00845 0.00307 0.00417 65 2PX 0.00933 -0.00180 -0.00221 0.00035 0.00474 66 2PY -0.00536 -0.00524 0.00841 0.00506 0.00561 67 2PZ 0.00606 -0.00732 0.00551 -0.00405 -0.00772 68 3S 0.00854 -0.00758 0.00715 0.00422 0.00344 69 3PX 0.00713 0.00038 -0.00291 -0.00044 0.00214 70 3PY -0.00293 -0.00226 0.00343 0.00237 0.00205 71 3PZ 0.00219 -0.00207 0.00190 -0.00136 -0.00287 72 4XX -0.00045 -0.00032 -0.00008 0.00000 -0.00014 73 4YY 0.00024 0.00015 -0.00012 -0.00014 -0.00013 74 4ZZ -0.00020 0.00047 -0.00025 -0.00020 0.00011 75 4XY -0.00002 -0.00049 0.00039 0.00011 0.00011 76 4XZ -0.00023 0.00001 -0.00003 0.00013 0.00037 77 4YZ -0.00031 0.00031 -0.00008 -0.00007 0.00075 78 6 C 1S 0.00044 -0.00115 0.00036 -0.00046 -0.00141 79 2S -0.00095 0.00215 -0.00067 0.00086 0.00306 80 2PX 0.00491 0.00346 -0.00326 -0.00138 0.00311 81 2PY -0.00382 0.00065 0.00188 0.00235 0.00207 82 2PZ -0.00286 0.00459 -0.00102 0.00327 0.00615 83 3S -0.00127 0.00282 -0.00196 -0.00057 0.00268 84 3PX 0.00311 0.00250 -0.00180 -0.00153 0.00146 85 3PY -0.00260 0.00013 0.00129 0.00155 0.00034 86 3PZ -0.00216 0.00338 -0.00082 0.00026 0.00174 87 4XX 0.00017 -0.00011 -0.00007 -0.00007 -0.00011 88 4YY -0.00010 -0.00016 0.00011 -0.00002 -0.00020 89 4ZZ 0.00010 0.00003 0.00013 0.00005 0.00010 90 4XY 0.00009 -0.00008 0.00004 0.00001 -0.00002 91 4XZ 0.00033 0.00006 -0.00012 0.00006 0.00021 92 4YZ -0.00024 -0.00012 0.00028 0.00026 0.00023 93 7 C 1S -0.00021 0.00032 -0.00013 0.00014 0.00049 94 2S 0.00032 -0.00109 0.00035 -0.00023 -0.00093 95 2PX -0.00111 -0.00098 0.00097 -0.00079 -0.00055 96 2PY 0.00128 -0.00129 -0.00029 -0.00033 -0.00158 97 2PZ 0.00033 -0.00080 0.00018 -0.00023 -0.00082 98 3S 0.00025 -0.00055 0.00119 0.00035 -0.00107 99 3PX -0.00130 -0.00046 0.00097 -0.00008 -0.00024 100 3PY 0.00091 -0.00022 0.00006 -0.00001 -0.00057 101 3PZ 0.00032 -0.00028 0.00003 0.00019 -0.00027 102 4XX 0.00027 0.00012 -0.00018 -0.00008 0.00005 103 4YY -0.00026 -0.00012 0.00016 0.00007 -0.00005 104 4ZZ -0.00005 0.00014 -0.00003 0.00006 0.00012 105 4XY 0.00018 0.00006 -0.00012 -0.00008 0.00000 106 4XZ -0.00010 0.00007 -0.00001 0.00004 0.00008 107 4YZ -0.00007 0.00013 -0.00008 0.00005 0.00012 108 8 C 1S 0.00002 0.00006 -0.00008 0.00001 0.00005 109 2S 0.00003 -0.00017 0.00026 0.00000 -0.00009 110 2PX -0.00423 -0.00159 0.00300 0.00100 -0.00031 111 2PY 0.00277 0.00065 -0.00126 -0.00047 0.00016 112 2PZ 0.00021 0.00040 0.00007 -0.00005 0.00005 113 3S -0.00040 -0.00012 0.00014 0.00001 0.00023 114 3PX -0.00346 -0.00133 0.00206 0.00080 -0.00016 115 3PY 0.00188 0.00055 -0.00142 -0.00039 0.00025 116 3PZ -0.00000 0.00023 -0.00017 0.00006 0.00009 117 4XX -0.00001 0.00000 0.00000 -0.00001 0.00001 118 4YY -0.00000 -0.00004 -0.00003 0.00000 -0.00002 119 4ZZ -0.00001 0.00003 0.00001 0.00001 0.00004 120 4XY -0.00003 -0.00002 -0.00002 -0.00001 -0.00000 121 4XZ -0.00002 0.00003 -0.00003 0.00005 0.00004 122 4YZ -0.00008 0.00004 -0.00004 0.00001 0.00012 123 9 C 1S 0.00046 -0.00014 0.00028 -0.00027 -0.00074 124 2S -0.00105 0.00007 -0.00048 0.00060 0.00170 125 2PX -0.00179 0.00005 -0.00013 0.00122 0.00122 126 2PY -0.00147 0.00038 -0.00155 0.00053 0.00294 127 2PZ -0.00034 -0.00021 -0.00041 0.00017 0.00039 128 3S -0.00013 0.00015 0.00060 -0.00011 0.00172 129 3PX -0.00106 -0.00010 0.00069 0.00050 0.00035 130 3PY 0.00024 0.00020 -0.00038 -0.00027 0.00111 131 3PZ -0.00056 0.00018 -0.00022 0.00022 0.00079 132 4XX 0.00029 0.00008 -0.00014 -0.00006 -0.00004 133 4YY -0.00017 -0.00012 0.00015 -0.00001 -0.00013 134 4ZZ 0.00000 0.00001 0.00005 0.00000 -0.00004 135 4XY 0.00018 0.00004 -0.00010 -0.00006 -0.00005 136 4XZ 0.00011 0.00010 -0.00014 0.00000 0.00009 137 4YZ -0.00025 0.00002 0.00002 0.00009 0.00013 138 10 C 1S -0.00120 0.00073 -0.00067 0.00052 0.00177 139 2S 0.00257 -0.00158 0.00157 -0.00109 -0.00372 140 2PX 0.00903 0.00075 -0.00158 -0.00206 -0.00339 141 2PY 0.00135 -0.00350 0.00560 -0.00173 -0.00607 142 2PZ -0.00391 0.00230 -0.00145 0.00168 0.00263 143 3S 0.00126 -0.00065 -0.00036 -0.00055 -0.00430 144 3PX 0.00506 0.00150 -0.00189 -0.00111 -0.00150 145 3PY -0.00084 -0.00102 0.00253 -0.00105 -0.00218 146 3PZ -0.00041 -0.00037 0.00058 0.00045 0.00030 147 4XX 0.00014 -0.00000 -0.00017 -0.00000 0.00019 148 4YY -0.00025 -0.00017 0.00029 0.00011 0.00022 149 4ZZ -0.00005 0.00023 -0.00010 0.00002 -0.00006 150 4XY 0.00022 -0.00011 0.00006 -0.00002 0.00012 151 4XZ -0.00042 0.00004 0.00002 0.00008 0.00005 152 4YZ -0.00014 0.00022 -0.00031 -0.00001 0.00015 153 11 H 1S -0.00074 0.00115 -0.00028 0.00013 -0.00077 154 2S -0.00175 0.00231 -0.00129 0.00041 0.00072 155 12 H 1S 0.00074 -0.00037 0.00035 -0.00038 -0.00102 156 2S 0.00127 -0.00049 0.00045 -0.00072 -0.00187 157 13 H 1S -0.00024 -0.00003 -0.00031 -0.00004 0.00009 158 2S -0.00040 -0.00009 -0.00048 0.00002 0.00025 159 14 H 1S -0.00038 0.00081 -0.00023 0.00032 0.00077 160 2S -0.00060 0.00133 -0.00054 0.00044 0.00117 161 15 H 1S 0.00032 0.00015 -0.00001 -0.00092 -0.00095 162 2S -0.00011 0.00074 -0.00018 -0.00168 -0.00180 163 16 C 1S -0.00019 -0.00066 0.00130 0.00093 0.00002 164 2S 0.00066 0.00144 -0.00271 -0.00181 -0.00005 165 2PX -0.00100 -0.00200 0.00472 0.00322 -0.00014 166 2PY -0.00147 0.00089 -0.00189 -0.00567 0.00164 167 2PZ 0.00222 0.00034 -0.00460 0.00456 -0.00357 168 3S -0.00121 0.00363 -0.00173 -0.00326 0.00017 169 3PX 0.00146 -0.00100 0.00020 0.00037 -0.00078 170 3PY -0.00196 0.00148 -0.00021 -0.00277 0.00192 171 3PZ 0.00149 0.00015 -0.00144 0.00267 -0.00238 172 4XX -0.00034 -0.00031 -0.00012 -0.00006 -0.00008 173 4YY 0.00020 0.00003 0.00035 0.00004 -0.00000 174 4ZZ 0.00002 0.00001 0.00003 0.00023 0.00004 175 4XY 0.00000 0.00003 0.00005 0.00014 0.00005 176 4XZ 0.00007 0.00001 0.00020 -0.00010 -0.00008 177 4YZ 0.00007 0.00005 0.00003 0.00016 0.00006 178 17 C 1S -0.00007 -0.00022 -0.00042 -0.00023 -0.00002 179 2S 0.00000 0.00033 0.00091 0.00055 0.00002 180 2PX 0.00081 -0.00009 -0.00026 0.00010 0.00008 181 2PY 0.00063 0.00069 0.00152 0.00009 0.00136 182 2PZ 0.00212 0.00020 0.00034 0.00221 -0.00162 183 3S -0.00086 0.00015 0.00294 0.00142 0.00013 184 3PX -0.00080 0.00002 0.00073 0.00065 0.00020 185 3PY 0.00088 0.00066 -0.00007 -0.00022 0.00107 186 3PZ 0.00165 0.00033 -0.00044 0.00119 -0.00083 187 4XX -0.00007 -0.00006 0.00002 0.00001 -0.00001 188 4YY -0.00007 0.00004 0.00001 -0.00024 0.00012 189 4ZZ 0.00007 -0.00001 -0.00013 0.00017 -0.00012 190 4XY -0.00007 -0.00003 0.00016 0.00013 -0.00000 191 4XZ -0.00004 -0.00000 0.00011 0.00002 0.00000 192 4YZ 0.00007 0.00003 -0.00011 0.00012 -0.00008 193 18 C 1S -0.00001 0.00001 0.00022 0.00012 -0.00001 194 2S -0.00006 -0.00000 -0.00046 -0.00029 -0.00006 195 2PX 0.00010 0.00022 0.00066 0.00031 0.00002 196 2PY 0.00007 0.00011 -0.00084 0.00041 -0.00056 197 2PZ -0.00044 0.00010 0.00034 -0.00165 0.00068 198 3S 0.00161 0.00030 -0.00195 -0.00095 0.00012 199 3PX -0.00029 -0.00017 0.00114 0.00044 -0.00010 200 3PY 0.00062 0.00004 -0.00083 0.00026 -0.00032 201 3PZ -0.00011 0.00007 0.00022 -0.00135 0.00061 202 4XX -0.00005 0.00001 -0.00002 -0.00003 -0.00001 203 4YY 0.00004 0.00001 0.00003 0.00004 0.00003 204 4ZZ 0.00003 0.00000 0.00003 0.00001 -0.00002 205 4XY 0.00004 -0.00000 -0.00003 0.00006 -0.00007 206 4XZ -0.00009 0.00001 0.00003 -0.00014 0.00012 207 4YZ 0.00004 -0.00000 0.00004 0.00002 0.00000 208 19 C 1S 0.00008 -0.00003 0.00007 0.00007 0.00002 209 2S -0.00013 0.00009 -0.00018 -0.00016 -0.00005 210 2PX 0.00002 -0.00029 0.00009 0.00006 0.00015 211 2PY 0.00072 -0.00002 -0.00082 0.00139 -0.00109 212 2PZ -0.00143 0.00005 0.00083 -0.00292 0.00216 213 3S -0.00078 -0.00000 -0.00026 -0.00012 -0.00001 214 3PX 0.00041 -0.00004 0.00003 -0.00001 0.00005 215 3PY 0.00032 -0.00014 -0.00016 0.00105 -0.00079 216 3PZ -0.00112 -0.00001 0.00060 -0.00176 0.00150 217 4XX -0.00000 -0.00001 -0.00001 -0.00001 -0.00001 218 4YY 0.00003 0.00001 -0.00001 0.00004 -0.00001 219 4ZZ -0.00000 -0.00000 0.00001 -0.00003 0.00002 220 4XY -0.00002 -0.00001 0.00003 -0.00001 0.00001 221 4XZ -0.00001 -0.00001 -0.00001 0.00004 -0.00001 222 4YZ -0.00001 0.00000 0.00002 -0.00002 0.00001 223 20 C 1S -0.00018 -0.00018 0.00007 0.00004 -0.00002 224 2S 0.00032 0.00038 -0.00023 -0.00014 0.00002 225 2PX -0.00056 -0.00076 0.00052 0.00025 0.00008 226 2PY 0.00086 0.00048 -0.00044 0.00082 -0.00054 227 2PZ -0.00044 0.00020 0.00071 -0.00163 0.00091 228 3S 0.00157 0.00093 -0.00015 -0.00019 -0.00005 229 3PX -0.00076 -0.00060 0.00010 0.00013 0.00008 230 3PY 0.00058 0.00022 -0.00025 0.00079 -0.00041 231 3PZ -0.00035 0.00006 0.00065 -0.00125 0.00077 232 4XX -0.00003 -0.00005 0.00007 0.00004 -0.00001 233 4YY -0.00006 0.00001 -0.00000 -0.00013 0.00010 234 4ZZ 0.00006 -0.00001 -0.00005 0.00009 -0.00009 235 4XY 0.00000 -0.00001 0.00001 0.00001 -0.00002 236 4XZ -0.00003 0.00000 -0.00001 -0.00001 0.00004 237 4YZ 0.00005 0.00001 -0.00003 0.00007 -0.00007 238 21 C 1S 0.00033 0.00019 -0.00012 -0.00006 0.00010 239 2S -0.00080 -0.00050 0.00014 0.00003 -0.00028 240 2PX 0.00144 0.00136 -0.00087 -0.00044 0.00018 241 2PY -0.00083 -0.00005 -0.00036 -0.00128 0.00106 242 2PZ 0.00087 -0.00030 -0.00059 0.00142 -0.00163 243 3S -0.00260 -0.00205 0.00048 0.00086 -0.00000 244 3PX 0.00050 0.00099 -0.00099 -0.00088 0.00001 245 3PY 0.00052 0.00034 -0.00039 -0.00104 0.00036 246 3PZ 0.00099 0.00014 -0.00048 0.00079 -0.00122 247 4XX 0.00008 0.00010 -0.00010 -0.00008 0.00001 248 4YY -0.00000 -0.00003 0.00004 0.00003 -0.00001 249 4ZZ 0.00001 0.00000 -0.00002 0.00000 0.00001 250 4XY -0.00003 -0.00008 0.00002 0.00020 -0.00009 251 4XZ -0.00015 -0.00005 0.00016 -0.00022 0.00015 252 4YZ -0.00002 -0.00002 0.00003 0.00003 0.00002 253 22 H 1S -0.00036 -0.00033 -0.00007 -0.00001 0.00005 254 2S -0.00047 -0.00031 0.00049 0.00036 0.00019 255 23 H 1S -0.00016 -0.00029 0.00032 0.00019 -0.00000 256 2S -0.00026 -0.00038 0.00043 0.00025 -0.00005 257 24 H 1S 0.00004 -0.00005 0.00001 0.00002 -0.00000 258 2S 0.00004 -0.00003 0.00002 0.00005 0.00002 259 25 H 1S 0.00023 -0.00008 0.00022 0.00021 0.00013 260 2S 0.00036 -0.00009 0.00044 0.00032 0.00016 261 26 H 1S -0.00021 0.00009 0.00011 -0.00003 0.00002 262 2S -0.00023 0.00039 -0.00039 0.00007 0.00012 263 27 H 1S 0.00152 -0.00122 0.00634 0.00528 0.00102 264 2S 0.00375 -0.00083 0.00394 0.00355 0.00144 31 32 33 34 35 31 3 H 1S 0.21133 32 2S 0.12587 0.09313 33 4 Br 1S 0.00141 -0.00229 2.39682 34 2S -0.00892 0.01009 -1.27323 4.73646 35 3S 0.01003 -0.00522 0.48328 -2.55998 1.98432 36 4S 0.01754 -0.00734 0.74773 -3.78389 2.97077 37 5S -0.01671 -0.00814 0.16178 -0.61878 0.13558 38 6S -0.00822 0.00668 0.14468 -0.58492 0.20096 39 7PX 0.00557 0.00864 0.00008 -0.00153 0.00302 40 7PY -0.00091 -0.00250 -0.00024 0.00691 -0.01456 41 7PZ -0.00729 -0.01802 0.00041 -0.00478 0.00835 42 8PX -0.01686 -0.02259 -0.00043 0.00323 -0.00449 43 8PY 0.00091 0.00329 0.00173 -0.01368 0.02009 44 8PZ 0.02377 0.04458 -0.00162 0.01177 -0.01603 45 9PX 0.03097 0.03965 0.00035 -0.00345 0.00554 46 9PY 0.00019 -0.00464 -0.00094 0.01244 -0.02297 47 9PZ -0.04677 -0.07778 0.00211 -0.01637 0.02281 48 10PX 0.03205 0.03858 0.00204 -0.01052 0.00846 49 10PY -0.00454 -0.01339 -0.00934 0.04930 -0.04187 50 10PZ -0.05052 -0.06822 0.00512 -0.02834 0.02641 51 11XX -0.00333 0.00404 -0.38780 1.78969 -1.10857 52 11YY -0.00145 0.00572 -0.38782 1.78977 -1.10905 53 11ZZ -0.00931 0.00138 -0.38778 1.78962 -1.10882 54 11XY -0.00181 0.00072 0.00000 -0.00010 0.00037 55 11XZ 0.00125 0.00131 -0.00006 0.00028 -0.00031 56 11YZ 0.00179 -0.00208 -0.00004 -0.00005 0.00101 57 12XX -0.00570 -0.00106 -0.10738 0.50554 -0.32784 58 12YY -0.00989 -0.00698 -0.10818 0.51120 -0.33496 59 12ZZ 0.00764 0.00487 -0.10769 0.50791 -0.33105 60 12XY 0.00409 0.00230 0.00026 -0.00186 0.00241 61 12XZ -0.00430 -0.00344 0.00010 0.00015 -0.00124 62 12YZ -0.00253 0.00211 0.00103 -0.00685 0.00817 63 5 C 1S 0.00991 0.01006 -0.00018 0.00136 -0.00183 64 2S -0.02135 -0.02047 0.00157 -0.00848 0.00751 65 2PX -0.01002 -0.00665 -0.00078 0.00515 -0.00622 66 2PY -0.02689 -0.04215 0.00229 -0.01486 0.01741 67 2PZ -0.02593 -0.05281 -0.00067 0.00444 -0.00543 68 3S -0.05337 -0.04681 0.00208 -0.01092 0.00923 69 3PX 0.00539 0.00972 -0.00724 0.03582 -0.02659 70 3PY -0.01279 -0.01293 -0.00934 0.04253 -0.02491 71 3PZ -0.01232 -0.01502 -0.01007 0.04865 -0.03372 72 4XX -0.00261 -0.00210 -0.00000 0.00001 0.00002 73 4YY 0.00260 -0.00003 -0.00070 0.00335 -0.00221 74 4ZZ 0.00394 0.00435 0.00034 -0.00159 0.00099 75 4XY -0.00199 -0.00302 -0.00033 0.00141 -0.00067 76 4XZ 0.00197 0.00024 0.00007 -0.00034 0.00028 77 4YZ 0.00623 0.00404 0.00035 -0.00174 0.00131 78 6 C 1S -0.00616 -0.00782 -0.00013 0.00118 -0.00182 79 2S 0.01353 0.01670 0.00157 -0.00860 0.00786 80 2PX 0.02222 0.04186 -0.00031 0.00195 -0.00224 81 2PY 0.00129 0.00637 0.00183 -0.01150 0.01317 82 2PZ 0.02283 0.03981 0.00044 -0.00189 0.00092 83 3S 0.02904 0.02955 -0.00445 0.02002 -0.01088 84 3PX 0.01396 0.02675 -0.00086 0.00449 -0.00381 85 3PY -0.00757 -0.00525 -0.00210 0.00886 -0.00380 86 3PZ 0.02029 0.02739 -0.01426 0.06871 -0.04742 87 4XX -0.00054 -0.00093 0.00046 -0.00207 0.00119 88 4YY -0.00117 -0.00168 0.00010 -0.00042 0.00023 89 4ZZ 0.00018 0.00083 -0.00038 0.00170 -0.00088 90 4XY -0.00069 -0.00090 -0.00000 -0.00002 0.00009 91 4XZ -0.00004 0.00049 -0.00011 0.00065 -0.00063 92 4YZ -0.00134 -0.00114 0.00004 -0.00021 0.00020 93 7 C 1S 0.00270 0.00446 0.00011 -0.00073 0.00086 94 2S -0.00617 -0.00962 0.00002 0.00032 -0.00100 95 2PX -0.00672 -0.00654 -0.00002 0.00043 -0.00105 96 2PY -0.00788 -0.02196 -0.00046 0.00299 -0.00360 97 2PZ -0.00356 -0.00734 -0.00014 0.00080 -0.00075 98 3S -0.01355 -0.01107 -0.00172 0.00882 -0.00733 99 3PX -0.00653 -0.00266 -0.00266 0.01279 -0.00892 100 3PY -0.00514 -0.00883 -0.00362 0.01757 -0.01244 101 3PZ -0.00354 -0.00386 0.00418 -0.01999 0.01347 102 4XX 0.00081 0.00124 -0.00010 0.00052 -0.00046 103 4YY -0.00080 -0.00148 -0.00004 0.00005 0.00018 104 4ZZ 0.00067 0.00141 0.00005 -0.00025 0.00021 105 4XY 0.00045 0.00056 -0.00019 0.00094 -0.00071 106 4XZ 0.00036 0.00041 -0.00001 0.00006 -0.00006 107 4YZ 0.00070 0.00088 0.00005 -0.00018 0.00003 108 8 C 1S 0.00070 -0.00009 -0.00002 0.00020 -0.00032 109 2S -0.00172 0.00037 0.00020 -0.00116 0.00115 110 2PX -0.01123 -0.01467 0.00068 -0.00463 0.00573 111 2PY 0.00504 0.01113 -0.00027 0.00178 -0.00212 112 2PZ -0.00057 0.00102 -0.00011 0.00082 -0.00120 113 3S -0.00066 0.00090 -0.00283 0.01306 -0.00797 114 3PX -0.00905 -0.01211 -0.00027 0.00025 0.00180 115 3PY 0.00505 0.00735 -0.00190 0.00942 -0.00700 116 3PZ 0.00105 0.00115 0.00229 -0.01075 0.00686 117 4XX 0.00002 -0.00016 0.00003 -0.00015 0.00009 118 4YY -0.00015 -0.00061 -0.00003 0.00018 -0.00017 119 4ZZ 0.00020 0.00049 0.00003 -0.00016 0.00012 120 4XY -0.00001 -0.00027 -0.00002 0.00011 -0.00009 121 4XZ 0.00024 -0.00046 -0.00000 -0.00004 0.00010 122 4YZ 0.00032 0.00058 0.00007 -0.00032 0.00022 123 9 C 1S -0.00197 -0.00076 -0.00008 0.00056 -0.00070 124 2S 0.00361 0.00120 0.00015 -0.00109 0.00147 125 2PX 0.00337 -0.01203 0.00063 -0.00426 0.00537 126 2PY 0.00680 0.01164 0.00030 -0.00172 0.00169 127 2PZ 0.00151 -0.00141 -0.00008 0.00041 -0.00031 128 3S 0.00947 0.00243 0.00468 -0.02238 0.01521 129 3PX 0.00307 -0.00890 0.00224 -0.01151 0.00936 130 3PY 0.00509 0.00753 0.00249 -0.01160 0.00734 131 3PZ 0.00420 0.00169 0.00152 -0.00729 0.00496 132 4XX 0.00052 0.00027 0.00004 -0.00015 -0.00002 133 4YY -0.00084 -0.00071 0.00006 -0.00028 0.00021 134 4ZZ -0.00026 0.00016 -0.00007 0.00031 -0.00021 135 4XY 0.00047 0.00014 0.00003 -0.00012 0.00001 136 4XZ 0.00053 0.00087 0.00002 -0.00005 -0.00003 137 4YZ -0.00019 0.00016 0.00006 -0.00034 0.00033 138 10 C 1S 0.00658 0.00362 0.00017 -0.00110 0.00128 139 2S -0.01496 -0.00817 -0.00026 0.00180 -0.00229 140 2PX 0.00292 -0.00333 -0.00095 0.00637 -0.00773 141 2PY -0.02707 -0.01826 -0.00056 0.00339 -0.00372 142 2PZ 0.00143 0.01871 0.00034 -0.00218 0.00254 143 3S -0.01699 -0.00515 -0.00406 0.01940 -0.01327 144 3PX 0.00960 0.00268 0.00219 -0.00937 0.00432 145 3PY -0.00444 -0.00277 0.00578 -0.02744 0.01811 146 3PZ -0.00919 -0.00300 0.00319 -0.01522 0.01039 147 4XX 0.00019 0.00037 -0.00005 0.00028 -0.00030 148 4YY 0.00014 -0.00158 0.00019 -0.00104 0.00097 149 4ZZ 0.00037 0.00195 -0.00004 0.00023 -0.00023 150 4XY -0.00001 -0.00014 -0.00001 0.00008 -0.00014 151 4XZ 0.00001 0.00026 -0.00003 0.00003 0.00016 152 4YZ 0.00117 0.00156 -0.00016 0.00076 -0.00046 153 11 H 1S -0.00344 0.01123 -0.00050 0.00249 -0.00189 154 2S 0.00908 0.01980 -0.00125 0.00611 -0.00438 155 12 H 1S -0.00156 -0.00309 -0.00024 0.00143 -0.00153 156 2S -0.00302 -0.00410 -0.00026 0.00158 -0.00174 157 13 H 1S 0.00046 -0.00230 -0.00001 0.00014 -0.00024 158 2S 0.00110 -0.00312 -0.00032 0.00164 -0.00132 159 14 H 1S 0.00409 0.00815 0.00027 -0.00129 0.00086 160 2S 0.00719 0.01225 0.00134 -0.00651 0.00461 161 15 H 1S 0.00263 0.00177 0.00115 -0.00649 0.00634 162 2S 0.00888 0.00707 -0.00908 0.04333 -0.02918 163 16 C 1S -0.00660 -0.00676 0.00022 -0.00131 0.00137 164 2S 0.01379 0.01361 -0.00006 0.00060 -0.00094 165 2PX -0.02267 -0.03231 -0.00020 0.00048 0.00056 166 2PY 0.02456 0.02953 0.00113 -0.00649 0.00652 167 2PZ -0.01268 -0.01435 -0.00173 0.01123 -0.01310 168 3S 0.03998 0.03088 0.00064 -0.00293 0.00189 169 3PX -0.01565 -0.01131 -0.00279 0.01382 -0.01033 170 3PY 0.02690 0.02156 -0.00170 0.00688 -0.00224 171 3PZ -0.00781 -0.01166 -0.00168 0.00940 -0.00897 172 4XX -0.00146 -0.00150 0.00071 -0.00331 0.00207 173 4YY -0.00062 -0.00044 0.00062 -0.00298 0.00198 174 4ZZ -0.00016 -0.00026 0.00027 -0.00114 0.00049 175 4XY 0.00017 -0.00080 -0.00018 0.00091 -0.00073 176 4XZ -0.00053 -0.00038 0.00014 -0.00074 0.00062 177 4YZ 0.00007 0.00018 -0.00016 0.00075 -0.00051 178 17 C 1S 0.00027 0.00138 -0.00006 0.00039 -0.00042 179 2S -0.00098 -0.00295 0.00012 -0.00073 0.00080 180 2PX -0.00060 0.00250 -0.00002 0.00043 -0.00093 181 2PY 0.00526 0.00630 0.00007 -0.00070 0.00115 182 2PZ -0.01042 -0.01504 -0.00035 0.00225 -0.00268 183 3S -0.00057 -0.00810 -0.00236 0.01018 -0.00489 184 3PX 0.00218 -0.00065 -0.00223 0.01021 -0.00607 185 3PY 0.00530 0.00787 0.00002 -0.00001 -0.00018 186 3PZ -0.00447 -0.00736 -0.00037 0.00224 -0.00243 187 4XX -0.00041 -0.00057 -0.00006 0.00028 -0.00014 188 4YY 0.00107 0.00116 -0.00004 0.00010 0.00010 189 4ZZ -0.00059 -0.00054 -0.00019 0.00098 -0.00080 190 4XY -0.00049 -0.00095 0.00005 -0.00027 0.00023 191 4XZ -0.00020 -0.00044 0.00006 -0.00032 0.00030 192 4YZ -0.00022 -0.00029 -0.00010 0.00054 -0.00048 193 18 C 1S -0.00035 -0.00078 -0.00001 0.00003 0.00005 194 2S 0.00096 0.00169 -0.00028 0.00142 -0.00108 195 2PX -0.00073 -0.00334 0.00004 -0.00038 0.00054 196 2PY -0.00171 -0.00025 -0.00022 0.00152 -0.00189 197 2PZ 0.00549 0.00313 0.00032 -0.00213 0.00256 198 3S 0.00162 0.00723 0.00285 -0.01269 0.00688 199 3PX -0.00230 -0.00439 0.00002 -0.00038 0.00077 200 3PY -0.00191 0.00034 0.00128 -0.00553 0.00268 201 3PZ 0.00391 0.00353 0.00117 -0.00594 0.00471 202 4XX 0.00009 -0.00002 0.00005 -0.00024 0.00017 203 4YY -0.00003 0.00008 -0.00000 0.00002 -0.00003 204 4ZZ -0.00012 -0.00017 -0.00004 0.00020 -0.00012 205 4XY -0.00035 -0.00049 -0.00005 0.00024 -0.00020 206 4XZ 0.00073 0.00083 0.00000 -0.00007 0.00015 207 4YZ -0.00015 -0.00013 0.00006 -0.00029 0.00018 208 19 C 1S -0.00033 -0.00009 0.00001 -0.00003 0.00001 209 2S 0.00074 0.00033 0.00007 -0.00033 0.00020 210 2PX -0.00034 0.00130 0.00000 0.00000 -0.00003 211 2PY -0.00620 -0.00669 -0.00032 0.00219 -0.00270 212 2PZ 0.01295 0.01436 0.00059 -0.00395 0.00480 213 3S 0.00185 0.00030 -0.00099 0.00442 -0.00243 214 3PX -0.00074 0.00096 0.00109 -0.00504 0.00313 215 3PY -0.00487 -0.00571 -0.00042 0.00224 -0.00201 216 3PZ 0.00875 0.00911 0.00012 -0.00135 0.00240 217 4XX -0.00002 0.00001 -0.00003 0.00013 -0.00010 218 4YY -0.00008 -0.00019 0.00000 -0.00000 -0.00003 219 4ZZ 0.00010 0.00032 0.00001 -0.00007 0.00006 220 4XY 0.00001 -0.00018 0.00000 -0.00002 0.00005 221 4XZ -0.00013 -0.00008 -0.00001 0.00006 -0.00007 222 4YZ 0.00006 0.00022 -0.00000 -0.00001 0.00003 223 20 C 1S -0.00093 -0.00137 -0.00002 0.00010 -0.00005 224 2S 0.00214 0.00310 -0.00021 0.00102 -0.00072 225 2PX -0.00302 -0.00530 0.00006 -0.00038 0.00046 226 2PY -0.00101 -0.00245 -0.00023 0.00151 -0.00179 227 2PZ 0.00673 0.01183 0.00031 -0.00216 0.00269 228 3S 0.00165 0.00591 0.00237 -0.01093 0.00662 229 3PX -0.00155 -0.00350 -0.00099 0.00453 -0.00270 230 3PY -0.00236 -0.00289 0.00067 -0.00295 0.00153 231 3PZ 0.00461 0.00830 0.00096 -0.00509 0.00442 232 4XX -0.00050 -0.00068 0.00001 -0.00007 0.00005 233 4YY 0.00073 0.00072 0.00002 -0.00015 0.00017 234 4ZZ -0.00050 -0.00045 -0.00007 0.00036 -0.00032 235 4XY -0.00016 -0.00018 -0.00003 0.00012 -0.00008 236 4XZ 0.00021 0.00001 -0.00004 0.00017 -0.00010 237 4YZ -0.00029 -0.00024 0.00004 -0.00014 0.00002 238 21 C 1S 0.00170 0.00331 -0.00003 0.00015 -0.00012 239 2S -0.00356 -0.00662 0.00007 -0.00033 0.00022 240 2PX 0.00848 0.01496 0.00002 0.00008 -0.00038 241 2PY 0.00833 0.00611 0.00015 -0.00100 0.00127 242 2PZ -0.00853 -0.00500 -0.00025 0.00187 -0.00252 243 3S -0.01069 -0.01611 0.00021 -0.00150 0.00188 244 3PX 0.01016 0.01024 -0.00302 0.01457 -0.01006 245 3PY 0.00407 0.00506 0.00030 -0.00124 0.00047 246 3PZ -0.00580 -0.00176 -0.00036 0.00216 -0.00229 247 4XX 0.00070 0.00080 -0.00007 0.00035 -0.00024 248 4YY -0.00027 -0.00014 -0.00004 0.00019 -0.00010 249 4ZZ 0.00005 0.00009 -0.00004 0.00020 -0.00015 250 4XY -0.00108 -0.00151 -0.00002 0.00014 -0.00016 251 4XZ 0.00055 0.00061 0.00014 -0.00078 0.00074 252 4YZ -0.00011 -0.00024 -0.00001 0.00004 -0.00001 253 22 H 1S -0.00054 -0.00121 -0.00021 0.00097 -0.00059 254 2S -0.00138 -0.00176 0.00102 -0.00503 0.00367 255 23 H 1S -0.00166 -0.00278 -0.00002 0.00003 0.00007 256 2S -0.00284 -0.00416 0.00009 -0.00048 0.00039 257 24 H 1S 0.00003 0.00082 -0.00009 0.00043 -0.00033 258 2S 0.00016 0.00085 -0.00028 0.00135 -0.00091 259 25 H 1S -0.00055 0.00002 0.00002 -0.00010 0.00008 260 2S -0.00139 -0.00079 0.00049 -0.00236 0.00161 261 26 H 1S -0.00028 -0.00205 -0.00008 0.00024 0.00011 262 2S 0.00226 0.00059 -0.00076 0.00371 -0.00262 263 27 H 1S -0.02083 -0.01799 0.00093 -0.00554 0.00578 264 2S -0.01757 -0.01407 -0.00623 0.02966 -0.01988 36 37 38 39 40 36 4S 4.48170 37 5S 0.02216 1.01732 38 6S 0.17556 0.69245 0.54775 39 7PX 0.00325 -0.00561 0.00816 2.30543 40 7PY -0.01462 0.01358 -0.01398 0.00140 2.30052 41 7PZ 0.00970 -0.00649 -0.00699 -0.00120 0.00456 42 8PX -0.00731 0.01187 -0.00271 -0.86673 -0.00421 43 8PY 0.03073 -0.02077 -0.06276 -0.00421 -0.85215 44 8PZ -0.02479 0.01584 0.05090 0.00361 -0.01382 45 9PX 0.01189 -0.01943 -0.00285 0.07115 0.00834 46 9PY -0.04732 0.02617 0.15212 0.00840 0.04203 47 9PZ 0.04211 -0.02569 -0.10313 -0.00722 0.02640 48 10PX 0.01472 -0.01165 0.00459 0.13145 0.00579 49 10PY -0.07060 0.01380 0.08747 0.00567 0.10320 50 10PZ 0.04420 -0.01546 -0.05997 -0.00473 0.02721 51 11XX -1.64736 -0.18221 -0.20925 -0.00242 0.00879 52 11YY -1.64676 -0.19314 -0.17849 -0.00185 0.01206 53 11ZZ -1.64678 -0.18686 -0.19543 -0.00192 0.00993 54 11XY -0.00014 0.00261 -0.00722 0.00090 -0.00047 55 11XZ -0.00013 -0.00271 0.00716 -0.00065 0.00022 56 11YZ -0.00084 0.00824 -0.02269 0.00020 -0.00229 57 12XX -0.48749 -0.04833 -0.05442 -0.00119 0.01396 58 12YY -0.50019 -0.03405 -0.05900 -0.00426 0.00705 59 12ZZ -0.49329 -0.04100 -0.05754 -0.00383 0.01304 60 12XY 0.00420 -0.00457 0.00079 -0.00402 0.00092 61 12XZ -0.00254 0.00407 0.00114 0.00303 -0.00042 62 12YZ 0.01445 -0.01510 0.00369 -0.00030 0.00406 63 5 C 1S -0.00343 0.00416 -0.00043 -0.00100 -0.00318 64 2S 0.01247 -0.00883 0.00356 0.00209 0.00428 65 2PX -0.00996 0.01345 0.00105 0.00105 0.00127 66 2PY 0.03011 -0.03512 -0.00465 0.00320 0.01166 67 2PZ -0.00797 0.00971 0.00384 -0.00045 -0.00074 68 3S 0.01473 -0.00776 0.00719 0.01020 0.02132 69 3PX -0.04115 0.01070 0.00454 -0.00296 0.02115 70 3PY -0.03597 -0.02074 0.00842 -0.00063 0.04126 71 3PZ -0.05167 0.00592 -0.00413 0.01608 -0.00767 72 4XX 0.00005 -0.00003 0.00008 -0.00038 -0.00014 73 4YY -0.00331 0.00070 -0.00305 0.00012 -0.00175 74 4ZZ 0.00138 -0.00009 0.00201 -0.00005 -0.00059 75 4XY -0.00080 -0.00082 -0.00159 0.00044 0.00083 76 4XZ 0.00041 -0.00095 0.00217 -0.00022 0.00128 77 4YZ 0.00213 -0.00048 -0.00053 0.00015 0.00120 78 6 C 1S -0.00315 0.00570 -0.00301 -0.00067 -0.00214 79 2S 0.01252 -0.01212 0.00854 0.00114 0.00449 80 2PX -0.00365 0.00983 -0.01384 0.00011 -0.00305 81 2PY 0.02043 -0.03753 0.03785 0.00168 0.00659 82 2PZ 0.00043 0.00429 -0.00424 0.00029 -0.00011 83 3S -0.01640 -0.01163 0.00969 0.01058 -0.00132 84 3PX -0.00557 0.00915 -0.01737 0.00253 -0.00353 85 3PY -0.00552 -0.01701 0.01522 0.00361 0.00431 86 3PZ -0.07275 0.00482 -0.00184 0.00390 0.00777 87 4XX 0.00172 0.00071 0.00059 -0.00010 -0.00116 88 4YY 0.00033 0.00062 -0.00094 -0.00038 -0.00170 89 4ZZ -0.00125 -0.00110 0.00024 0.00020 0.00085 90 4XY 0.00015 -0.00036 0.00040 0.00031 -0.00061 91 4XZ -0.00103 0.00115 -0.00046 0.00014 -0.00054 92 4YZ 0.00036 0.00013 -0.00131 0.00007 -0.00049 93 7 C 1S 0.00131 -0.00268 0.00283 0.00013 0.00029 94 2S -0.00158 0.00529 -0.00488 -0.00016 -0.00241 95 2PX -0.00053 0.01322 -0.03150 -0.00195 -0.00030 96 2PY -0.00538 0.00685 0.00074 0.00066 -0.00142 97 2PZ -0.00146 0.00034 0.00204 0.00012 -0.00097 98 3S -0.01100 0.00629 -0.00848 0.00091 0.00291 99 3PX -0.01284 0.00644 -0.02016 -0.00100 0.00378 100 3PY -0.01885 0.00018 0.00338 0.00166 0.00427 101 3PZ 0.02044 -0.00083 0.00144 -0.00044 0.00053 102 4XX -0.00072 0.00086 -0.00077 0.00006 -0.00050 103 4YY 0.00033 -0.00138 0.00104 0.00009 0.00072 104 4ZZ 0.00030 -0.00013 0.00018 0.00009 -0.00024 105 4XY -0.00107 0.00053 -0.00065 -0.00003 0.00053 106 4XZ -0.00008 0.00025 -0.00060 -0.00001 0.00016 107 4YZ 0.00003 0.00055 -0.00042 -0.00007 0.00005 108 8 C 1S -0.00049 0.00135 -0.00176 -0.00004 -0.00032 109 2S 0.00176 -0.00291 0.00388 0.00029 0.00043 110 2PX 0.00944 -0.01357 0.00217 0.00014 0.00524 111 2PY -0.00382 0.00353 0.00439 0.00012 -0.00278 112 2PZ -0.00128 0.00453 -0.00478 -0.00032 -0.00005 113 3S -0.01184 -0.00542 0.00533 -0.00276 0.00529 114 3PX 0.00334 -0.00986 0.00136 -0.00063 0.00508 115 3PY -0.01094 0.00352 0.00058 -0.00138 -0.00055 116 3PZ 0.01053 0.00301 -0.00141 -0.00187 -0.00232 117 4XX 0.00014 0.00021 -0.00052 -0.00003 -0.00015 118 4YY -0.00028 0.00025 -0.00005 0.00004 -0.00013 119 4ZZ 0.00018 -0.00011 0.00015 -0.00006 0.00008 120 4XY -0.00012 0.00026 -0.00063 -0.00005 -0.00004 121 4XZ 0.00015 -0.00074 0.00114 0.00008 0.00015 122 4YZ 0.00037 0.00027 -0.00094 -0.00009 0.00010 123 9 C 1S -0.00110 0.00120 0.00077 -0.00030 -0.00082 124 2S 0.00238 -0.00304 -0.00098 -0.00018 0.00241 125 2PX 0.00800 -0.01693 0.01533 0.00132 0.00282 126 2PY 0.00270 0.00316 -0.01612 -0.00003 0.00189 127 2PZ -0.00090 -0.00038 0.00114 0.00034 0.00001 128 3S 0.02281 -0.00140 0.00275 0.00755 -0.00819 129 3PX 0.01414 -0.01172 0.01293 0.00277 -0.00111 130 3PY 0.01101 0.00555 -0.00815 0.00281 -0.00456 131 3PZ 0.00746 -0.00093 0.00262 -0.00395 0.00252 132 4XX -0.00009 0.00040 0.00048 -0.00017 -0.00048 133 4YY 0.00034 0.00009 -0.00066 0.00001 -0.00012 134 4ZZ -0.00031 -0.00012 0.00044 -0.00003 0.00014 135 4XY -0.00004 0.00034 0.00007 0.00011 -0.00045 136 4XZ -0.00006 0.00024 0.00012 0.00002 -0.00012 137 4YZ 0.00055 -0.00044 -0.00027 0.00005 0.00031 138 10 C 1S 0.00216 -0.00265 0.00025 0.00049 0.00149 139 2S -0.00400 0.00541 -0.00081 0.00027 -0.00557 140 2PX -0.01342 0.00966 0.02150 -0.00087 -0.00911 141 2PY -0.00506 0.00748 -0.00351 -0.00070 -0.00114 142 2PZ 0.00438 -0.00730 0.00473 0.00042 0.00364 143 3S -0.01961 -0.00065 -0.00018 -0.01824 0.02167 144 3PX 0.00538 0.00484 0.01475 -0.00129 -0.00911 145 3PY 0.02786 0.00240 -0.00237 -0.00279 -0.00392 146 3PZ 0.01564 0.00038 -0.00148 0.00711 -0.01474 147 4XX -0.00048 0.00074 -0.00041 0.00017 -0.00027 148 4YY 0.00157 -0.00161 0.00080 0.00011 0.00063 149 4ZZ -0.00036 0.00025 0.00001 -0.00004 0.00008 150 4XY -0.00021 0.00038 0.00010 -0.00020 0.00063 151 4XZ 0.00032 -0.00080 -0.00022 0.00001 0.00024 152 4YZ -0.00071 -0.00005 -0.00023 0.00019 -0.00019 153 11 H 1S -0.00282 -0.00032 0.00314 -0.00036 -0.00051 154 2S -0.00670 -0.00042 0.00342 -0.00091 0.00373 155 12 H 1S -0.00255 0.00167 0.00281 0.00006 -0.00155 156 2S -0.00291 0.00270 0.00134 0.00104 -0.00347 157 13 H 1S -0.00034 0.00133 -0.00230 -0.00008 -0.00015 158 2S -0.00197 0.00246 -0.00445 -0.00059 0.00005 159 14 H 1S 0.00127 0.00018 -0.00014 -0.00010 -0.00001 160 2S 0.00701 -0.00108 0.00056 -0.00011 0.00102 161 15 H 1S 0.00989 -0.01531 0.01813 0.00050 -0.00016 162 2S -0.04454 -0.00633 0.01407 -0.00066 0.00685 163 16 C 1S 0.00181 -0.00227 0.00326 -0.00032 0.00040 164 2S -0.00166 0.00461 -0.00483 0.00000 0.00028 165 2PX 0.00203 -0.00710 0.00065 -0.00131 0.00140 166 2PY 0.01015 -0.00912 0.00077 -0.00436 0.00338 167 2PZ -0.02216 0.02909 -0.00906 0.00980 -0.00818 168 3S 0.00258 0.00179 -0.00274 0.00782 -0.01260 169 3PX -0.01596 0.00391 -0.00077 0.00221 0.01206 170 3PY -0.00252 -0.01066 0.00161 -0.00049 -0.00144 171 3PZ -0.01435 0.01445 -0.00863 0.01088 -0.00586 172 4XX 0.00315 0.00020 -0.00007 0.00034 -0.00043 173 4YY 0.00303 -0.00042 0.00004 0.00066 -0.00043 174 4ZZ 0.00062 0.00070 0.00073 -0.00020 0.00013 175 4XY -0.00114 0.00009 0.00085 -0.00044 0.00060 176 4XZ 0.00104 -0.00054 -0.00083 0.00067 -0.00020 177 4YZ -0.00080 0.00014 0.00011 -0.00048 0.00011 178 17 C 1S -0.00072 0.00133 -0.00121 -0.00007 0.00007 179 2S 0.00140 -0.00249 0.00179 -0.00017 -0.00016 180 2PX -0.00174 0.00409 -0.00170 0.00013 -0.00113 181 2PY 0.00209 -0.00388 0.00189 -0.00412 0.00154 182 2PZ -0.00399 0.00622 -0.00429 0.00747 -0.00415 183 3S -0.00623 -0.01103 0.00214 0.00150 0.00587 184 3PX -0.00854 -0.00243 -0.00453 -0.00211 0.00155 185 3PY -0.00042 0.00114 0.00038 -0.00067 -0.00218 186 3PZ -0.00383 0.00470 -0.00125 0.00561 -0.00453 187 4XX -0.00017 -0.00021 -0.00009 -0.00010 0.00022 188 4YY 0.00021 -0.00077 0.00020 -0.00029 0.00040 189 4ZZ -0.00127 0.00087 -0.00040 0.00031 -0.00014 190 4XY 0.00038 -0.00032 0.00016 -0.00006 -0.00031 191 4XZ 0.00051 -0.00038 -0.00013 0.00007 -0.00029 192 4YZ -0.00077 0.00067 -0.00025 0.00035 -0.00024 193 18 C 1S 0.00017 -0.00041 -0.00011 -0.00004 0.00010 194 2S -0.00175 0.00100 -0.00070 -0.00010 0.00063 195 2PX 0.00121 -0.00112 -0.00175 -0.00012 0.00029 196 2PY -0.00333 0.00514 -0.00268 0.00142 -0.00085 197 2PZ 0.00446 -0.00549 0.00118 -0.00261 0.00175 198 3S 0.00926 0.00797 0.00249 0.00310 -0.00579 199 3PX 0.00158 -0.00274 -0.00069 -0.00083 0.00236 200 3PY 0.00343 0.00520 0.00010 0.00194 -0.00359 201 3PZ 0.00745 -0.00357 0.00164 -0.00124 -0.00038 202 4XX 0.00025 -0.00006 0.00005 0.00002 -0.00006 203 4YY -0.00007 0.00003 0.00019 -0.00011 0.00000 204 4ZZ -0.00016 -0.00002 -0.00014 0.00008 0.00012 205 4XY -0.00031 0.00023 -0.00020 0.00028 0.00003 206 4XZ 0.00025 -0.00053 0.00020 -0.00052 0.00035 207 4YZ 0.00028 0.00003 0.00000 0.00009 -0.00021 208 19 C 1S -0.00001 0.00010 0.00006 -0.00002 -0.00002 209 2S 0.00031 0.00002 -0.00009 0.00022 -0.00005 210 2PX -0.00016 -0.00056 0.00204 -0.00025 -0.00021 211 2PY -0.00468 0.00565 -0.00022 0.00456 -0.00283 212 2PZ 0.00805 -0.01105 0.00341 -0.00830 0.00467 213 3S -0.00336 -0.00227 -0.00091 -0.00182 0.00170 214 3PX 0.00451 0.00091 0.00124 0.00101 -0.00010 215 3PY -0.00318 0.00259 -0.00143 0.00242 -0.00043 216 3PZ 0.00419 -0.00776 0.00261 -0.00705 0.00408 217 4XX -0.00015 0.00010 -0.00011 0.00001 0.00004 218 4YY -0.00006 0.00007 0.00027 0.00001 -0.00005 219 4ZZ 0.00011 -0.00006 -0.00015 -0.00000 0.00007 220 4XY 0.00011 -0.00021 0.00002 -0.00003 0.00003 221 4XZ -0.00011 0.00012 -0.00006 0.00004 -0.00002 222 4YZ 0.00006 -0.00008 -0.00012 -0.00004 0.00003 223 20 C 1S -0.00002 -0.00034 0.00008 -0.00013 0.00016 224 2S -0.00118 0.00075 -0.00048 -0.00022 -0.00030 225 2PX 0.00086 -0.00172 0.00008 -0.00031 0.00041 226 2PY -0.00308 0.00423 0.00065 0.00140 -0.00146 227 2PZ 0.00469 -0.00409 -0.00530 -0.00207 0.00226 228 3S 0.00937 0.00380 0.00085 0.00513 0.00197 229 3PX -0.00379 -0.00190 -0.00042 -0.00302 -0.00069 230 3PY 0.00209 0.00239 0.00054 0.00066 0.00071 231 3PZ 0.00711 -0.00388 -0.00233 -0.00130 0.00258 232 4XX 0.00011 -0.00005 -0.00012 0.00002 0.00016 233 4YY 0.00027 -0.00045 0.00038 -0.00039 0.00017 234 4ZZ -0.00051 0.00043 -0.00029 0.00033 -0.00017 235 4XY -0.00012 0.00006 -0.00025 0.00006 -0.00014 236 4XZ -0.00015 -0.00017 0.00035 -0.00029 0.00007 237 4YZ 0.00001 0.00037 -0.00015 0.00041 -0.00021 238 21 C 1S -0.00035 0.00045 0.00035 0.00017 -0.00037 239 2S 0.00064 -0.00054 -0.00112 0.00012 0.00078 240 2PX -0.00117 0.00318 0.00098 0.00113 -0.00142 241 2PY 0.00179 -0.00534 0.00856 -0.00417 0.00166 242 2PZ -0.00406 0.00831 -0.01050 0.00808 -0.00408 243 3S 0.00379 -0.00562 0.00071 -0.00820 -0.00249 244 3PX -0.01548 0.00225 -0.00146 0.00089 -0.00338 245 3PY 0.00017 0.00004 0.00542 0.00006 0.00573 246 3PZ -0.00365 0.00590 -0.00798 0.00602 0.00009 247 4XX -0.00039 0.00021 -0.00024 -0.00017 0.00006 248 4YY -0.00013 -0.00009 -0.00008 0.00008 -0.00016 249 4ZZ -0.00025 0.00001 0.00032 -0.00010 0.00003 250 4XY -0.00024 0.00030 -0.00010 0.00027 -0.00006 251 4XZ 0.00122 -0.00114 0.00023 -0.00032 0.00044 252 4YZ -0.00001 -0.00016 0.00027 -0.00017 0.00000 253 22 H 1S -0.00088 -0.00105 0.00147 -0.00038 -0.00022 254 2S 0.00570 -0.00183 0.00160 0.00023 -0.00207 255 23 H 1S 0.00020 -0.00041 -0.00067 -0.00013 0.00022 256 2S 0.00071 -0.00051 -0.00045 0.00033 0.00037 257 24 H 1S -0.00052 0.00025 0.00009 -0.00011 -0.00002 258 2S -0.00137 0.00023 -0.00023 -0.00049 0.00010 259 25 H 1S 0.00012 -0.00047 0.00104 -0.00007 -0.00022 260 2S 0.00246 -0.00048 0.00105 0.00007 -0.00104 261 26 H 1S 0.00039 -0.00166 -0.00005 -0.00035 0.00058 262 2S -0.00376 0.00170 -0.00453 -0.00133 -0.00260 263 27 H 1S 0.00982 -0.00898 0.00004 -0.00277 0.00024 264 2S -0.03022 -0.00232 0.00618 -0.00560 0.00860 41 42 43 44 45 41 7PZ 2.30321 42 8PX 0.00361 2.47332 43 8PY -0.01382 0.01252 2.43075 44 8PZ -0.85999 -0.01070 0.04160 2.45313 45 9PX -0.00706 -0.34653 -0.02337 0.01959 0.73100 46 9PY 0.02635 -0.02349 -0.26871 -0.07643 0.04236 47 9PZ 0.05825 0.02000 -0.07612 -0.30935 -0.03523 48 10PX -0.00585 -0.34957 -0.02001 0.02040 0.61055 49 10PY 0.02960 -0.01896 -0.25399 -0.08946 0.03578 50 10PZ 0.11485 0.01642 -0.08703 -0.30020 -0.03070 51 11XX -0.00423 0.00277 -0.00415 0.00404 -0.00364 52 11YY -0.00547 0.00138 -0.01402 0.00844 -0.00103 53 11ZZ -0.00565 0.00162 -0.00792 0.00865 -0.00143 54 11XY 0.00023 -0.00246 0.00154 -0.00075 0.00444 55 11XZ -0.00045 0.00177 -0.00048 0.00131 -0.00321 56 11YZ 0.00203 -0.00052 0.00698 -0.00608 0.00111 57 12XX -0.00498 -0.00201 -0.00842 0.00530 0.00564 58 12YY -0.00553 0.00427 0.01590 0.00043 -0.00455 59 12ZZ -0.00151 0.00313 -0.00281 -0.00842 -0.00257 60 12XY 0.00016 0.01071 -0.00437 0.00037 -0.01866 61 12XZ 0.00135 -0.00793 0.00047 -0.00396 0.01377 62 12YZ -0.00440 0.00090 -0.01451 0.01445 -0.00163 63 5 C 1S -0.00015 0.00261 0.00891 0.00118 -0.00461 64 2S 0.00088 -0.00862 -0.01631 0.00007 0.01677 65 2PX 0.00280 -0.00218 -0.00509 -0.00764 0.00198 66 2PY -0.00199 -0.01072 -0.03996 0.00798 0.02150 67 2PZ 0.00128 0.00036 0.00549 -0.00507 -0.00016 68 3S 0.00813 -0.01012 -0.06546 -0.05453 0.01103 69 3PX 0.00187 0.00448 -0.01803 -0.02051 -0.00754 70 3PY -0.00699 0.00063 -0.05428 -0.00160 0.00012 71 3PZ 0.01741 -0.02719 0.00570 -0.02357 0.04056 72 4XX 0.00028 0.00023 -0.00156 0.00046 -0.00015 73 4YY 0.00111 -0.00016 0.00445 -0.00188 0.00017 74 4ZZ -0.00029 -0.00075 -0.00056 0.00083 0.00163 75 4XY -0.00009 -0.00075 -0.00136 -0.00030 0.00118 76 4XZ -0.00087 0.00042 -0.00260 0.00168 -0.00060 77 4YZ -0.00082 -0.00066 -0.00313 0.00210 0.00130 78 6 C 1S -0.00066 0.00183 0.00624 0.00206 -0.00325 79 2S 0.00076 -0.00447 -0.01375 -0.00333 0.00872 80 2PX 0.00414 0.00079 0.00816 -0.01199 -0.00348 81 2PY 0.00197 -0.00602 -0.02380 -0.00587 0.01244 82 2PZ -0.00607 -0.00037 -0.00247 0.01827 0.00049 83 3S 0.01360 -0.01867 -0.02126 -0.02746 0.02821 84 3PX 0.00222 -0.00786 0.01412 -0.00220 0.01324 85 3PY 0.00154 -0.00603 -0.00445 0.00413 0.00972 86 3PZ 0.00157 -0.00955 0.00698 0.01915 0.01599 87 4XX 0.00014 -0.00029 0.00076 -0.00022 0.00070 88 4YY -0.00006 0.00087 0.00177 0.00070 -0.00149 89 4ZZ 0.00074 -0.00071 -0.00107 -0.00114 0.00133 90 4XY 0.00017 -0.00073 0.00036 -0.00037 0.00124 91 4XZ 0.00015 -0.00015 0.00078 0.00010 0.00009 92 4YZ -0.00002 -0.00022 -0.00040 0.00093 0.00043 93 7 C 1S 0.00032 -0.00032 -0.00156 -0.00086 0.00053 94 2S -0.00020 0.00067 0.00382 0.00119 -0.00134 95 2PX -0.00253 0.00578 0.00111 0.00766 -0.01085 96 2PY -0.00033 -0.00193 0.00543 0.00097 0.00369 97 2PZ 0.00072 -0.00026 0.00248 -0.00155 0.00049 98 3S -0.00356 -0.00218 0.01473 0.01542 0.00389 99 3PX -0.00154 0.00418 0.00112 0.00824 -0.00826 100 3PY 0.00023 -0.00677 0.00451 0.00395 0.01305 101 3PZ -0.00310 0.00222 0.00044 -0.00071 -0.00410 102 4XX 0.00030 0.00021 0.00095 -0.00052 -0.00058 103 4YY -0.00002 -0.00031 -0.00142 0.00016 0.00067 104 4ZZ -0.00007 0.00000 0.00011 0.00025 -0.00009 105 4XY 0.00003 0.00010 0.00029 -0.00026 -0.00022 106 4XZ -0.00022 0.00014 -0.00011 0.00061 -0.00029 107 4YZ -0.00034 0.00007 0.00021 0.00075 -0.00008 108 8 C 1S -0.00034 0.00017 0.00091 0.00113 -0.00034 109 2S 0.00091 -0.00060 -0.00166 -0.00249 0.00103 110 2PX -0.00187 -0.00053 -0.01641 0.00604 0.00182 111 2PY 0.00261 -0.00043 0.00824 -0.00763 0.00034 112 2PZ -0.00080 0.00061 0.00126 0.00206 -0.00106 113 3S 0.00113 0.00089 -0.00742 -0.00135 0.00102 114 3PX -0.00205 0.00017 -0.01501 0.00489 0.00090 115 3PY 0.00151 0.00229 0.00396 -0.00559 -0.00392 116 3PZ -0.00181 0.00382 0.00147 0.00200 -0.00627 117 4XX -0.00001 0.00009 0.00018 0.00024 -0.00017 118 4YY 0.00001 -0.00006 0.00021 0.00022 0.00009 119 4ZZ -0.00000 0.00005 -0.00017 -0.00005 -0.00004 120 4XY -0.00010 0.00012 0.00012 0.00028 -0.00020 121 4XZ -0.00004 -0.00022 -0.00031 0.00004 0.00044 122 4YZ -0.00015 0.00017 -0.00031 0.00038 -0.00029 123 9 C 1S 0.00031 0.00074 0.00265 -0.00108 -0.00132 124 2S -0.00133 -0.00042 -0.00665 0.00326 0.00122 125 2PX -0.00115 -0.00410 -0.00955 0.00376 0.00838 126 2PY -0.00142 0.00021 -0.00725 0.00506 -0.00076 127 2PZ -0.00020 -0.00061 -0.00075 0.00081 0.00096 128 3S 0.00387 -0.01491 0.00054 0.00296 0.02451 129 3PX 0.00093 -0.00672 -0.00466 0.00111 0.01233 130 3PY 0.00138 -0.00476 0.00161 0.00070 0.00702 131 3PZ -0.00311 0.00414 -0.00288 0.00665 -0.00454 132 4XX 0.00016 0.00021 0.00114 -0.00045 -0.00032 133 4YY -0.00001 -0.00001 -0.00011 0.00021 0.00001 134 4ZZ 0.00002 0.00001 -0.00009 -0.00013 -0.00001 135 4XY 0.00026 -0.00011 0.00097 -0.00044 0.00012 136 4XZ 0.00008 -0.00010 0.00032 -0.00022 0.00017 137 4YZ -0.00009 -0.00014 -0.00103 0.00040 0.00026 138 10 C 1S -0.00098 -0.00115 -0.00533 0.00334 0.00202 139 2S 0.00331 0.00094 0.01276 -0.00834 -0.00254 140 2PX 0.00497 0.00241 0.02877 -0.01559 -0.00483 141 2PY 0.00119 0.00196 0.00579 -0.00494 -0.00350 142 2PZ -0.00071 -0.00135 -0.01164 0.00246 0.00255 143 3S -0.01150 0.03060 0.00292 0.00288 -0.04644 144 3PX 0.00124 0.00183 0.02456 -0.00320 -0.00266 145 3PY -0.00113 0.00143 0.00490 0.00634 0.00033 146 3PZ 0.00646 -0.01070 0.00434 -0.00721 0.01539 147 4XX 0.00004 0.00010 -0.00013 0.00018 -0.00043 148 4YY -0.00042 -0.00040 -0.00206 0.00115 0.00088 149 4ZZ 0.00003 0.00042 0.00081 -0.00021 -0.00087 150 4XY -0.00041 0.00021 -0.00082 0.00059 -0.00026 151 4XZ -0.00016 -0.00014 -0.00085 0.00034 0.00032 152 4YZ -0.00002 -0.00018 0.00010 0.00006 0.00015 153 11 H 1S 0.00043 0.00126 0.00301 -0.00226 -0.00245 154 2S -0.00097 0.00179 -0.00061 0.00282 -0.00298 155 12 H 1S 0.00071 0.00033 0.00438 -0.00218 -0.00083 156 2S 0.00207 -0.00054 0.00849 -0.00551 -0.00010 157 13 H 1S -0.00077 0.00028 0.00009 0.00202 -0.00053 158 2S -0.00147 0.00137 -0.00014 0.00350 -0.00235 159 14 H 1S -0.00113 0.00034 -0.00024 0.00266 -0.00066 160 2S -0.00219 0.00078 -0.00153 0.00261 -0.00154 161 15 H 1S 0.00183 -0.00212 -0.00241 -0.00758 0.00420 162 2S 0.00137 -0.00016 0.00526 0.00865 0.00098 163 16 C 1S -0.00071 0.00125 -0.00107 0.00222 -0.00270 164 2S 0.00237 0.00003 0.00156 -0.00731 0.00031 165 2PX -0.00256 0.00291 -0.00411 0.00817 -0.00563 166 2PY -0.00128 0.01392 -0.01139 0.00408 -0.02596 167 2PZ 0.00678 -0.03078 0.02543 -0.02018 0.05869 168 3S -0.00424 -0.02817 0.01054 0.00409 0.05398 169 3PX -0.00057 -0.00247 -0.00663 -0.00708 0.00246 170 3PY -0.00706 0.00795 -0.00595 0.01385 -0.01713 171 3PZ 0.00137 -0.03252 0.01522 -0.01408 0.06001 172 4XX 0.00011 0.00025 -0.00060 0.00003 -0.00089 173 4YY 0.00019 -0.00121 0.00073 -0.00053 0.00187 174 4ZZ -0.00015 0.00106 -0.00006 0.00035 -0.00206 175 4XY -0.00019 0.00107 -0.00069 0.00026 -0.00182 176 4XZ 0.00020 -0.00173 0.00069 -0.00061 0.00300 177 4YZ -0.00015 0.00101 -0.00005 0.00023 -0.00167 178 17 C 1S 0.00021 0.00016 -0.00022 -0.00054 -0.00031 179 2S 0.00007 0.00022 0.00003 0.00043 -0.00022 180 2PX 0.00062 -0.00044 0.00258 -0.00177 0.00052 181 2PY -0.00176 0.01255 -0.00384 0.00509 -0.02356 182 2PZ 0.00274 -0.02318 0.01332 -0.00887 0.04292 183 3S -0.00669 -0.00317 -0.00336 0.00812 0.00527 184 3PX -0.00254 0.00515 0.00085 0.00602 -0.00900 185 3PY -0.00143 0.00891 0.00058 0.00327 -0.01943 186 3PZ 0.00239 -0.01335 0.01006 -0.00574 0.02320 187 4XX -0.00005 0.00022 -0.00038 0.00011 -0.00034 188 4YY -0.00018 0.00106 -0.00091 0.00045 -0.00203 189 4ZZ 0.00036 -0.00104 0.00076 -0.00077 0.00198 190 4XY -0.00007 0.00020 -0.00000 0.00034 -0.00037 191 4XZ 0.00002 -0.00006 0.00015 0.00025 0.00007 192 4YZ 0.00019 -0.00086 0.00067 -0.00054 0.00156 193 18 C 1S -0.00014 0.00007 -0.00000 0.00037 -0.00011 194 2S 0.00010 -0.00006 -0.00027 -0.00068 0.00027 195 2PX -0.00054 0.00052 -0.00045 0.00143 -0.00102 196 2PY 0.00122 -0.00431 0.00268 -0.00370 0.00802 197 2PZ -0.00162 0.00804 -0.00529 0.00505 -0.01479 198 3S 0.00381 -0.00312 0.00376 -0.00733 0.00324 199 3PX -0.00135 -0.00022 -0.00136 0.00230 0.00145 200 3PY 0.00240 -0.00488 0.00308 -0.00519 0.00864 201 3PZ -0.00072 0.00465 -0.00354 0.00280 -0.00897 202 4XX 0.00001 0.00004 -0.00008 0.00006 -0.00010 203 4YY -0.00003 0.00027 0.00005 0.00008 -0.00049 204 4ZZ -0.00003 -0.00036 0.00013 -0.00006 0.00069 205 4XY 0.00006 -0.00089 0.00035 -0.00034 0.00165 206 4XZ -0.00022 0.00160 -0.00087 0.00067 -0.00296 207 4YZ 0.00003 -0.00021 0.00019 -0.00004 0.00035 208 19 C 1S -0.00000 0.00011 0.00005 0.00003 -0.00024 209 2S 0.00011 -0.00044 0.00004 -0.00024 0.00078 210 2PX 0.00001 0.00060 0.00018 0.00007 -0.00113 211 2PY 0.00239 -0.01415 0.00851 -0.00713 0.02616 212 2PZ -0.00391 0.02557 -0.01451 0.01213 -0.04730 213 3S -0.00028 0.00314 -0.00148 0.00138 -0.00480 214 3PX 0.00019 -0.00062 0.00076 -0.00084 0.00014 215 3PY 0.00105 -0.00949 0.00484 -0.00393 0.01823 216 3PZ -0.00298 0.02048 -0.01035 0.00919 -0.03735 217 4XX -0.00001 0.00001 -0.00002 -0.00001 -0.00004 218 4YY 0.00004 -0.00003 0.00016 -0.00008 0.00007 219 4ZZ 0.00001 0.00004 -0.00012 0.00004 -0.00008 220 4XY -0.00003 0.00009 -0.00012 0.00011 -0.00017 221 4XZ 0.00002 -0.00013 0.00006 -0.00009 0.00024 222 4YZ -0.00002 0.00006 -0.00008 0.00006 -0.00010 223 20 C 1S -0.00004 0.00024 -0.00048 0.00020 -0.00041 224 2S 0.00036 -0.00022 0.00097 -0.00068 0.00082 225 2PX -0.00035 0.00084 -0.00186 0.00122 -0.00162 226 2PY 0.00092 -0.00413 0.00474 -0.00305 0.00772 227 2PZ -0.00153 0.00639 -0.00657 0.00450 -0.01192 228 3S -0.00131 -0.00438 0.00274 -0.00219 0.00390 229 3PX 0.00110 0.00323 -0.00187 0.00092 -0.00374 230 3PY 0.00038 -0.00094 0.00348 -0.00171 0.00143 231 3PZ -0.00123 0.00528 -0.00604 0.00338 -0.01039 232 4XX -0.00012 0.00009 -0.00026 0.00017 -0.00023 233 4YY -0.00013 0.00119 -0.00054 0.00048 -0.00220 234 4ZZ 0.00022 -0.00128 0.00062 -0.00061 0.00245 235 4XY 0.00009 -0.00037 0.00013 -0.00014 0.00074 236 4XZ -0.00005 0.00072 -0.00022 0.00023 -0.00126 237 4YZ 0.00011 -0.00103 0.00054 -0.00041 0.00182 238 21 C 1S 0.00011 -0.00046 0.00119 -0.00030 0.00085 239 2S -0.00014 0.00032 -0.00218 0.00042 -0.00087 240 2PX 0.00055 -0.00276 0.00504 -0.00225 0.00493 241 2PY -0.00134 0.01262 -0.00537 0.00445 -0.02330 242 2PZ 0.00337 -0.02489 0.01175 -0.01006 0.04600 243 3S 0.00240 0.01342 -0.00717 0.00310 -0.02020 244 3PX 0.00094 -0.00706 0.00395 -0.00277 0.01472 245 3PY -0.00212 0.00452 -0.00512 -0.00073 -0.01014 246 3PZ 0.00119 -0.01644 0.00833 -0.00678 0.02962 247 4XX 0.00018 0.00011 0.00014 -0.00027 -0.00003 248 4YY 0.00008 -0.00024 0.00018 0.00001 0.00043 249 4ZZ -0.00001 0.00023 0.00001 0.00007 -0.00041 250 4XY 0.00003 -0.00053 0.00033 -0.00013 0.00089 251 4XZ -0.00035 0.00124 -0.00134 0.00087 -0.00244 252 4YZ -0.00012 0.00041 -0.00014 0.00017 -0.00071 253 22 H 1S 0.00006 0.00051 -0.00023 0.00008 -0.00078 254 2S -0.00008 0.00041 0.00182 0.00347 -0.00139 255 23 H 1S -0.00022 0.00039 -0.00090 0.00062 -0.00073 256 2S -0.00067 0.00012 -0.00142 0.00098 -0.00067 257 24 H 1S 0.00003 0.00008 0.00017 -0.00011 -0.00004 258 2S -0.00012 0.00059 0.00007 0.00018 -0.00074 259 25 H 1S -0.00004 0.00003 0.00055 0.00014 -0.00009 260 2S 0.00006 -0.00036 0.00079 0.00003 0.00058 261 26 H 1S -0.00027 0.00064 -0.00096 0.00075 -0.00094 262 2S -0.00056 0.00697 0.00433 0.00412 -0.01396 263 27 H 1S -0.00122 0.01227 -0.00010 0.00544 -0.02466 264 2S -0.00148 0.01061 -0.01609 -0.00727 -0.01688 46 47 48 49 50 46 9PY 0.59537 47 9PZ 0.13638 0.66425 48 10PX 0.03821 -0.03892 0.51440 49 10PY 0.43303 0.16306 0.02997 0.32820 50 10PZ 0.16096 0.52064 -0.03196 0.16417 0.41830 51 11XX -0.00027 -0.00407 -0.00563 0.02149 -0.01270 52 11YY 0.01838 -0.01245 -0.00357 0.02341 -0.01277 53 11ZZ 0.00680 -0.01222 -0.00443 0.02167 -0.01490 54 11XY -0.00292 0.00153 0.00167 0.00010 -0.00072 55 11XZ 0.00110 -0.00250 -0.00101 -0.00145 -0.00060 56 11YZ -0.01315 0.01142 -0.00089 -0.00168 0.00166 57 12XX 0.00245 -0.00565 0.00361 0.00702 -0.00610 58 12YY -0.04241 0.00548 -0.00544 -0.02281 -0.00185 59 12ZZ -0.00877 0.02013 -0.00313 0.00100 0.01195 60 12XY 0.00844 -0.00095 -0.01476 0.00518 0.00043 61 12XZ -0.00047 0.00711 0.01075 0.00076 0.00518 62 12YZ 0.02689 -0.02635 -0.00051 0.01539 -0.01677 63 5 C 1S -0.01628 -0.00248 -0.00535 -0.01331 -0.00446 64 2S 0.03193 -0.00123 0.01668 0.02502 0.00474 65 2PX 0.00892 0.01369 0.01070 0.00517 0.02229 66 2PY 0.07920 -0.01651 0.02056 0.07595 -0.00955 67 2PZ -0.01342 0.01089 0.00204 -0.01217 0.01555 68 3S 0.11994 0.11052 0.01005 0.09607 0.10045 69 3PX 0.01530 0.04244 -0.00201 0.00737 0.04090 70 3PY 0.07496 0.01057 -0.00133 0.05899 0.01284 71 3PZ -0.00433 0.03216 0.03305 -0.00020 0.02560 72 4XX 0.00344 -0.00122 -0.00047 0.00282 -0.00070 73 4YY -0.00790 0.00289 0.00032 -0.00480 0.00127 74 4ZZ 0.00173 -0.00143 0.00137 0.00029 -0.00110 75 4XY 0.00222 0.00070 0.00091 0.00265 0.00061 76 4XZ 0.00444 -0.00279 -0.00045 0.00271 -0.00173 77 4YZ 0.00558 -0.00382 0.00156 0.00442 -0.00303 78 6 C 1S -0.01170 -0.00394 -0.00300 -0.00782 -0.00285 79 2S 0.02618 0.00665 0.00763 0.01703 0.00574 80 2PX -0.01522 0.02200 0.00202 -0.01081 0.01648 81 2PY 0.04868 0.01110 0.00689 0.02804 0.01258 82 2PZ 0.00576 -0.03441 -0.00156 0.00393 -0.03248 83 3S 0.04900 0.04464 0.02234 0.03451 0.03548 84 3PX -0.02773 0.00267 0.01493 -0.01800 -0.00033 85 3PY 0.00674 -0.01026 0.00654 0.00266 -0.00746 86 3PZ -0.02416 -0.04460 0.01261 -0.02023 -0.03952 87 4XX -0.00060 0.00036 0.00065 -0.00069 0.00060 88 4YY -0.00220 -0.00142 -0.00118 -0.00115 -0.00136 89 4ZZ 0.00149 0.00175 0.00098 0.00093 0.00143 90 4XY -0.00011 0.00063 0.00110 -0.00016 0.00070 91 4XZ -0.00124 -0.00040 0.00034 -0.00097 -0.00016 92 4YZ 0.00136 -0.00209 0.00033 0.00185 -0.00186 93 7 C 1S 0.00340 0.00155 0.00035 0.00152 0.00136 94 2S -0.00624 -0.00250 -0.00084 -0.00278 -0.00196 95 2PX -0.00340 -0.01402 -0.00749 0.00952 -0.01670 96 2PY -0.01145 -0.00183 0.00386 -0.00995 0.00115 97 2PZ -0.00417 0.00267 0.00043 -0.00290 0.00315 98 3S -0.03544 -0.02960 0.00449 -0.02432 -0.02483 99 3PX -0.00715 -0.01629 -0.00600 0.00281 -0.01703 100 3PY -0.01477 -0.00883 0.01163 -0.01273 -0.00540 101 3PZ -0.00116 0.00534 -0.00340 -0.00114 0.00483 102 4XX -0.00167 0.00085 -0.00024 -0.00128 0.00067 103 4YY 0.00244 -0.00030 0.00034 0.00178 -0.00019 104 4ZZ -0.00001 -0.00047 -0.00010 -0.00015 -0.00042 105 4XY -0.00120 0.00053 -0.00002 -0.00088 0.00041 106 4XZ 0.00006 -0.00111 -0.00028 0.00025 -0.00115 107 4YZ -0.00054 -0.00129 -0.00010 -0.00043 -0.00119 108 8 C 1S -0.00176 -0.00215 -0.00042 -0.00099 -0.00231 109 2S 0.00343 0.00460 0.00118 0.00193 0.00505 110 2PX 0.03154 -0.01121 -0.00109 0.02906 -0.01126 111 2PY -0.01530 0.01398 0.00221 -0.01473 0.01500 112 2PZ -0.00371 -0.00355 0.00050 -0.00200 -0.00168 113 3S 0.01069 0.00145 0.00141 0.00730 0.00330 114 3PX 0.02812 -0.00856 -0.00155 0.02503 -0.00850 115 3PY -0.00867 0.01052 -0.00211 -0.00838 0.01032 116 3PZ -0.00105 -0.00248 -0.00470 -0.00113 -0.00134 117 4XX -0.00024 -0.00050 -0.00012 0.00002 -0.00057 118 4YY -0.00034 -0.00050 0.00006 -0.00026 -0.00040 119 4ZZ 0.00029 0.00011 -0.00003 0.00014 0.00014 120 4XY -0.00022 -0.00051 -0.00015 0.00009 -0.00057 121 4XZ 0.00057 -0.00006 0.00031 0.00013 0.00006 122 4YZ 0.00055 -0.00068 -0.00014 0.00081 -0.00068 123 9 C 1S -0.00515 0.00219 -0.00131 -0.00501 0.00186 124 2S 0.01241 -0.00598 0.00165 0.01160 -0.00463 125 2PX 0.01976 -0.00745 0.00540 0.01467 -0.00706 126 2PY 0.01421 -0.01014 0.00127 0.01981 -0.00994 127 2PZ 0.00220 -0.00174 -0.00024 0.00091 -0.00280 128 3S 0.00882 -0.01100 0.02278 0.00807 -0.00806 129 3PX 0.01288 -0.00378 0.00928 0.00826 -0.00311 130 3PY 0.00165 -0.00332 0.00790 0.00490 -0.00277 131 3PZ 0.00394 -0.01144 -0.00344 0.00180 -0.00876 132 4XX -0.00203 0.00082 -0.00018 -0.00196 0.00074 133 4YY 0.00038 -0.00045 -0.00018 0.00063 -0.00061 134 4ZZ 0.00005 0.00029 0.00000 -0.00018 0.00040 135 4XY -0.00164 0.00068 0.00011 -0.00139 0.00046 136 4XZ -0.00058 0.00039 0.00030 -0.00057 0.00048 137 4YZ 0.00197 -0.00080 0.00023 0.00191 -0.00071 138 10 C 1S 0.01044 -0.00650 0.00240 0.00833 -0.00515 139 2S -0.02262 0.01516 -0.00354 -0.01752 0.01178 140 2PX -0.05471 0.02957 -0.00227 -0.05657 0.02868 141 2PY -0.01339 0.01077 -0.00536 -0.01213 0.00987 142 2PZ 0.02265 -0.00494 0.00305 0.01766 -0.00171 143 3S -0.03108 0.00707 -0.04156 -0.02732 0.00524 144 3PX -0.04422 0.00598 -0.00014 -0.04347 0.00734 145 3PY -0.00646 -0.01247 0.00014 -0.00479 -0.01012 146 3PZ 0.00700 0.00873 0.01343 0.00834 0.00756 147 4XX 0.00044 -0.00041 -0.00008 0.00036 -0.00008 148 4YY 0.00395 -0.00208 0.00078 0.00320 -0.00153 149 4ZZ -0.00185 0.00042 -0.00089 -0.00174 0.00019 150 4XY 0.00110 -0.00084 0.00005 0.00077 -0.00030 151 4XZ 0.00170 -0.00061 0.00012 0.00166 -0.00064 152 4YZ -0.00000 -0.00014 0.00025 0.00015 -0.00017 153 11 H 1S -0.00608 0.00467 -0.00245 -0.00654 0.00472 154 2S -0.00269 -0.00528 -0.00280 -0.00465 -0.00412 155 12 H 1S -0.00812 0.00420 -0.00150 -0.00926 0.00348 156 2S -0.01510 0.01009 -0.00120 -0.01433 0.00765 157 13 H 1S -0.00009 -0.00368 -0.00055 0.00040 -0.00406 158 2S 0.00007 -0.00624 -0.00207 0.00146 -0.00647 159 14 H 1S 0.00048 -0.00471 -0.00079 -0.00035 -0.00449 160 2S 0.00232 -0.00328 -0.00162 0.00067 -0.00354 161 15 H 1S 0.00681 0.01553 0.00391 -0.00054 0.01494 162 2S -0.01916 -0.02013 0.00097 -0.02147 -0.01516 163 16 C 1S 0.00216 -0.00424 -0.00252 0.00074 -0.00258 164 2S -0.00401 0.01362 0.00134 -0.00125 0.00926 165 2PX 0.00856 -0.01578 -0.00758 0.00585 -0.01275 166 2PY 0.02190 -0.00756 -0.02337 0.01944 -0.00825 167 2PZ -0.04802 0.03738 0.05265 -0.03716 0.03184 168 3S -0.01011 -0.00363 0.04607 -0.00682 -0.00819 169 3PX 0.00212 0.01606 0.00219 0.00306 0.01424 170 3PY 0.01448 -0.02214 -0.01546 0.01033 -0.02020 171 3PZ -0.02789 0.02993 0.05168 -0.02043 0.02376 172 4XX 0.00182 -0.00020 -0.00119 0.00155 -0.00013 173 4YY -0.00109 0.00087 0.00155 -0.00067 0.00056 174 4ZZ -0.00001 -0.00061 -0.00155 -0.00029 -0.00030 175 4XY 0.00089 -0.00037 -0.00142 0.00037 -0.00018 176 4XZ -0.00119 0.00106 0.00239 -0.00047 0.00045 177 4YZ -0.00005 -0.00033 -0.00125 -0.00019 -0.00016 178 17 C 1S 0.00037 0.00097 -0.00022 0.00079 0.00111 179 2S 0.00010 -0.00111 -0.00028 -0.00053 -0.00147 180 2PX -0.00461 0.00318 0.00172 -0.00360 0.00379 181 2PY 0.00659 -0.00932 -0.01829 0.00436 -0.00783 182 2PZ -0.02543 0.01654 0.03668 -0.01959 0.01369 183 3S 0.00176 -0.01046 0.00324 0.00022 -0.00972 184 3PX -0.00351 -0.01037 -0.00792 -0.00237 -0.00934 185 3PY 0.00051 -0.00532 -0.01495 -0.00043 -0.00423 186 3PZ -0.01780 0.01015 0.02018 -0.01469 0.00890 187 4XX 0.00062 -0.00019 -0.00042 0.00053 -0.00018 188 4YY 0.00158 -0.00077 -0.00178 0.00130 -0.00070 189 4ZZ -0.00152 0.00132 0.00182 -0.00115 0.00114 190 4XY 0.00031 -0.00068 -0.00039 0.00014 -0.00059 191 4XZ -0.00005 -0.00056 -0.00007 0.00001 -0.00055 192 4YZ -0.00126 0.00099 0.00145 -0.00100 0.00082 193 18 C 1S -0.00011 -0.00067 -0.00017 -0.00007 -0.00067 194 2S -0.00005 0.00140 0.00029 0.00024 0.00122 195 2PX 0.00049 -0.00251 -0.00118 0.00092 -0.00287 196 2PY -0.00495 0.00687 0.00792 -0.00355 0.00553 197 2PZ 0.00958 -0.00928 -0.01468 0.00787 -0.00793 198 3S -0.00277 0.01202 0.00435 -0.00264 0.01126 199 3PX 0.00071 -0.00374 0.00064 0.00095 -0.00360 200 3PY -0.00312 0.00877 0.00844 -0.00267 0.00774 201 3PZ 0.00798 -0.00539 -0.00880 0.00641 -0.00442 202 4XX 0.00024 -0.00014 -0.00015 0.00019 -0.00016 203 4YY -0.00011 -0.00015 -0.00030 -0.00018 -0.00006 204 4ZZ -0.00038 0.00014 0.00055 -0.00025 0.00009 205 4XY -0.00079 0.00067 0.00142 -0.00058 0.00054 206 4XZ 0.00156 -0.00124 -0.00259 0.00124 -0.00106 207 4YZ -0.00023 0.00006 0.00030 -0.00018 0.00007 208 19 C 1S -0.00009 -0.00006 -0.00017 -0.00009 0.00007 209 2S -0.00004 0.00039 0.00062 0.00007 0.00005 210 2PX -0.00001 -0.00025 -0.00083 -0.00069 0.00052 211 2PY -0.01562 0.01298 0.02396 -0.01303 0.01127 212 2PZ 0.02704 -0.02247 -0.04267 0.02196 -0.01953 213 3S 0.00161 -0.00270 -0.00446 0.00135 -0.00269 214 3PX -0.00157 0.00151 0.00055 -0.00140 0.00163 215 3PY -0.01002 0.00741 0.01629 -0.00803 0.00630 216 3PZ 0.01852 -0.01700 -0.03332 0.01471 -0.01450 217 4XX 0.00001 0.00004 -0.00004 0.00004 0.00004 218 4YY -0.00032 0.00013 0.00012 -0.00037 0.00020 219 4ZZ 0.00019 -0.00009 -0.00010 0.00024 -0.00014 220 4XY 0.00024 -0.00022 -0.00022 0.00021 -0.00022 221 4XZ -0.00010 0.00018 0.00026 -0.00007 0.00013 222 4YZ 0.00016 -0.00010 -0.00010 0.00018 -0.00013 223 20 C 1S 0.00099 -0.00043 -0.00057 0.00075 -0.00038 224 2S -0.00200 0.00119 0.00108 -0.00151 0.00099 225 2PX 0.00409 -0.00247 -0.00253 0.00364 -0.00244 226 2PY -0.00935 0.00595 0.00794 -0.00854 0.00608 227 2PZ 0.01211 -0.00820 -0.01186 0.01250 -0.00886 228 3S -0.00841 0.00615 0.00502 -0.00591 0.00501 229 3PX 0.00507 -0.00325 -0.00422 0.00385 -0.00265 230 3PY -0.00858 0.00330 0.00234 -0.00743 0.00350 231 3PZ 0.01070 -0.00619 -0.00988 0.01030 -0.00639 232 4XX 0.00041 -0.00025 -0.00029 0.00037 -0.00022 233 4YY 0.00101 -0.00090 -0.00190 0.00073 -0.00074 234 4ZZ -0.00116 0.00109 0.00215 -0.00087 0.00089 235 4XY -0.00014 0.00021 0.00057 -0.00001 0.00010 236 4XZ 0.00040 -0.00044 -0.00104 0.00018 -0.00029 237 4YZ -0.00098 0.00079 0.00163 -0.00075 0.00064 238 21 C 1S -0.00234 0.00056 0.00109 -0.00186 0.00066 239 2S 0.00423 -0.00084 -0.00163 0.00363 -0.00119 240 2PX -0.01041 0.00470 0.00670 -0.00880 0.00469 241 2PY 0.01023 -0.00838 -0.01920 0.00578 -0.00602 242 2PZ -0.02123 0.01836 0.03907 -0.01317 0.01297 243 3S 0.01875 -0.00963 -0.01985 0.01350 -0.00708 244 3PX -0.00548 0.00555 0.01318 -0.00427 0.00396 245 3PY 0.00519 0.00384 -0.00750 0.00353 0.00375 246 3PZ -0.01822 0.01353 0.02568 -0.01148 0.00948 247 4XX -0.00038 0.00042 0.00004 -0.00020 0.00027 248 4YY -0.00022 -0.00011 0.00035 -0.00015 -0.00011 249 4ZZ -0.00005 -0.00012 -0.00028 -0.00016 -0.00001 250 4XY -0.00064 0.00024 0.00073 -0.00057 0.00024 251 4XZ 0.00253 -0.00156 -0.00228 0.00206 -0.00138 252 4YZ 0.00030 -0.00026 -0.00056 0.00012 -0.00015 253 22 H 1S 0.00089 -0.00027 -0.00048 0.00032 -0.00022 254 2S -0.00163 -0.00765 -0.00117 -0.00208 -0.00609 255 23 H 1S 0.00186 -0.00115 -0.00124 0.00184 -0.00117 256 2S 0.00284 -0.00143 -0.00130 0.00255 -0.00137 257 24 H 1S -0.00034 0.00024 -0.00000 -0.00043 0.00049 258 2S -0.00028 -0.00022 -0.00058 -0.00039 0.00013 259 25 H 1S -0.00097 -0.00033 0.00018 -0.00108 0.00007 260 2S -0.00064 -0.00023 0.00083 -0.00087 0.00020 261 26 H 1S 0.00159 -0.00139 -0.00165 0.00119 -0.00198 262 2S -0.00706 -0.00830 -0.01219 -0.00510 -0.00832 263 27 H 1S -0.00034 -0.01132 -0.02168 -0.00176 -0.00714 264 2S 0.02492 0.01787 -0.01198 0.01804 0.01905 51 52 53 54 55 51 11XX 2.69331 52 11YY -0.28066 2.69303 53 11ZZ -0.28079 -0.28054 2.69323 54 11XY -0.00002 -0.00013 -0.00019 1.98258 55 11XZ 0.00003 0.00022 0.00004 0.00026 1.98270 56 11YZ -0.00042 -0.00025 -0.00010 -0.00003 0.00005 57 12XX 0.25001 0.17881 0.18365 0.00147 -0.00170 58 12YY 0.18842 0.24730 0.18602 0.00147 -0.00217 59 12ZZ 0.18740 0.18009 0.24901 0.00195 -0.00182 60 12XY -0.00117 -0.00102 -0.00094 0.04288 -0.00088 61 12XZ 0.00037 0.00004 0.00056 -0.00085 0.04246 62 12YZ -0.00238 -0.00423 -0.00430 0.00042 -0.00029 63 5 C 1S 0.00084 0.00152 -0.00001 0.00063 -0.00029 64 2S -0.00408 -0.00575 -0.00196 -0.00084 0.00073 65 2PX 0.00305 0.00183 0.00384 -0.00009 0.00136 66 2PY -0.00704 -0.01312 -0.00377 -0.00280 0.00159 67 2PZ 0.00181 0.00246 0.00336 0.00008 0.00017 68 3S -0.00940 0.00336 -0.00873 -0.00238 0.00014 69 3PX 0.01669 0.01934 0.01013 -0.00141 -0.00043 70 3PY 0.01780 0.01897 0.01282 -0.00338 -0.00109 71 3PZ 0.02380 0.02089 0.01576 0.00630 -0.00452 72 4XX -0.00018 0.00027 -0.00009 0.00022 0.00000 73 4YY 0.00142 0.00151 0.00115 0.00025 -0.00005 74 4ZZ -0.00094 -0.00011 -0.00086 0.00015 0.00009 75 4XY 0.00049 0.00056 0.00050 -0.00005 -0.00001 76 4XZ -0.00010 -0.00028 -0.00009 -0.00020 0.00010 77 4YZ -0.00068 -0.00082 -0.00072 -0.00026 0.00015 78 6 C 1S 0.00066 0.00061 0.00096 0.00022 0.00011 79 2S -0.00401 -0.00418 -0.00403 -0.00074 -0.00002 80 2PX 0.00169 0.00204 -0.00049 0.00061 0.00018 81 2PY -0.00626 -0.00656 -0.00605 -0.00112 -0.00059 82 2PZ -0.00128 0.00044 -0.00140 -0.00010 0.00024 83 3S 0.00776 0.01494 -0.00027 0.00424 -0.00258 84 3PX 0.00367 -0.00078 0.00341 0.00144 -0.00027 85 3PY 0.00549 -0.00443 0.00789 -0.00116 -0.00152 86 3PZ 0.03329 0.02631 0.02564 0.00275 -0.00264 87 4XX -0.00095 -0.00062 -0.00082 0.00008 0.00009 88 4YY -0.00034 0.00014 -0.00028 0.00020 0.00012 89 4ZZ 0.00083 0.00049 0.00057 0.00004 -0.00016 90 4XY -0.00014 0.00019 -0.00014 0.00006 0.00001 91 4XZ 0.00031 0.00031 0.00033 0.00010 0.00004 92 4YZ -0.00013 -0.00015 -0.00003 0.00006 0.00006 93 7 C 1S -0.00038 -0.00026 -0.00054 -0.00004 -0.00005 94 2S 0.00002 0.00071 0.00032 0.00028 0.00023 95 2PX 0.00056 0.00012 0.00082 0.00062 0.00037 96 2PY 0.00148 0.00141 0.00221 -0.00015 0.00022 97 2PZ 0.00033 0.00020 0.00054 0.00003 0.00001 98 3S 0.00671 -0.00476 0.01008 -0.00116 -0.00065 99 3PX 0.00714 0.00198 0.00703 -0.00006 -0.00048 100 3PY 0.00962 0.00306 0.00943 0.00014 -0.00076 101 3PZ -0.00903 -0.00961 -0.00593 -0.00162 0.00038 102 4XX 0.00026 0.00029 0.00018 0.00001 0.00002 103 4YY 0.00001 -0.00022 0.00010 -0.00007 -0.00004 104 4ZZ -0.00016 -0.00004 -0.00015 -0.00002 -0.00000 105 4XY 0.00054 0.00021 0.00048 -0.00006 -0.00003 106 4XZ 0.00005 -0.00002 0.00007 -0.00003 -0.00001 107 4YZ -0.00005 -0.00006 -0.00003 -0.00001 0.00001 108 8 C 1S 0.00011 0.00020 0.00010 0.00003 0.00002 109 2S -0.00051 -0.00092 -0.00033 -0.00010 -0.00007 110 2PX -0.00267 -0.00355 -0.00165 -0.00038 -0.00028 111 2PY 0.00109 0.00123 0.00053 0.00011 0.00006 112 2PZ 0.00056 0.00044 0.00073 0.00008 0.00006 113 3S 0.00608 0.00566 0.00367 0.00037 0.00001 114 3PX -0.00074 -0.00006 -0.00050 -0.00002 -0.00004 115 3PY 0.00403 0.00574 0.00233 0.00028 0.00017 116 3PZ -0.00544 -0.00257 -0.00481 -0.00036 0.00066 117 4XX -0.00005 -0.00009 -0.00003 0.00002 0.00002 118 4YY 0.00009 0.00007 0.00011 0.00000 0.00001 119 4ZZ -0.00007 -0.00005 -0.00008 -0.00001 -0.00000 120 4XY 0.00005 0.00007 0.00003 0.00002 0.00002 121 4XZ -0.00003 -0.00008 -0.00001 -0.00007 0.00000 122 4YZ -0.00013 -0.00014 -0.00011 -0.00002 0.00004 123 9 C 1S 0.00024 0.00048 0.00025 0.00016 -0.00010 124 2S -0.00056 -0.00097 -0.00042 -0.00049 0.00039 125 2PX -0.00219 -0.00344 -0.00191 -0.00098 0.00012 126 2PY -0.00038 -0.00149 -0.00066 -0.00018 0.00064 127 2PZ 0.00004 0.00038 0.00001 -0.00007 0.00009 128 3S -0.00851 -0.01228 -0.00698 0.00049 -0.00011 129 3PX -0.00522 -0.00575 -0.00467 -0.00043 -0.00014 130 3PY -0.00454 -0.00514 -0.00417 0.00043 0.00024 131 3PZ -0.00313 -0.00280 -0.00306 -0.00084 0.00079 132 4XX -0.00005 0.00003 -0.00009 0.00002 0.00002 133 4YY -0.00013 -0.00013 -0.00010 0.00006 -0.00003 134 4ZZ 0.00013 0.00010 0.00016 -0.00001 -0.00001 135 4XY -0.00001 0.00001 -0.00011 0.00006 -0.00004 136 4XZ 0.00002 -0.00001 -0.00002 0.00000 0.00002 137 4YZ -0.00013 -0.00027 -0.00009 -0.00003 0.00000 138 10 C 1S -0.00050 -0.00077 -0.00049 -0.00034 0.00025 139 2S 0.00067 0.00154 0.00081 0.00103 -0.00064 140 2PX 0.00321 0.00498 0.00224 0.00054 -0.00036 141 2PY 0.00088 0.00269 0.00200 0.00103 -0.00092 142 2PZ -0.00088 -0.00223 -0.00031 -0.00047 0.00028 143 3S 0.00824 0.00841 0.00759 -0.00357 0.00104 144 3PX -0.00311 -0.00415 -0.00281 -0.00031 0.00053 145 3PY -0.01145 -0.01215 -0.00971 -0.00024 0.00046 146 3PZ -0.00726 -0.00694 -0.00469 0.00196 0.00011 147 4XX 0.00009 0.00016 0.00019 -0.00002 0.00009 148 4YY -0.00053 -0.00066 -0.00031 -0.00024 0.00013 149 4ZZ 0.00020 0.00011 0.00004 0.00001 -0.00009 150 4XY 0.00005 -0.00001 0.00014 -0.00011 0.00010 151 4XZ -0.00005 0.00001 -0.00007 -0.00000 -0.00000 152 4YZ 0.00027 0.00039 0.00024 0.00005 0.00002 153 11 H 1S 0.00108 0.00110 0.00112 0.00029 -0.00027 154 2S 0.00327 0.00282 0.00169 -0.00031 -0.00057 155 12 H 1S 0.00046 0.00128 0.00045 0.00022 -0.00020 156 2S 0.00060 0.00145 0.00041 0.00059 -0.00052 157 13 H 1S 0.00005 0.00023 0.00004 -0.00000 0.00013 158 2S 0.00056 0.00137 0.00030 0.00001 0.00026 159 14 H 1S -0.00063 -0.00029 -0.00067 -0.00007 0.00003 160 2S -0.00293 -0.00286 -0.00239 -0.00055 -0.00001 161 15 H 1S -0.00322 -0.00290 -0.00356 -0.00028 -0.00030 162 2S 0.02047 0.01680 0.01585 0.00060 -0.00128 163 16 C 1S -0.00093 -0.00087 -0.00060 0.00032 -0.00041 164 2S 0.00058 0.00063 0.00006 -0.00041 0.00117 165 2PX 0.00010 -0.00045 0.00047 0.00117 -0.00176 166 2PY -0.00421 -0.00263 -0.00305 0.00079 0.00055 167 2PZ 0.00827 0.00478 0.00532 -0.00230 0.00153 168 3S -0.00048 -0.00255 -0.00054 -0.00229 -0.00336 169 3PX 0.00596 0.00591 0.00599 0.00299 0.00315 170 3PY 0.00290 0.00058 0.00302 -0.00169 -0.00055 171 3PZ 0.00564 0.00311 0.00507 -0.00128 -0.00140 172 4XX -0.00128 -0.00149 -0.00119 0.00020 -0.00017 173 4YY -0.00125 -0.00118 -0.00123 0.00001 -0.00008 174 4ZZ -0.00049 -0.00034 -0.00036 0.00003 0.00001 175 4XY 0.00038 0.00042 0.00041 0.00005 0.00006 176 4XZ -0.00025 -0.00040 -0.00035 0.00006 0.00002 177 4YZ 0.00027 0.00037 0.00029 -0.00010 -0.00003 178 17 C 1S 0.00023 0.00019 0.00020 0.00012 0.00006 179 2S -0.00050 -0.00020 -0.00042 -0.00025 -0.00013 180 2PX 0.00025 0.00053 0.00023 0.00015 0.00014 181 2PY -0.00091 0.00013 -0.00061 -0.00003 -0.00016 182 2PZ 0.00202 0.00085 0.00101 -0.00060 -0.00015 183 3S 0.00461 0.00168 0.00479 -0.00068 -0.00039 184 3PX 0.00481 0.00228 0.00493 -0.00087 -0.00120 185 3PY -0.00049 0.00041 0.00018 -0.00031 0.00033 186 3PZ 0.00193 0.00046 0.00116 -0.00070 0.00057 187 4XX 0.00013 0.00002 0.00015 0.00003 -0.00004 188 4YY -0.00008 0.00002 0.00004 0.00008 -0.00001 189 4ZZ 0.00053 0.00037 0.00042 -0.00007 0.00009 190 4XY -0.00015 -0.00006 -0.00015 -0.00005 -0.00007 191 4XZ -0.00015 -0.00014 -0.00017 -0.00003 -0.00003 192 4YZ 0.00034 0.00018 0.00024 -0.00009 0.00008 193 18 C 1S 0.00000 -0.00000 0.00001 -0.00001 -0.00005 194 2S 0.00069 0.00046 0.00068 0.00010 0.00014 195 2PX -0.00017 -0.00024 -0.00021 -0.00002 -0.00020 196 2PY 0.00111 0.00062 0.00081 -0.00020 0.00036 197 2PZ -0.00166 -0.00093 -0.00094 0.00058 -0.00022 198 3S -0.00566 -0.00306 -0.00571 0.00010 0.00110 199 3PX -0.00010 -0.00058 -0.00013 0.00012 -0.00058 200 3PY -0.00216 -0.00125 -0.00261 -0.00020 0.00034 201 3PZ -0.00335 -0.00170 -0.00285 0.00043 -0.00019 202 4XX -0.00011 -0.00009 -0.00010 -0.00001 0.00001 203 4YY 0.00001 0.00003 0.00000 0.00000 0.00000 204 4ZZ 0.00009 0.00006 0.00008 0.00003 -0.00000 205 4XY 0.00016 0.00005 0.00012 -0.00001 -0.00000 206 4XZ -0.00009 -0.00005 -0.00003 0.00004 -0.00000 207 4YZ -0.00013 -0.00008 -0.00014 -0.00001 -0.00002 208 19 C 1S -0.00002 -0.00000 -0.00002 0.00002 -0.00001 209 2S -0.00012 -0.00013 -0.00014 -0.00001 0.00008 210 2PX -0.00007 0.00010 -0.00002 0.00003 -0.00004 211 2PY 0.00181 0.00085 0.00103 -0.00054 0.00026 212 2PZ -0.00330 -0.00141 -0.00195 0.00092 -0.00033 213 3S 0.00182 0.00126 0.00195 -0.00025 -0.00007 214 3PX -0.00220 -0.00169 -0.00211 -0.00006 0.00020 215 3PY 0.00153 0.00060 0.00108 -0.00035 -0.00017 216 3PZ -0.00159 -0.00061 -0.00070 0.00054 -0.00028 217 4XX 0.00006 0.00004 0.00007 0.00001 0.00001 218 4YY 0.00000 0.00001 -0.00000 -0.00002 0.00001 219 4ZZ -0.00005 -0.00002 -0.00003 0.00002 0.00001 220 4XY -0.00001 -0.00003 -0.00002 0.00001 -0.00002 221 4XZ 0.00004 0.00003 0.00002 -0.00001 0.00000 222 4YZ -0.00002 -0.00000 -0.00001 -0.00000 -0.00001 223 20 C 1S 0.00006 0.00001 0.00007 0.00011 -0.00007 224 2S 0.00037 0.00054 0.00034 -0.00014 0.00016 225 2PX -0.00005 -0.00038 -0.00016 0.00036 -0.00037 226 2PY 0.00103 0.00073 0.00069 -0.00050 0.00029 227 2PZ -0.00167 -0.00092 -0.00104 0.00053 -0.00014 228 3S -0.00472 -0.00402 -0.00419 -0.00072 0.00136 229 3PX 0.00181 0.00183 0.00169 0.00051 -0.00060 230 3PY -0.00111 -0.00112 -0.00103 -0.00064 0.00032 231 3PZ -0.00283 -0.00201 -0.00222 0.00020 -0.00010 232 4XX -0.00002 -0.00005 -0.00001 0.00003 -0.00003 233 4YY -0.00013 -0.00004 -0.00008 0.00003 0.00001 234 4ZZ 0.00022 0.00014 0.00015 -0.00001 0.00001 235 4XY 0.00007 0.00004 0.00004 0.00002 -0.00002 236 4XZ 0.00004 0.00008 0.00006 0.00001 -0.00000 237 4YZ -0.00000 -0.00007 -0.00005 -0.00004 0.00001 238 21 C 1S -0.00000 0.00015 -0.00001 -0.00019 0.00015 239 2S 0.00012 -0.00050 0.00008 0.00054 -0.00019 240 2PX -0.00019 0.00052 -0.00016 -0.00092 0.00074 241 2PY -0.00102 -0.00020 -0.00063 0.00021 0.00005 242 2PZ 0.00216 0.00037 0.00092 -0.00038 0.00012 243 3S -0.00122 -0.00000 -0.00119 0.00024 -0.00239 244 3PX 0.00677 0.00560 0.00566 0.00042 0.00034 245 3PY -0.00087 -0.00004 -0.00043 0.00039 0.00099 246 3PZ 0.00178 0.00056 0.00109 -0.00016 0.00093 247 4XX 0.00012 0.00020 0.00012 -0.00002 0.00005 248 4YY 0.00010 0.00003 0.00008 -0.00001 0.00000 249 4ZZ 0.00007 0.00007 0.00010 0.00004 0.00000 250 4XY 0.00016 0.00002 0.00006 -0.00006 -0.00001 251 4XZ -0.00047 -0.00032 -0.00034 0.00010 -0.00009 252 4YZ -0.00002 0.00003 0.00002 -0.00001 -0.00005 253 22 H 1S 0.00046 0.00033 0.00035 0.00010 -0.00012 254 2S -0.00223 -0.00237 -0.00181 -0.00012 -0.00043 255 23 H 1S 0.00007 -0.00011 0.00003 0.00016 -0.00016 256 2S -0.00010 -0.00038 -0.00012 0.00014 -0.00020 257 24 H 1S 0.00017 0.00019 0.00020 0.00001 0.00001 258 2S 0.00057 0.00049 0.00060 -0.00001 -0.00008 259 25 H 1S -0.00006 0.00005 -0.00012 -0.00003 -0.00009 260 2S -0.00112 -0.00057 -0.00122 -0.00006 -0.00017 261 26 H 1S 0.00015 -0.00009 0.00005 0.00008 -0.00019 262 2S 0.00185 0.00075 0.00212 -0.00047 -0.00059 263 27 H 1S -0.00385 -0.00175 -0.00267 -0.00094 -0.00038 264 2S 0.01198 0.01374 0.01068 -0.00209 0.00036 56 57 58 59 60 56 11YZ 1.98263 57 12XX 0.00614 0.06082 58 12YY 0.00481 0.05967 0.06720 59 12ZZ 0.00471 0.05922 0.06133 0.06351 60 12XY 0.00016 -0.00090 -0.00137 -0.00061 0.00261 61 12XZ -0.00021 0.00036 0.00055 0.00021 -0.00105 62 12YZ 0.04356 -0.00081 -0.00470 -0.00327 0.00098 63 5 C 1S 0.00027 -0.00011 -0.00008 0.00171 -0.00091 64 2S -0.00101 -0.00091 -0.00105 -0.00491 0.00192 65 2PX -0.00181 0.00208 0.00417 0.00293 0.00018 66 2PY 0.00063 -0.00678 0.00176 -0.01641 0.00797 67 2PZ -0.00068 0.00456 0.00496 0.00280 -0.00258 68 3S -0.00024 -0.00034 -0.00565 -0.00347 0.00251 69 3PX 0.00017 0.00532 0.00271 0.00915 -0.00042 70 3PY -0.00019 0.00296 0.00048 -0.00103 0.00304 71 3PZ -0.00340 0.00697 0.00759 0.00719 -0.00238 72 4XX -0.00013 0.00017 0.00000 -0.00023 -0.00018 73 4YY -0.00004 0.00032 0.00130 0.00083 0.00002 74 4ZZ -0.00019 -0.00035 -0.00089 -0.00007 -0.00005 75 4XY 0.00013 0.00027 0.00055 -0.00006 -0.00005 76 4XZ 0.00012 -0.00030 -0.00050 -0.00051 0.00034 77 4YZ 0.00002 -0.00009 -0.00061 -0.00005 0.00030 78 6 C 1S 0.00054 0.00141 0.00179 0.00088 -0.00050 79 2S -0.00131 -0.00399 -0.00515 -0.00278 0.00112 80 2PX -0.00132 0.00111 0.00005 0.00733 -0.00204 81 2PY -0.00238 -0.01261 -0.01030 -0.01369 0.00421 82 2PZ 0.00131 0.00090 -0.00370 0.00043 0.00124 83 3S -0.00038 -0.00119 -0.00463 0.00248 0.00010 84 3PX -0.00165 0.00262 0.00267 0.00607 -0.00211 85 3PY -0.00201 -0.00408 -0.00089 -0.00598 0.00222 86 3PZ -0.00284 0.00874 0.00735 0.00866 -0.00061 87 4XX -0.00003 -0.00017 -0.00013 -0.00021 -0.00005 88 4YY 0.00011 0.00006 0.00043 -0.00006 -0.00001 89 4ZZ -0.00027 0.00003 -0.00013 0.00012 -0.00002 90 4XY 0.00003 -0.00012 0.00005 -0.00017 0.00002 91 4XZ -0.00001 0.00028 0.00029 0.00033 -0.00003 92 4YZ 0.00016 0.00020 0.00032 -0.00023 0.00016 93 7 C 1S -0.00023 -0.00108 -0.00109 -0.00067 0.00023 94 2S 0.00061 0.00185 0.00189 0.00100 -0.00038 95 2PX 0.00128 0.00637 0.00566 0.00537 -0.00227 96 2PY 0.00087 0.00273 0.00352 0.00151 -0.00019 97 2PZ -0.00030 -0.00013 -0.00047 -0.00049 0.00019 98 3S -0.00097 0.00319 0.00571 0.00099 -0.00031 99 3PX -0.00027 0.00480 0.00528 0.00384 -0.00108 100 3PY -0.00164 0.00200 0.00360 0.00108 0.00015 101 3PZ 0.00069 -0.00259 -0.00261 -0.00259 0.00029 102 4XX -0.00001 0.00021 0.00019 0.00048 -0.00010 103 4YY -0.00007 -0.00026 -0.00021 -0.00051 0.00014 104 4ZZ 0.00002 -0.00010 -0.00014 -0.00003 0.00001 105 4XY -0.00005 0.00025 0.00021 0.00042 -0.00008 106 4XZ 0.00006 0.00013 0.00005 0.00009 -0.00002 107 4YZ 0.00006 0.00016 0.00002 0.00015 -0.00001 108 8 C 1S 0.00013 0.00053 0.00020 0.00045 -0.00002 109 2S -0.00039 -0.00122 -0.00062 -0.00105 0.00008 110 2PX 0.00017 -0.00243 -0.00211 -0.00597 0.00096 111 2PY -0.00102 -0.00034 -0.00063 0.00202 -0.00017 112 2PZ 0.00038 0.00227 0.00261 0.00243 -0.00104 113 3S -0.00043 -0.00001 0.00073 -0.00019 0.00045 114 3PX 0.00030 -0.00109 -0.00121 -0.00397 0.00071 115 3PY -0.00039 0.00118 0.00081 0.00298 -0.00019 116 3PZ 0.00158 -0.00010 -0.00037 -0.00006 -0.00026 117 4XX 0.00002 0.00006 0.00007 0.00004 -0.00002 118 4YY 0.00002 0.00008 0.00008 0.00002 0.00003 119 4ZZ -0.00002 -0.00005 -0.00008 -0.00002 0.00000 120 4XY 0.00005 0.00011 0.00011 0.00009 -0.00002 121 4XZ 0.00003 -0.00027 -0.00016 -0.00031 0.00014 122 4YZ 0.00003 0.00009 0.00007 0.00011 -0.00001 123 9 C 1S 0.00003 0.00035 0.00039 0.00058 -0.00059 124 2S -0.00006 -0.00082 -0.00084 -0.00135 0.00124 125 2PX 0.00049 -0.00605 -0.00379 -0.00793 0.00319 126 2PY 0.00008 0.00076 0.00034 0.00090 0.00120 127 2PZ -0.00007 -0.00052 -0.00134 -0.00109 0.00095 128 3S -0.00034 -0.00361 -0.00296 -0.00420 0.00144 129 3PX 0.00047 -0.00500 -0.00355 -0.00644 0.00194 130 3PY 0.00055 -0.00004 -0.00036 0.00046 0.00010 131 3PZ 0.00109 -0.00116 -0.00162 -0.00174 0.00095 132 4XX -0.00001 -0.00007 0.00000 0.00012 -0.00003 133 4YY 0.00006 0.00010 0.00002 -0.00003 -0.00006 134 4ZZ -0.00006 0.00001 0.00002 0.00001 -0.00004 135 4XY 0.00002 -0.00004 -0.00002 0.00011 -0.00003 136 4XZ 0.00000 -0.00003 0.00004 0.00009 0.00003 137 4YZ 0.00005 -0.00010 0.00001 -0.00024 0.00009 138 10 C 1S -0.00004 -0.00071 -0.00060 -0.00107 0.00109 139 2S -0.00004 0.00121 0.00125 0.00200 -0.00231 140 2PX -0.00075 -0.00035 0.00083 0.00416 -0.00223 141 2PY -0.00034 0.00519 0.00294 0.00404 -0.00447 142 2PZ 0.00009 -0.00241 -0.00003 -0.00372 0.00166 143 3S 0.00176 0.00273 0.00254 0.00414 -0.00202 144 3PX 0.00099 -0.00289 -0.00087 0.00024 -0.00021 145 3PY 0.00166 -0.00125 -0.00191 -0.00217 -0.00134 146 3PZ -0.00092 -0.00204 -0.00014 -0.00314 0.00019 147 4XX -0.00009 0.00019 0.00014 0.00023 -0.00000 148 4YY 0.00001 -0.00039 -0.00031 -0.00079 0.00036 149 4ZZ 0.00010 0.00008 -0.00001 0.00025 -0.00018 150 4XY -0.00006 0.00014 -0.00001 0.00009 0.00003 151 4XZ 0.00003 -0.00012 -0.00003 -0.00026 0.00011 152 4YZ -0.00007 -0.00003 0.00011 0.00010 0.00004 153 11 H 1S 0.00003 -0.00009 0.00090 0.00025 -0.00088 154 2S 0.00054 0.00015 0.00022 0.00100 -0.00029 155 12 H 1S -0.00026 0.00055 -0.00026 0.00071 -0.00051 156 2S -0.00025 0.00076 0.00013 0.00145 -0.00112 157 13 H 1S 0.00042 0.00042 0.00065 0.00018 0.00008 158 2S 0.00069 0.00107 0.00100 0.00067 0.00016 159 14 H 1S 0.00025 -0.00015 -0.00029 0.00009 -0.00001 160 2S 0.00038 -0.00111 -0.00162 -0.00046 0.00010 161 15 H 1S -0.00173 -0.00630 -0.00390 -0.00445 0.00055 162 2S -0.00378 0.00205 0.00316 0.00324 -0.00068 163 16 C 1S 0.00007 -0.00076 -0.00073 -0.00151 -0.00061 164 2S 0.00012 0.00025 0.00070 0.00233 0.00156 165 2PX 0.00050 0.00024 0.00094 -0.00304 -0.00340 166 2PY -0.00013 -0.00084 -0.00547 -0.00328 -0.00102 167 2PZ 0.00030 0.00128 0.01018 0.00869 0.00480 168 3S -0.00065 -0.00127 -0.00073 0.00201 -0.00004 169 3PX 0.00351 0.00222 0.00306 0.00187 -0.00037 170 3PY -0.00123 0.00030 -0.00317 -0.00071 -0.00137 171 3PZ 0.00077 0.00127 0.00664 0.00593 0.00126 172 4XX 0.00005 -0.00029 -0.00023 -0.00047 -0.00035 173 4YY 0.00009 -0.00032 -0.00040 -0.00046 -0.00003 174 4ZZ -0.00002 -0.00015 -0.00017 -0.00010 0.00020 175 4XY 0.00003 -0.00002 0.00009 0.00005 0.00004 176 4XZ 0.00012 -0.00008 0.00005 -0.00015 -0.00028 177 4YZ -0.00006 0.00011 -0.00001 0.00012 0.00027 178 17 C 1S -0.00004 0.00028 0.00012 0.00052 -0.00023 179 2S 0.00008 -0.00039 -0.00023 -0.00095 0.00063 180 2PX -0.00027 0.00086 0.00018 0.00106 -0.00036 181 2PY -0.00043 0.00023 -0.00235 -0.00042 0.00022 182 2PZ 0.00063 0.00025 0.00464 0.00314 0.00078 183 3S 0.00036 0.00032 0.00012 -0.00119 0.00049 184 3PX -0.00121 0.00171 0.00114 0.00144 -0.00054 185 3PY -0.00023 0.00056 -0.00119 0.00068 -0.00015 186 3PZ 0.00014 0.00011 0.00279 0.00215 0.00048 187 4XX -0.00001 0.00003 0.00007 -0.00006 -0.00005 188 4YY 0.00001 0.00000 -0.00028 -0.00014 -0.00008 189 4ZZ -0.00001 0.00011 0.00039 0.00036 0.00015 190 4XY -0.00002 -0.00006 -0.00004 -0.00014 -0.00003 191 4XZ -0.00001 -0.00004 -0.00001 -0.00010 -0.00007 192 4YZ -0.00000 0.00006 0.00028 0.00027 0.00013 193 18 C 1S 0.00003 0.00003 0.00006 0.00001 0.00002 194 2S -0.00001 0.00027 0.00025 0.00033 -0.00001 195 2PX 0.00013 0.00007 0.00063 0.00026 -0.00004 196 2PY -0.00005 0.00054 0.00140 0.00095 0.00052 197 2PZ 0.00007 -0.00001 -0.00121 -0.00144 -0.00111 198 3S 0.00038 -0.00131 -0.00129 -0.00010 0.00026 199 3PX 0.00008 -0.00007 0.00003 -0.00059 -0.00013 200 3PY 0.00004 -0.00055 0.00009 0.00017 0.00046 201 3PZ 0.00015 -0.00055 -0.00165 -0.00152 -0.00089 202 4XX 0.00001 -0.00005 -0.00002 -0.00008 0.00000 203 4YY -0.00001 -0.00000 -0.00007 0.00000 0.00002 204 4ZZ 0.00004 0.00003 0.00008 0.00006 -0.00002 205 4XY 0.00003 0.00001 0.00018 0.00012 0.00003 206 4XZ -0.00003 0.00001 -0.00026 -0.00015 -0.00006 207 4YZ 0.00000 -0.00002 -0.00002 -0.00001 -0.00002 208 19 C 1S -0.00001 -0.00003 -0.00005 0.00005 -0.00002 209 2S 0.00007 -0.00001 0.00007 -0.00013 0.00010 210 2PX -0.00010 -0.00016 -0.00087 -0.00032 -0.00012 211 2PY 0.00014 -0.00019 0.00213 0.00130 0.00102 212 2PZ -0.00032 -0.00002 -0.00494 -0.00341 -0.00159 213 3S -0.00047 0.00040 0.00041 0.00012 0.00018 214 3PX 0.00017 -0.00059 -0.00090 -0.00062 0.00015 215 3PY -0.00006 0.00006 0.00162 0.00094 0.00050 216 3PZ -0.00045 0.00008 -0.00325 -0.00221 -0.00093 217 4XX 0.00001 0.00004 0.00004 0.00004 -0.00002 218 4YY -0.00001 -0.00004 0.00001 0.00001 0.00005 219 4ZZ 0.00001 0.00002 -0.00005 -0.00001 -0.00002 220 4XY 0.00001 -0.00002 -0.00002 -0.00004 -0.00003 221 4XZ -0.00000 -0.00000 0.00002 0.00002 0.00002 222 4YZ -0.00001 0.00002 -0.00003 -0.00001 -0.00001 223 20 C 1S 0.00004 0.00003 -0.00001 -0.00016 -0.00025 224 2S -0.00012 0.00018 0.00022 0.00053 0.00054 225 2PX 0.00021 -0.00036 -0.00049 -0.00071 -0.00093 226 2PY -0.00005 -0.00011 0.00176 0.00162 0.00107 227 2PZ -0.00005 0.00083 -0.00181 -0.00058 -0.00100 228 3S 0.00105 -0.00126 -0.00111 -0.00063 0.00183 229 3PX -0.00051 0.00044 0.00033 0.00015 -0.00089 230 3PY -0.00017 -0.00060 0.00064 0.00024 0.00118 231 3PZ -0.00011 0.00006 -0.00224 -0.00136 -0.00059 232 4XX 0.00002 0.00001 0.00005 -0.00004 -0.00008 233 4YY -0.00002 -0.00003 -0.00024 -0.00015 -0.00004 234 4ZZ 0.00003 0.00003 0.00022 0.00017 0.00004 235 4XY 0.00002 0.00002 0.00007 0.00004 -0.00003 236 4XZ -0.00002 -0.00003 -0.00007 -0.00006 0.00001 237 4YZ 0.00002 -0.00002 0.00011 0.00008 0.00005 238 21 C 1S -0.00007 -0.00008 -0.00034 0.00029 0.00055 239 2S 0.00033 0.00020 0.00080 -0.00049 -0.00117 240 2PX -0.00045 0.00006 -0.00036 0.00170 0.00222 241 2PY -0.00025 -0.00114 -0.00317 -0.00215 -0.00018 242 2PZ 0.00061 0.00083 0.00370 0.00297 0.00034 243 3S -0.00204 -0.00017 -0.00020 -0.00211 -0.00237 244 3PX 0.00035 0.00164 0.00191 0.00333 0.00004 245 3PY 0.00123 -0.00058 -0.00149 -0.00079 0.00067 246 3PZ 0.00100 0.00069 0.00289 0.00221 0.00067 247 4XX -0.00001 0.00004 0.00006 0.00013 0.00011 248 4YY -0.00002 0.00004 0.00002 0.00001 -0.00003 249 4ZZ 0.00002 -0.00001 -0.00003 0.00000 0.00004 250 4XY -0.00001 0.00000 0.00022 0.00007 -0.00004 251 4XZ -0.00001 -0.00006 -0.00047 -0.00040 -0.00025 252 4YZ -0.00003 -0.00001 -0.00005 -0.00007 -0.00001 253 22 H 1S -0.00001 -0.00010 -0.00032 -0.00039 -0.00029 254 2S -0.00056 -0.00065 -0.00114 -0.00131 -0.00032 255 23 H 1S 0.00012 -0.00006 0.00006 -0.00009 -0.00036 256 2S 0.00022 -0.00005 0.00007 -0.00031 -0.00053 257 24 H 1S -0.00005 0.00012 -0.00002 0.00017 -0.00001 258 2S -0.00016 0.00029 0.00012 0.00033 -0.00004 259 25 H 1S -0.00004 -0.00018 -0.00042 0.00002 0.00004 260 2S -0.00004 -0.00035 -0.00063 -0.00028 -0.00000 261 26 H 1S 0.00014 -0.00018 0.00024 -0.00037 -0.00016 262 2S -0.00052 0.00106 0.00133 0.00144 -0.00084 263 27 H 1S -0.00108 0.00108 -0.00384 -0.00307 0.00312 264 2S -0.00064 0.00408 0.00069 0.00223 0.00338 61 62 63 64 65 61 12XZ 0.00180 62 12YZ -0.00074 0.00500 63 5 C 1S 0.00053 -0.00091 2.05260 64 2S -0.00076 0.00211 -0.06226 0.33013 65 2PX -0.00331 0.00353 0.00566 -0.01229 0.37071 66 2PY -0.00259 0.00140 0.00728 -0.01207 0.01337 67 2PZ 0.00142 -0.00068 0.00239 -0.00356 -0.00218 68 3S 0.00068 0.00206 -0.17440 0.26404 0.00160 69 3PX -0.00109 0.00207 -0.00500 0.01082 0.18541 70 3PY 0.00045 0.00294 -0.00348 0.01564 -0.06351 71 3PZ 0.00208 -0.00198 -0.00154 0.00400 -0.01230 72 4XX 0.00013 0.00016 -0.01258 -0.01196 -0.00118 73 4YY -0.00010 -0.00082 -0.01484 -0.00739 0.00753 74 4ZZ 0.00006 0.00030 -0.01648 -0.00315 -0.00402 75 4XY 0.00005 -0.00010 -0.00299 0.00632 0.00109 76 4XZ -0.00013 0.00023 -0.00039 0.00067 0.00250 77 4YZ -0.00036 0.00024 0.00002 -0.00011 0.00560 78 6 C 1S -0.00012 -0.00155 0.01774 -0.03389 0.01328 79 2S 0.00024 0.00287 -0.03404 0.05934 -0.02341 80 2PX -0.00147 0.00355 -0.01390 0.03054 0.14816 81 2PY 0.00172 0.00573 -0.01967 0.04156 -0.09582 82 2PZ -0.00145 -0.00133 -0.07729 0.15672 -0.06135 83 3S 0.00150 0.00224 -0.00526 0.03060 -0.04092 84 3PX -0.00113 0.00098 0.00012 -0.00065 0.10323 85 3PY 0.00062 0.00145 0.00081 -0.00229 -0.04626 86 3PZ -0.00026 -0.00056 -0.00979 0.03470 -0.02299 87 4XX -0.00001 -0.00008 0.00239 -0.00496 0.00633 88 4YY -0.00004 -0.00012 0.00289 -0.00617 0.00082 89 4ZZ 0.00010 0.00013 -0.00596 0.01084 -0.00519 90 4XY 0.00003 0.00004 0.00016 -0.00075 0.00278 91 4XZ -0.00014 -0.00009 -0.00183 0.00345 0.01117 92 4YZ -0.00012 -0.00027 -0.00233 0.00454 -0.00288 93 7 C 1S 0.00006 0.00059 -0.00355 0.00915 -0.00410 94 2S -0.00014 -0.00116 0.00870 -0.01980 0.01082 95 2PX -0.00067 -0.00181 0.00819 -0.01715 -0.00900 96 2PY -0.00001 -0.00324 0.01138 -0.02977 0.02067 97 2PZ 0.00011 0.00082 0.00963 -0.02260 0.00823 98 3S -0.00072 -0.00179 0.00422 -0.01996 0.02807 99 3PX -0.00055 -0.00064 0.00574 -0.01073 -0.01256 100 3PY -0.00002 -0.00104 0.00848 -0.01957 0.03035 101 3PZ -0.00002 0.00020 -0.00265 -0.00301 0.00079 102 4XX -0.00009 0.00003 0.00015 -0.00001 0.00719 103 4YY 0.00010 0.00007 0.00021 -0.00038 -0.00710 104 4ZZ -0.00000 0.00001 -0.00110 0.00279 -0.00099 105 4XY -0.00005 0.00001 0.00019 -0.00053 0.00419 106 4XZ -0.00002 -0.00011 -0.00095 0.00206 -0.00187 107 4YZ -0.00005 -0.00015 -0.00154 0.00312 -0.00177 108 8 C 1S -0.00012 -0.00024 -0.00348 0.00593 -0.00419 109 2S 0.00027 0.00061 0.00613 -0.01249 0.00954 110 2PX 0.00120 0.00074 0.00391 -0.00609 -0.08968 111 2PY -0.00027 0.00190 0.00717 -0.01610 0.06860 112 2PZ 0.00022 -0.00169 0.00222 -0.00396 0.01069 113 3S 0.00015 0.00131 0.02274 -0.03162 0.02267 114 3PX 0.00088 0.00042 0.00467 -0.00443 -0.07382 115 3PY -0.00036 0.00077 0.00834 -0.01175 0.04928 116 3PZ -0.00012 -0.00083 0.00229 -0.00285 0.00624 117 4XX -0.00003 -0.00005 -0.00021 0.00015 0.00025 118 4YY -0.00004 -0.00008 0.00005 -0.00052 -0.00021 119 4ZZ 0.00001 0.00005 -0.00033 0.00089 -0.00013 120 4XY -0.00004 -0.00007 0.00035 -0.00068 0.00016 121 4XZ 0.00002 -0.00004 0.00008 -0.00029 0.00027 122 4YZ -0.00007 0.00002 0.00016 -0.00042 0.00031 123 9 C 1S 0.00036 -0.00048 -0.00341 0.00884 -0.00657 124 2S -0.00076 0.00105 0.00853 -0.01949 0.01654 125 2PX 0.00002 -0.00019 0.00797 -0.02059 -0.00376 126 2PY -0.00213 0.00197 0.01412 -0.03501 0.03004 127 2PZ -0.00067 0.00084 -0.00230 0.00361 -0.00136 128 3S -0.00100 0.00129 0.00125 -0.01590 0.03245 129 3PX 0.00034 -0.00041 0.00266 -0.00917 -0.01203 130 3PY -0.00110 0.00091 0.00514 -0.01628 0.03048 131 3PZ -0.00075 0.00104 0.00732 -0.00814 0.01180 132 4XX -0.00002 -0.00007 -0.00027 0.00069 0.00559 133 4YY 0.00006 -0.00003 -0.00096 0.00221 -0.00839 134 4ZZ 0.00005 0.00003 0.00051 -0.00064 0.00060 135 4XY -0.00000 -0.00007 -0.00062 0.00110 0.00194 136 4XZ -0.00006 -0.00002 0.00091 -0.00207 0.00563 137 4YZ -0.00003 -0.00003 0.00149 -0.00313 -0.00021 138 10 C 1S -0.00074 0.00066 0.01701 -0.03358 0.02768 139 2S 0.00163 -0.00149 -0.03401 0.05904 -0.05453 140 2PX 0.00129 -0.00219 -0.02712 0.05450 0.11857 141 2PY 0.00320 -0.00137 -0.04901 0.10425 -0.15616 142 2PZ -0.00075 -0.00003 0.05742 -0.11470 0.07706 143 3S 0.00154 -0.00056 0.00154 0.02406 -0.06448 144 3PX -0.00004 -0.00111 -0.00071 0.00322 0.09450 145 3PY 0.00072 0.00020 -0.00457 0.01619 -0.07051 146 3PZ -0.00007 -0.00101 0.00722 -0.02975 0.02827 147 4XX -0.00015 0.00019 0.00120 -0.00305 0.00993 148 4YY -0.00010 0.00017 -0.00081 0.00044 -0.00253 149 4ZZ 0.00011 -0.00017 -0.00216 0.00316 -0.00319 150 4XY -0.00012 0.00022 -0.00174 0.00299 0.00549 151 4XZ 0.00002 -0.00003 0.00280 -0.00553 -0.00508 152 4YZ -0.00007 -0.00002 0.00508 -0.00992 0.00757 153 11 H 1S 0.00075 -0.00121 0.01194 -0.02598 0.00885 154 2S 0.00026 -0.00064 0.01388 -0.02628 0.01012 155 12 H 1S 0.00041 0.00004 -0.00854 0.01886 -0.01266 156 2S 0.00082 -0.00051 -0.01216 0.02496 -0.02307 157 13 H 1S -0.00035 -0.00084 -0.00072 0.00112 -0.00248 158 2S -0.00053 -0.00095 0.00113 -0.00181 -0.00246 159 14 H 1S -0.00013 -0.00044 -0.00862 0.01910 -0.00651 160 2S -0.00011 -0.00022 -0.01197 0.02497 -0.01265 161 15 H 1S 0.00125 0.00448 0.01152 -0.02559 0.00006 162 2S 0.00099 0.00352 0.01404 -0.02685 -0.00683 163 16 C 1S 0.00102 -0.00018 -0.00088 0.00187 0.00396 164 2S -0.00219 0.00007 0.00288 -0.00454 -0.00722 165 2PX 0.00427 -0.00112 -0.00344 0.00592 0.01438 166 2PY -0.00259 0.00181 0.00209 -0.00262 0.00039 167 2PZ -0.00208 -0.00249 0.00159 -0.00487 -0.00967 168 3S -0.00091 -0.00148 -0.00483 0.00046 -0.06032 169 3PX 0.00032 -0.00026 0.00492 -0.00036 0.01851 170 3PY -0.00021 0.00074 0.00951 -0.00852 -0.00198 171 3PZ 0.00050 -0.00278 0.00491 -0.00559 -0.01042 172 4XX 0.00016 -0.00002 0.00016 -0.00061 -0.00143 173 4YY 0.00014 -0.00011 -0.00047 0.00078 0.00074 174 4ZZ -0.00005 0.00010 -0.00001 0.00020 0.00079 175 4XY 0.00006 -0.00006 -0.00008 -0.00026 -0.00003 176 4XZ 0.00020 -0.00024 -0.00002 0.00000 -0.00059 177 4YZ -0.00012 0.00016 -0.00034 0.00044 0.00061 178 17 C 1S -0.00021 0.00012 -0.00045 0.00244 0.00600 179 2S 0.00038 -0.00027 0.00112 -0.00478 -0.01487 180 2PX -0.00032 0.00085 -0.00388 0.01507 0.03170 181 2PY 0.00014 0.00131 -0.00229 0.00545 0.01208 182 2PZ 0.00128 -0.00263 -0.00145 0.00087 -0.00193 183 3S 0.00173 -0.00062 0.00040 -0.00560 -0.03368 184 3PX 0.00055 -0.00003 -0.00195 0.00321 0.00123 185 3PY -0.00036 0.00100 0.00943 -0.00339 0.03695 186 3PZ 0.00051 -0.00160 0.00499 -0.00256 0.01683 187 4XX 0.00004 -0.00003 -0.00026 -0.00028 -0.00059 188 4YY -0.00004 0.00008 0.00036 -0.00007 -0.00047 189 4ZZ -0.00006 -0.00007 0.00009 0.00007 -0.00036 190 4XY 0.00012 -0.00004 0.00042 -0.00064 -0.00134 191 4XZ 0.00010 -0.00006 0.00028 -0.00045 -0.00070 192 4YZ -0.00004 -0.00006 0.00024 -0.00024 -0.00056 193 18 C 1S 0.00013 -0.00010 0.00005 -0.00102 -0.00229 194 2S -0.00030 0.00018 -0.00066 0.00185 0.00333 195 2PX 0.00056 -0.00048 0.00077 -0.00415 -0.00724 196 2PY -0.00066 0.00030 0.00019 0.00093 0.00224 197 2PZ 0.00036 -0.00002 0.00004 -0.00020 0.00438 198 3S -0.00130 0.00059 0.00510 0.00231 0.03652 199 3PX 0.00066 -0.00024 -0.00618 0.00294 -0.01426 200 3PY -0.00056 0.00023 0.00042 0.00163 0.00881 201 3PZ 0.00018 0.00015 0.00025 0.00025 0.00624 202 4XX -0.00001 -0.00002 0.00033 -0.00065 -0.00112 203 4YY -0.00000 0.00005 -0.00017 0.00039 0.00091 204 4ZZ 0.00004 -0.00005 -0.00016 0.00004 -0.00007 205 4XY 0.00002 -0.00009 -0.00010 -0.00016 -0.00072 206 4XZ -0.00003 0.00012 -0.00005 0.00000 0.00020 207 4YZ 0.00004 -0.00001 -0.00004 0.00026 0.00068 208 19 C 1S 0.00003 0.00002 -0.00021 0.00087 0.00177 209 2S -0.00008 -0.00004 0.00069 -0.00195 -0.00360 210 2PX -0.00007 0.00023 -0.00100 0.00325 0.00567 211 2PY -0.00012 -0.00073 0.00011 -0.00009 -0.00237 212 2PZ -0.00004 0.00181 0.00017 0.00056 0.00743 213 3S -0.00010 -0.00008 0.00188 -0.00552 -0.01119 214 3PX -0.00023 0.00021 -0.00124 0.00319 0.00605 215 3PY 0.00015 -0.00058 -0.00271 0.00155 -0.00539 216 3PZ -0.00008 0.00132 -0.00127 0.00106 0.00393 217 4XX -0.00001 0.00000 0.00001 0.00012 0.00038 218 4YY -0.00001 -0.00002 -0.00002 -0.00001 -0.00001 219 4ZZ -0.00001 0.00003 0.00003 0.00007 0.00006 220 4XY 0.00004 -0.00003 0.00005 -0.00016 -0.00033 221 4XZ -0.00001 0.00001 0.00002 -0.00005 -0.00026 222 4YZ -0.00000 0.00003 -0.00005 0.00006 -0.00006 223 20 C 1S 0.00017 -0.00005 -0.00001 -0.00020 -0.00008 224 2S -0.00040 0.00014 -0.00016 0.00019 0.00028 225 2PX 0.00071 -0.00035 -0.00008 0.00004 0.00054 226 2PY -0.00042 -0.00060 -0.00027 -0.00009 0.00020 227 2PZ -0.00009 0.00101 -0.00007 0.00175 0.00209 228 3S -0.00135 0.00027 0.00159 0.00177 0.00297 229 3PX 0.00063 -0.00013 -0.00028 -0.00134 0.00042 230 3PY -0.00052 -0.00025 -0.00148 0.00063 -0.00148 231 3PZ -0.00016 0.00094 -0.00087 0.00185 0.00104 232 4XX 0.00007 -0.00002 -0.00001 0.00001 0.00000 233 4YY -0.00003 0.00008 0.00006 -0.00008 0.00029 234 4ZZ 0.00001 -0.00008 -0.00001 -0.00004 -0.00035 235 4XY 0.00003 -0.00003 0.00001 -0.00005 -0.00006 236 4XZ -0.00002 0.00003 0.00001 -0.00008 0.00018 237 4YZ -0.00000 -0.00005 0.00006 -0.00002 -0.00027 238 21 C 1S -0.00039 0.00015 -0.00032 0.00078 0.00112 239 2S 0.00081 -0.00037 0.00071 -0.00196 -0.00327 240 2PX -0.00163 0.00063 -0.00024 0.00176 0.00028 241 2PY -0.00041 0.00066 0.00064 -0.00172 0.00135 242 2PZ 0.00034 -0.00143 0.00046 -0.00020 -0.00765 243 3S 0.00193 0.00006 -0.00228 -0.00347 -0.00605 244 3PX -0.00034 -0.00046 0.00218 -0.00133 0.00078 245 3PY -0.00091 0.00038 0.00043 0.00046 0.00020 246 3PZ -0.00025 -0.00092 0.00041 0.00055 -0.00643 247 4XX -0.00014 0.00002 -0.00006 0.00003 0.00039 248 4YY 0.00005 -0.00000 -0.00005 0.00007 -0.00008 249 4ZZ -0.00002 0.00002 -0.00005 0.00001 -0.00001 250 4XY 0.00012 -0.00010 0.00011 -0.00019 -0.00039 251 4XZ 0.00009 0.00012 0.00004 0.00007 0.00016 252 4YZ 0.00003 0.00003 -0.00001 0.00002 0.00017 253 22 H 1S 0.00026 -0.00003 0.00039 -0.00088 -0.00099 254 2S 0.00050 0.00020 -0.00024 0.00029 0.00107 255 23 H 1S 0.00032 -0.00019 -0.00008 0.00007 0.00025 256 2S 0.00049 -0.00020 0.00017 -0.00004 -0.00084 257 24 H 1S -0.00010 0.00005 -0.00053 0.00115 0.00194 258 2S -0.00008 0.00012 -0.00106 0.00187 0.00320 259 25 H 1S 0.00013 0.00002 -0.00082 0.00171 0.00295 260 2S 0.00025 0.00008 -0.00147 0.00259 0.00445 261 26 H 1S 0.00029 -0.00053 0.00089 -0.00811 -0.00772 262 2S 0.00019 -0.00058 0.00855 -0.01287 0.01526 263 27 H 1S 0.00155 0.00259 -0.00714 0.01543 0.02355 264 2S 0.00002 0.00221 -0.00526 0.01421 0.04870 66 67 68 69 70 66 2PY 0.38400 67 2PZ -0.00987 0.43347 68 3S -0.01951 -0.00808 0.28648 69 3PX -0.08418 -0.01587 0.02705 0.12508 70 3PY 0.09658 -0.01770 0.02027 -0.04329 0.05601 71 3PZ -0.01347 0.08834 0.00646 -0.00497 -0.00296 72 4XX 0.00578 0.00273 -0.00772 -0.00287 0.00105 73 4YY 0.00390 0.00595 -0.00485 0.00148 -0.00292 74 4ZZ -0.00663 -0.00730 -0.00448 0.00037 0.00023 75 4XY 0.00704 0.00474 0.00534 -0.00185 0.00061 76 4XZ 0.00473 -0.00522 0.00152 0.00043 0.00099 77 4YZ 0.00704 -0.00951 -0.00029 0.00101 0.00004 78 6 C 1S 0.01475 0.07494 0.00103 -0.00604 -0.00669 79 2S -0.02571 -0.15106 0.02580 -0.00245 -0.00453 80 2PX -0.10076 -0.06784 0.00697 0.11004 -0.03225 81 2PY 0.05936 -0.06745 0.02069 -0.03037 0.08124 82 2PZ -0.06089 -0.29348 0.14472 -0.00231 0.00797 83 3S -0.05349 -0.15207 0.00684 0.00287 0.00245 84 3PX -0.04689 -0.03500 -0.01820 0.06372 -0.02967 85 3PY 0.06595 -0.03380 -0.01359 -0.03061 0.03821 86 3PZ -0.03380 -0.10326 0.01922 0.00120 0.00047 87 4XX 0.00118 0.00637 -0.00259 0.00302 -0.00097 88 4YY 0.00662 0.00881 -0.00677 -0.00264 0.00012 89 4ZZ -0.00602 -0.00399 0.00945 0.00039 0.00175 90 4XY 0.00212 0.00087 -0.00150 0.00075 -0.00067 91 4XZ -0.00279 -0.00614 0.00474 0.00647 -0.00284 92 4YZ 0.00980 -0.00730 0.00596 -0.00405 0.00257 93 7 C 1S -0.00633 -0.01162 -0.00373 0.00552 0.00964 94 2S 0.01605 0.02940 -0.01236 -0.00822 -0.01423 95 2PX 0.01881 0.02116 -0.03058 -0.03691 -0.02032 96 2PY 0.01118 0.02678 -0.01027 -0.00403 -0.03070 97 2PZ 0.00944 0.02869 -0.06587 -0.00954 -0.02158 98 3S 0.04971 0.02091 -0.01548 -0.00786 -0.00804 99 3PX 0.02769 0.01180 -0.02500 -0.02758 -0.00192 100 3PY 0.01765 0.01165 -0.01509 0.00940 -0.01001 101 3PZ 0.00308 0.00106 -0.01536 -0.00279 -0.00520 102 4XX -0.00462 -0.00059 -0.00011 0.00493 -0.00253 103 4YY 0.00446 0.00086 -0.00066 -0.00495 0.00230 104 4ZZ -0.00142 -0.00560 0.00273 0.00101 0.00168 105 4XY -0.00331 -0.00028 -0.00080 0.00262 -0.00247 106 4XZ -0.00109 -0.00475 0.00276 -0.00124 -0.00022 107 4YZ -0.00241 -0.00748 0.00480 -0.00025 -0.00079 108 8 C 1S -0.00707 -0.00196 0.02779 -0.00696 -0.01142 109 2S 0.01623 0.00476 -0.04108 0.00775 0.01356 110 2PX 0.07275 0.01177 -0.03558 -0.07799 0.03377 111 2PY -0.02036 0.00928 -0.04694 0.04636 -0.02172 112 2PZ 0.00952 -0.03044 -0.01933 0.00597 0.00585 113 3S 0.03304 0.00594 -0.06182 0.00993 0.01541 114 3PX 0.05191 0.00535 -0.01421 -0.05987 0.02610 115 3PY -0.02581 0.00063 -0.01619 0.03518 -0.01860 116 3PZ 0.00383 -0.01785 -0.00804 0.00268 0.00003 117 4XX -0.00026 0.00026 0.00084 -0.00057 -0.00076 118 4YY 0.00007 0.00095 0.00077 -0.00050 -0.00121 119 4ZZ -0.00006 -0.00124 0.00156 0.00048 0.00093 120 4XY -0.00016 0.00055 -0.00084 -0.00065 -0.00100 121 4XZ 0.00039 -0.00139 0.00055 0.00022 0.00039 122 4YZ 0.00063 -0.00192 -0.00066 -0.00015 -0.00015 123 9 C 1S -0.01047 0.00646 -0.00593 0.00414 0.00680 124 2S 0.02713 -0.01706 -0.00803 -0.00354 -0.00517 125 2PX 0.02961 -0.01351 -0.01156 -0.02370 -0.00125 126 2PY 0.02578 -0.02089 -0.04087 -0.00148 -0.02474 127 2PZ -0.00426 0.00908 0.05292 -0.00585 -0.01348 128 3S 0.04851 0.01934 -0.00291 0.00004 -0.00146 129 3PX 0.03033 0.00313 -0.00600 -0.01996 0.00800 130 3PY 0.01572 0.00685 -0.02381 0.00862 -0.01224 131 3PZ 0.01470 -0.00179 0.00417 0.00013 -0.00340 132 4XX -0.00517 0.00086 0.00149 0.00426 -0.00220 133 4YY -0.00028 0.00417 0.00255 -0.00479 0.00066 134 4ZZ 0.00182 -0.00129 -0.00258 0.00056 0.00151 135 4XY -0.00528 0.00222 0.00205 0.00181 -0.00247 136 4XZ 0.00002 -0.00321 -0.00260 0.00347 -0.00084 137 4YZ 0.00610 -0.00470 -0.00477 -0.00182 0.00183 138 10 C 1S 0.04604 -0.05697 0.00582 0.00103 0.00190 139 2S -0.08957 0.11790 0.01955 -0.01609 -0.02446 140 2PX -0.15783 0.07679 0.04620 0.10656 -0.04512 141 2PY -0.04790 0.15444 0.05455 -0.05743 0.03616 142 2PZ 0.14662 -0.15868 -0.13450 0.01293 0.03816 143 3S -0.10802 0.09152 -0.00897 -0.00882 -0.01365 144 3PX -0.07819 0.03965 0.00110 0.06941 -0.03275 145 3PY 0.01389 0.08070 -0.01223 -0.03883 0.01936 146 3PZ 0.06565 -0.02840 -0.03574 -0.00324 0.00923 147 4XX 0.00134 -0.00206 -0.00089 0.00507 -0.00144 148 4YY 0.01094 0.00292 0.00199 -0.00435 0.00299 149 4ZZ -0.00542 -0.00988 -0.00075 0.00076 0.00085 150 4XY -0.00087 0.00507 0.00248 0.00273 -0.00186 151 4XZ 0.00789 -0.00430 -0.00634 -0.00450 0.00280 152 4YZ 0.00355 -0.00722 -0.01019 0.00264 -0.00084 153 11 H 1S 0.01917 -0.04684 -0.06463 0.00499 0.01352 154 2S 0.01426 -0.09517 -0.05348 0.01004 0.01498 155 12 H 1S -0.02130 0.02407 0.04339 0.00019 -0.00170 156 2S -0.03894 0.03986 0.03933 -0.00085 -0.00405 157 13 H 1S -0.00468 -0.00123 0.01707 0.00027 -0.00002 158 2S -0.00568 -0.00217 0.01877 -0.00425 -0.00823 159 14 H 1S -0.00854 -0.03298 0.04314 0.00716 0.01366 160 2S -0.01672 -0.05503 0.03934 0.00746 0.01427 161 15 H 1S -0.00184 0.05032 -0.05204 0.00825 0.01362 162 2S -0.03201 0.08708 -0.05113 0.00810 0.00340 163 16 C 1S 0.00311 0.00153 0.00375 0.00219 0.00368 164 2S -0.00615 -0.00298 -0.00667 -0.00293 -0.00591 165 2PX 0.00754 0.00416 0.01994 0.00298 0.00982 166 2PY -0.00867 -0.00134 -0.02007 -0.01221 -0.01735 167 2PZ -0.00088 -0.00475 0.00144 -0.00952 -0.00689 168 3S -0.00682 -0.01317 -0.01808 -0.03105 0.00012 169 3PX 0.00128 0.01023 0.00606 0.00928 -0.00268 170 3PY -0.01102 -0.01251 -0.01392 0.00011 -0.00316 171 3PZ -0.00235 -0.00268 0.00339 -0.00371 0.00064 172 4XX -0.00084 -0.00053 -0.00070 -0.00134 -0.00015 173 4YY 0.00142 0.00064 0.00158 0.00077 0.00064 174 4ZZ 0.00034 0.00002 0.00031 0.00050 0.00040 175 4XY 0.00036 0.00035 0.00123 0.00027 0.00068 176 4XZ 0.00057 0.00041 0.00013 -0.00057 0.00027 177 4YZ 0.00065 0.00009 0.00057 0.00058 0.00057 178 17 C 1S -0.00546 -0.00235 -0.00345 -0.00002 -0.00705 179 2S 0.01315 0.00446 0.00740 -0.00255 0.01495 180 2PX -0.01908 -0.00878 -0.00852 0.01300 -0.01676 181 2PY -0.00160 0.00029 0.00313 0.01563 0.00599 182 2PZ 0.00429 0.00053 0.01640 0.00758 0.00291 183 3S 0.02703 0.01152 0.01068 -0.01183 0.02619 184 3PX -0.00683 -0.00511 -0.00412 -0.00171 -0.00208 185 3PY -0.01415 -0.00701 -0.00266 0.02630 -0.00536 186 3PZ -0.00562 -0.00494 0.00930 0.01531 -0.00388 187 4XX 0.00059 0.00028 0.00064 -0.00042 0.00062 188 4YY 0.00003 -0.00014 -0.00071 -0.00033 -0.00027 189 4ZZ 0.00002 -0.00023 -0.00021 -0.00050 -0.00033 190 4XY 0.00114 0.00050 0.00073 -0.00047 0.00133 191 4XZ 0.00074 -0.00000 0.00030 -0.00022 0.00057 192 4YZ 0.00008 -0.00014 0.00005 -0.00009 0.00019 193 18 C 1S 0.00196 0.00103 0.00246 0.00001 0.00174 194 2S -0.00406 -0.00163 -0.00333 0.00012 -0.00288 195 2PX 0.00603 0.00332 0.00723 0.00285 0.00918 196 2PY -0.00359 -0.00098 -0.00510 -0.00038 0.00122 197 2PZ -0.00251 -0.00166 0.00176 0.00433 -0.00322 198 3S -0.01773 -0.00782 -0.00397 0.02023 -0.01620 199 3PX 0.00744 0.00606 0.00505 -0.00686 0.00686 200 3PY -0.00457 -0.00180 -0.00118 0.00475 -0.00242 201 3PZ -0.00211 -0.00161 0.00136 0.00503 -0.00353 202 4XX 0.00055 0.00023 -0.00000 -0.00058 0.00050 203 4YY -0.00034 -0.00006 0.00006 0.00059 -0.00013 204 4ZZ 0.00006 0.00012 0.00023 0.00004 -0.00010 205 4XY 0.00026 0.00016 0.00044 -0.00029 0.00024 206 4XZ -0.00020 0.00002 -0.00038 0.00006 -0.00000 207 4YZ -0.00019 -0.00013 0.00023 0.00049 -0.00016 208 19 C 1S -0.00052 -0.00025 -0.00084 0.00066 -0.00095 209 2S 0.00099 0.00061 0.00146 -0.00116 0.00244 210 2PX -0.00273 -0.00165 -0.00243 -0.00129 -0.00767 211 2PY -0.00009 -0.00052 0.00303 -0.00278 0.00178 212 2PZ -0.00435 -0.00097 -0.00562 0.00285 -0.00274 213 3S 0.00421 0.00030 -0.00107 -0.00659 0.00469 214 3PX -0.00165 0.00041 0.00012 0.00152 -0.00453 215 3PY 0.00124 0.00129 0.00212 -0.00424 0.00172 216 3PZ -0.00307 -0.00032 -0.00393 0.00139 -0.00171 217 4XX -0.00030 -0.00011 -0.00025 0.00011 -0.00029 218 4YY 0.00013 -0.00001 0.00033 0.00016 0.00001 219 4ZZ -0.00001 0.00006 -0.00034 -0.00012 -0.00010 220 4XY 0.00015 0.00003 0.00022 -0.00019 0.00011 221 4XZ 0.00009 0.00006 -0.00013 -0.00028 0.00020 222 4YZ 0.00008 0.00006 -0.00016 -0.00008 0.00011 223 20 C 1S -0.00055 -0.00016 0.00071 -0.00120 -0.00093 224 2S 0.00066 0.00018 -0.00072 0.00258 0.00179 225 2PX -0.00138 -0.00045 -0.00024 -0.00629 -0.00572 226 2PY 0.00152 -0.00035 0.00281 0.00607 0.00071 227 2PZ -0.00059 0.00145 -0.00961 0.00024 -0.00041 228 3S 0.00944 0.00577 0.00141 0.00250 0.00072 229 3PX -0.00386 -0.00270 -0.00116 -0.00178 -0.00187 230 3PY 0.00438 0.00198 0.00302 0.00051 0.00091 231 3PZ 0.00163 0.00260 -0.00571 -0.00159 0.00009 232 4XX 0.00018 0.00016 0.00023 -0.00008 0.00015 233 4YY -0.00032 -0.00014 -0.00021 0.00015 -0.00025 234 4ZZ 0.00004 0.00004 0.00004 -0.00035 -0.00005 235 4XY 0.00002 0.00004 0.00003 -0.00021 -0.00001 236 4XZ -0.00010 -0.00010 0.00016 0.00015 -0.00003 237 4YZ 0.00009 0.00002 0.00008 -0.00014 0.00012 238 21 C 1S 0.00078 0.00017 -0.00049 0.00162 -0.00076 239 2S -0.00200 -0.00021 0.00136 -0.00307 0.00225 240 2PX 0.00109 -0.00015 -0.00522 0.01023 0.00225 241 2PY -0.00532 -0.00254 -0.00159 -0.00161 -0.00590 242 2PZ 0.00075 0.00077 -0.00408 -0.00984 -0.00144 243 3S -0.00475 -0.00492 0.00277 -0.00676 0.00433 244 3PX -0.01004 -0.00538 -0.00592 0.00639 -0.00308 245 3PY 0.00143 0.00456 0.00096 -0.00062 -0.00308 246 3PZ 0.00349 0.00315 -0.00336 -0.00720 -0.00042 247 4XX -0.00007 0.00002 -0.00032 -0.00000 -0.00061 248 4YY -0.00004 -0.00004 0.00001 -0.00000 0.00018 249 4ZZ -0.00006 -0.00000 0.00002 0.00012 -0.00005 250 4XY -0.00008 -0.00017 0.00053 -0.00031 0.00018 251 4XZ -0.00024 0.00018 -0.00040 -0.00015 0.00000 252 4YZ -0.00005 -0.00005 0.00029 0.00021 0.00024 253 22 H 1S -0.00244 -0.00096 -0.00028 -0.00223 -0.00100 254 2S -0.00077 -0.00203 0.00030 0.00013 0.00070 255 23 H 1S 0.00030 0.00024 0.00005 -0.00169 -0.00156 256 2S 0.00071 0.00051 0.00111 -0.00209 -0.00032 257 24 H 1S -0.00080 -0.00045 -0.00104 0.00033 -0.00298 258 2S -0.00185 -0.00080 -0.00148 0.00141 -0.00272 259 25 H 1S -0.00067 -0.00031 0.00105 0.00130 -0.00202 260 2S -0.00004 0.00012 0.00281 0.00318 -0.00084 261 26 H 1S 0.00410 0.00309 0.00896 -0.00002 0.00829 262 2S -0.01282 -0.00322 -0.00075 0.01079 -0.00238 263 27 H 1S 0.02514 0.00891 0.03377 0.02110 0.02197 264 2S 0.02817 0.01321 0.03481 0.03187 0.01294 71 72 73 74 75 71 3PZ 0.03671 72 4XX 0.00043 0.00090 73 4YY 0.00044 0.00033 0.00115 74 4ZZ -0.00094 -0.00007 -0.00041 0.00118 75 4XY 0.00077 0.00010 0.00020 -0.00052 0.00064 76 4XZ -0.00202 -0.00005 0.00009 -0.00007 0.00002 77 4YZ -0.00255 0.00006 0.00006 -0.00001 0.00013 78 6 C 1S 0.00352 0.00227 0.00265 -0.00574 0.00017 79 2S -0.02482 -0.00469 -0.00545 0.01002 -0.00063 80 2PX -0.00150 -0.00403 -0.00234 0.00429 -0.00326 81 2PY -0.00218 -0.00204 -0.00668 0.00463 -0.00319 82 2PZ -0.05820 -0.00673 -0.00738 0.00102 -0.00126 83 3S -0.00683 -0.00397 -0.00693 0.01164 -0.00269 84 3PX -0.00050 -0.00145 -0.00016 0.00225 -0.00122 85 3PY -0.00584 0.00002 -0.00149 0.00150 -0.00085 86 3PZ -0.01399 -0.00218 -0.00285 0.00144 -0.00161 87 4XX 0.00087 0.00028 0.00034 -0.00041 0.00002 88 4YY 0.00203 0.00032 0.00040 -0.00022 0.00014 89 4ZZ -0.00028 -0.00045 -0.00050 0.00017 -0.00007 90 4XY 0.00051 0.00002 0.00007 0.00010 0.00011 91 4XZ -0.00246 -0.00021 0.00016 -0.00019 0.00002 92 4YZ -0.00322 0.00007 0.00002 -0.00043 0.00030 93 7 C 1S -0.00027 -0.00028 -0.00062 0.00039 -0.00067 94 2S 0.00729 0.00094 0.00175 -0.00070 0.00143 95 2PX -0.00345 0.00079 0.00230 0.00084 0.00208 96 2PY -0.02053 0.00180 0.00334 -0.00043 0.00279 97 2PZ 0.04801 0.00058 0.00127 0.00064 0.00126 98 3S 0.00148 0.00105 0.00202 -0.00167 0.00098 99 3PX -0.00052 0.00078 0.00105 0.00003 0.00116 100 3PY -0.00991 0.00092 0.00217 -0.00097 0.00101 101 3PZ 0.01167 -0.00006 0.00004 0.00032 0.00009 102 4XX 0.00033 -0.00006 0.00001 0.00008 -0.00005 103 4YY 0.00089 0.00004 -0.00002 0.00015 0.00005 104 4ZZ -0.00317 -0.00014 -0.00024 -0.00002 -0.00016 105 4XY 0.00044 -0.00004 0.00004 0.00017 0.00004 106 4XZ -0.00206 -0.00015 -0.00000 0.00003 -0.00003 107 4YZ -0.00299 -0.00009 -0.00015 0.00003 0.00004 108 8 C 1S -0.00312 -0.00021 0.00012 -0.00023 0.00033 109 2S 0.00339 0.00011 -0.00060 0.00076 -0.00071 110 2PX 0.00417 -0.00088 0.00098 0.00020 -0.00059 111 2PY 0.01308 0.00058 -0.00101 0.00020 -0.00004 112 2PZ -0.05736 -0.00015 -0.00122 0.00144 -0.00082 113 3S 0.00263 0.00075 -0.00020 0.00175 -0.00077 114 3PX 0.00095 -0.00008 0.00060 -0.00002 0.00002 115 3PY 0.00332 0.00049 0.00000 -0.00007 0.00021 116 3PZ -0.02044 -0.00013 -0.00082 0.00108 -0.00056 117 4XX 0.00009 -0.00004 0.00015 -0.00003 0.00003 118 4YY 0.00068 0.00013 0.00017 -0.00014 0.00021 119 4ZZ -0.00103 -0.00004 -0.00014 0.00000 -0.00009 120 4XY 0.00039 0.00003 0.00021 -0.00008 0.00012 121 4XZ -0.00202 -0.00008 0.00024 -0.00011 -0.00002 122 4YZ -0.00229 0.00013 0.00010 -0.00010 0.00019 123 9 C 1S 0.00530 -0.00047 -0.00152 0.00133 -0.00114 124 2S -0.01444 0.00131 0.00341 -0.00261 0.00234 125 2PX -0.02126 -0.00181 0.00852 -0.00328 0.00095 126 2PY -0.01842 0.00453 0.00549 -0.00446 0.00695 127 2PZ 0.04973 0.00055 0.00114 -0.00125 0.00101 128 3S -0.00348 0.00132 0.00388 -0.00362 0.00220 129 3PX -0.00700 -0.00141 0.00411 -0.00134 -0.00033 130 3PY 0.00084 0.00219 0.00153 -0.00149 0.00269 131 3PZ 0.01258 0.00049 0.00060 -0.00020 0.00036 132 4XX 0.00012 -0.00020 0.00013 0.00003 -0.00014 133 4YY 0.00185 0.00011 -0.00009 -0.00007 0.00024 134 4ZZ 0.00057 -0.00006 -0.00033 0.00030 -0.00027 135 4XY 0.00057 -0.00014 0.00026 -0.00010 0.00007 136 4XZ -0.00218 0.00006 0.00006 0.00010 0.00000 137 4YZ -0.00353 0.00011 0.00013 0.00015 0.00004 138 10 C 1S -0.00698 0.00121 -0.00052 -0.00222 -0.00156 139 2S 0.01902 -0.00290 0.00038 0.00262 0.00297 140 2PX 0.01340 -0.00810 0.00012 0.00324 -0.00607 141 2PY 0.05018 -0.00219 -0.01184 0.00536 -0.00156 142 2PZ -0.03792 0.00245 -0.00335 0.00995 -0.00523 143 3S 0.00521 -0.00237 -0.00168 0.00461 -0.00006 144 3PX 0.00113 -0.00406 0.00245 0.00108 -0.00339 145 3PY 0.02014 0.00066 -0.00401 0.00204 0.00006 146 3PZ -0.00469 0.00115 0.00015 0.00204 -0.00019 147 4XX -0.00007 0.00024 0.00012 -0.00025 0.00003 148 4YY 0.00041 0.00014 0.00037 -0.00050 0.00026 149 4ZZ -0.00231 -0.00036 -0.00069 0.00085 -0.00044 150 4XY 0.00082 -0.00002 0.00016 -0.00020 0.00029 151 4XZ -0.00182 0.00032 -0.00004 0.00015 0.00004 152 4YZ -0.00342 0.00022 0.00034 0.00020 -0.00016 153 11 H 1S -0.01572 -0.00109 -0.00408 0.00873 -0.00338 154 2S -0.02601 -0.00100 -0.00435 0.00742 -0.00403 155 12 H 1S 0.03503 -0.00084 -0.00211 0.00044 -0.00135 156 2S 0.03927 -0.00122 -0.00245 0.00070 -0.00150 157 13 H 1S 0.00021 0.00040 0.00113 -0.00064 0.00080 158 2S -0.00248 0.00070 0.00207 -0.00140 0.00157 159 14 H 1S -0.03004 -0.00074 -0.00131 -0.00047 -0.00103 160 2S -0.03375 -0.00122 -0.00199 0.00022 -0.00144 161 15 H 1S 0.02279 -0.00055 -0.00189 0.00612 -0.00180 162 2S 0.03076 -0.00005 -0.00087 0.00325 -0.00174 163 16 C 1S 0.00103 0.00021 -0.00006 -0.00024 0.00034 164 2S -0.00158 -0.00041 0.00030 0.00047 -0.00065 165 2PX 0.00202 0.00064 -0.00032 -0.00078 0.00135 166 2PY -0.00038 -0.00033 0.00053 0.00076 -0.00084 167 2PZ 0.00700 -0.00001 0.00023 -0.00039 -0.00036 168 3S -0.00048 -0.00079 -0.00064 0.00221 -0.00070 169 3PX 0.00290 0.00035 0.00034 -0.00089 0.00046 170 3PY -0.00545 -0.00015 -0.00008 0.00078 -0.00084 171 3PZ 0.00531 0.00013 -0.00009 -0.00015 -0.00020 172 4XX 0.00004 0.00023 -0.00014 -0.00002 0.00011 173 4YY -0.00005 -0.00011 0.00008 -0.00005 -0.00001 174 4ZZ 0.00019 -0.00002 0.00001 -0.00002 -0.00000 175 4XY -0.00041 0.00004 -0.00005 -0.00007 -0.00000 176 4XZ 0.00053 0.00001 0.00002 -0.00004 0.00001 177 4YZ 0.00018 -0.00006 0.00003 -0.00001 -0.00002 178 17 C 1S 0.00006 -0.00021 0.00020 0.00034 0.00021 179 2S 0.00067 0.00040 -0.00033 -0.00074 -0.00032 180 2PX -0.00015 -0.00157 0.00111 0.00162 0.00093 181 2PY -0.00111 -0.00059 0.00016 0.00028 0.00012 182 2PZ -0.00685 -0.00036 0.00001 -0.00038 0.00006 183 3S 0.00145 0.00053 -0.00039 -0.00093 -0.00019 184 3PX -0.00145 -0.00069 0.00040 0.00085 0.00012 185 3PY -0.00173 -0.00041 0.00037 0.00003 -0.00047 186 3PZ -0.00637 -0.00044 0.00035 -0.00039 -0.00035 187 4XX 0.00012 0.00009 -0.00005 -0.00008 -0.00001 188 4YY -0.00055 -0.00002 0.00001 0.00005 -0.00001 189 4ZZ 0.00033 -0.00001 0.00002 0.00001 0.00002 190 4XY 0.00015 0.00008 -0.00005 -0.00008 -0.00000 191 4XZ -0.00031 0.00004 -0.00004 -0.00002 -0.00001 192 4YZ 0.00017 0.00000 0.00000 -0.00001 -0.00001 193 18 C 1S -0.00042 0.00002 -0.00016 -0.00020 -0.00003 194 2S 0.00062 -0.00017 0.00022 0.00033 0.00011 195 2PX -0.00264 0.00057 -0.00037 -0.00058 -0.00017 196 2PY 0.00697 0.00004 0.00031 0.00016 0.00017 197 2PZ -0.01075 -0.00016 -0.00002 0.00025 -0.00008 198 3S -0.00071 -0.00047 0.00043 0.00022 -0.00011 199 3PX 0.00068 0.00014 -0.00021 -0.00010 0.00025 200 3PY 0.00430 0.00002 0.00010 -0.00004 0.00013 201 3PZ -0.00712 -0.00003 -0.00016 0.00015 -0.00001 202 4XX 0.00005 0.00006 -0.00003 -0.00005 -0.00003 203 4YY 0.00012 -0.00004 0.00002 0.00002 0.00001 204 4ZZ -0.00018 -0.00001 0.00000 -0.00000 -0.00000 205 4XY 0.00002 0.00003 -0.00001 -0.00003 -0.00001 206 4XZ -0.00016 0.00001 -0.00001 0.00001 -0.00001 207 4YZ -0.00017 -0.00003 0.00001 0.00001 0.00001 208 19 C 1S 0.00012 -0.00005 0.00006 0.00008 0.00004 209 2S -0.00017 0.00016 -0.00008 -0.00014 -0.00011 210 2PX 0.00083 -0.00055 0.00010 0.00028 0.00012 211 2PY 0.00475 0.00004 0.00015 -0.00008 0.00003 212 2PZ -0.00701 -0.00007 0.00000 0.00043 -0.00021 213 3S -0.00074 0.00033 -0.00012 -0.00017 -0.00026 214 3PX 0.00057 -0.00037 0.00014 0.00009 0.00007 215 3PY 0.00343 -0.00004 0.00009 0.00004 0.00015 216 3PZ -0.00496 -0.00010 -0.00000 0.00034 -0.00009 217 4XX 0.00004 -0.00001 0.00001 0.00002 0.00001 218 4YY -0.00027 -0.00001 -0.00000 -0.00000 -0.00001 219 4ZZ 0.00025 -0.00000 0.00001 0.00000 -0.00000 220 4XY -0.00022 0.00002 -0.00002 -0.00001 -0.00001 221 4XZ 0.00042 0.00002 -0.00000 -0.00001 0.00000 222 4YZ 0.00019 -0.00000 0.00001 0.00000 0.00000 223 20 C 1S 0.00009 0.00002 -0.00010 -0.00004 0.00006 224 2S -0.00020 -0.00011 0.00018 0.00005 -0.00013 225 2PX 0.00154 0.00013 -0.00029 -0.00005 0.00014 226 2PY -0.00333 -0.00020 0.00003 -0.00007 -0.00004 227 2PZ 0.00347 -0.00006 0.00025 0.00022 -0.00004 228 3S 0.00074 -0.00053 0.00063 -0.00038 -0.00037 229 3PX 0.00001 0.00029 -0.00029 0.00010 0.00014 230 3PY -0.00158 -0.00023 0.00018 -0.00014 -0.00006 231 3PZ 0.00277 -0.00010 0.00024 0.00012 -0.00003 232 4XX 0.00004 0.00003 -0.00002 -0.00002 0.00003 233 4YY -0.00046 -0.00001 -0.00001 0.00002 -0.00002 234 4ZZ 0.00046 0.00000 0.00000 -0.00001 0.00000 235 4XY 0.00022 0.00002 -0.00000 -0.00001 -0.00000 236 4XZ -0.00028 0.00000 -0.00001 0.00000 -0.00001 237 4YZ 0.00031 -0.00000 0.00001 -0.00001 -0.00000 238 21 C 1S 0.00046 -0.00030 0.00011 -0.00001 -0.00017 239 2S -0.00046 0.00058 -0.00028 -0.00007 0.00036 240 2PX -0.00202 -0.00077 0.00047 0.00029 -0.00053 241 2PY -0.00626 -0.00012 -0.00029 0.00027 -0.00029 242 2PZ 0.01152 0.00013 0.00017 -0.00017 0.00007 243 3S -0.00157 0.00134 -0.00107 0.00000 0.00072 244 3PX -0.00088 -0.00031 0.00004 0.00050 -0.00031 245 3PY -0.00296 -0.00029 0.00015 -0.00004 -0.00022 246 3PZ 0.00830 -0.00005 0.00034 -0.00022 0.00001 247 4XX 0.00004 -0.00006 0.00005 0.00002 -0.00004 248 4YY 0.00008 0.00001 -0.00001 0.00000 0.00001 249 4ZZ -0.00013 -0.00001 -0.00001 0.00000 -0.00001 250 4XY 0.00002 0.00005 -0.00005 -0.00002 0.00004 251 4XZ -0.00008 0.00002 -0.00002 0.00003 0.00002 252 4YZ -0.00017 0.00001 -0.00001 0.00000 0.00001 253 22 H 1S -0.00055 0.00014 -0.00019 0.00005 0.00005 254 2S -0.00094 0.00005 -0.00016 0.00006 0.00008 255 23 H 1S 0.00057 0.00010 -0.00011 -0.00006 0.00008 256 2S 0.00057 0.00020 -0.00019 -0.00011 0.00014 257 24 H 1S 0.00007 -0.00025 0.00003 0.00008 0.00006 258 2S 0.00007 -0.00027 0.00009 0.00018 0.00010 259 25 H 1S -0.00040 -0.00019 0.00002 0.00007 0.00003 260 2S -0.00029 -0.00016 -0.00004 0.00001 0.00013 261 26 H 1S 0.00084 0.00089 -0.00075 -0.00106 -0.00070 262 2S -0.00169 0.00035 -0.00008 -0.00050 -0.00102 263 27 H 1S 0.00408 -0.00161 0.00080 -0.00085 -0.00018 264 2S 0.00135 -0.00137 0.00129 -0.00145 0.00020 76 77 78 79 80 76 4XZ 0.00093 77 4YZ 0.00022 0.00120 78 6 C 1S -0.00180 -0.00228 2.05365 79 2S 0.00366 0.00486 -0.06219 0.32637 80 2PX -0.01173 0.00190 0.00033 -0.00496 0.35606 81 2PY 0.00117 -0.01110 -0.00145 -0.00455 0.04315 82 2PZ 0.00445 0.00678 0.00371 -0.00467 0.00179 83 3S 0.00195 0.00312 -0.18397 0.27408 0.02783 84 3PX -0.00734 0.00348 -0.00324 0.01059 0.20136 85 3PY 0.00280 -0.00400 -0.00025 0.01478 -0.03665 86 3PZ 0.00085 0.00189 -0.00204 -0.01601 0.01575 87 4XX 0.00021 -0.00019 -0.01267 -0.01207 -0.00456 88 4YY -0.00027 0.00012 -0.01639 -0.00437 0.00035 89 4ZZ -0.00023 -0.00041 -0.01830 -0.00088 0.00735 90 4XY 0.00028 0.00004 -0.00377 0.00793 -0.00491 91 4XZ 0.00024 0.00035 0.00082 -0.00118 0.00228 92 4YZ 0.00026 0.00058 0.00233 -0.00398 -0.00756 93 7 C 1S -0.00098 -0.00150 0.01711 -0.03432 0.04074 94 2S 0.00201 0.00308 -0.03469 0.06085 -0.08340 95 2PX -0.00647 0.00908 -0.03999 0.08476 0.07779 96 2PY 0.00970 0.00371 -0.06659 0.14069 -0.23097 97 2PZ 0.00240 0.00253 -0.02058 0.03764 -0.04864 98 3S 0.00196 0.00363 0.00928 0.01859 -0.06982 99 3PX -0.00569 0.00460 -0.00418 0.01691 0.08103 100 3PY 0.00480 0.00001 -0.00949 0.03146 -0.09565 101 3PZ 0.00124 0.00087 0.00246 0.01219 -0.01847 102 4XX -0.00032 0.00015 -0.00022 -0.00023 0.00998 103 4YY 0.00033 -0.00015 -0.00413 0.00693 -0.00836 104 4ZZ -0.00011 -0.00019 0.00290 -0.00670 0.00476 105 4XY -0.00007 0.00026 -0.00418 0.00780 0.00197 106 4XZ 0.00004 0.00024 -0.00115 0.00253 0.00000 107 4YZ 0.00027 0.00030 -0.00212 0.00451 -0.00555 108 8 C 1S 0.00008 0.00014 -0.00302 0.00853 -0.00742 109 2S -0.00025 -0.00049 0.00840 -0.01991 0.01925 110 2PX -0.00081 -0.00057 0.00719 -0.01683 0.00710 111 2PY -0.00013 -0.00079 0.01148 -0.03145 0.02483 112 2PZ 0.00134 0.00224 -0.00536 0.01784 -0.01103 113 3S -0.00019 -0.00041 -0.00872 -0.00415 0.02199 114 3PX -0.00038 -0.00034 -0.00233 -0.00114 -0.01031 115 3PY 0.00002 -0.00027 -0.00364 -0.00465 0.01291 116 3PZ 0.00136 0.00190 -0.00728 0.01472 -0.02187 117 4XX -0.00008 0.00012 -0.00043 0.00133 0.00149 118 4YY 0.00026 0.00009 -0.00157 0.00360 -0.00814 119 4ZZ -0.00012 -0.00009 0.00137 -0.00274 0.00342 120 4XY -0.00003 0.00018 -0.00115 0.00247 -0.00082 121 4XZ 0.00050 -0.00032 0.00018 -0.00013 -0.00687 122 4YZ -0.00033 0.00013 0.00021 -0.00018 0.00513 123 9 C 1S 0.00018 0.00019 -0.00334 0.00580 -0.00313 124 2S -0.00026 -0.00019 0.00565 -0.01175 0.00628 125 2PX 0.00707 -0.00546 0.00231 -0.00288 -0.09739 126 2PY -0.00603 0.00098 0.00446 -0.01148 0.05501 127 2PZ -0.00020 0.00026 -0.00665 0.01281 -0.01207 128 3S -0.00066 -0.00013 0.02712 -0.03641 0.01902 129 3PX 0.00547 -0.00311 0.00425 -0.00376 -0.07906 130 3PY -0.00358 0.00187 0.00817 -0.01132 0.04309 131 3PZ 0.00064 0.00120 -0.00965 0.01238 -0.00960 132 4XX 0.00024 -0.00016 -0.00033 0.00045 -0.00059 133 4YY -0.00040 -0.00013 -0.00012 0.00001 -0.00065 134 4ZZ 0.00009 0.00014 0.00001 -0.00008 0.00102 135 4XY 0.00002 -0.00028 0.00018 -0.00021 -0.00055 136 4XZ 0.00013 0.00001 -0.00017 0.00052 -0.00070 137 4YZ -0.00003 0.00011 -0.00026 0.00093 0.00032 138 10 C 1S 0.00282 0.00509 -0.00328 0.00902 0.00052 139 2S -0.00566 -0.00995 0.00871 -0.02043 -0.00081 140 2PX 0.00695 -0.00682 0.00276 -0.00549 -0.02209 141 2PY -0.00730 -0.00264 0.00534 -0.01506 0.01518 142 2PZ 0.00340 0.00620 -0.01366 0.03429 0.00201 143 3S -0.00527 -0.01036 -0.00453 -0.01049 0.01084 144 3PX 0.00531 -0.00429 0.00577 -0.00805 -0.02638 145 3PY -0.00475 -0.00034 0.00882 -0.01552 0.01821 146 3PZ 0.00058 0.00200 0.00415 0.00494 -0.01042 147 4XX -0.00005 0.00050 0.00051 -0.00062 0.00603 148 4YY 0.00036 0.00009 0.00088 -0.00141 -0.00696 149 4ZZ 0.00003 0.00003 -0.00197 0.00429 0.00186 150 4XY -0.00020 -0.00002 0.00065 -0.00132 0.00340 151 4XZ 0.00001 0.00009 -0.00010 0.00026 -0.00390 152 4YZ 0.00011 0.00018 0.00017 0.00001 0.00235 153 11 H 1S -0.00023 -0.00078 -0.00751 0.01690 0.00466 154 2S 0.00130 0.00172 -0.01283 0.02522 0.01129 155 12 H 1S 0.00017 0.00013 -0.00086 0.00127 -0.00136 156 2S -0.00038 -0.00075 0.00170 -0.00276 -0.00025 157 13 H 1S 0.00033 0.00058 -0.00826 0.01921 -0.01805 158 2S 0.00070 0.00116 -0.01277 0.02707 -0.03274 159 14 H 1S -0.00093 -0.00131 0.01335 -0.02834 0.01991 160 2S -0.00083 -0.00122 0.01687 -0.02984 0.03394 161 15 H 1S -0.00298 -0.00592 -0.06136 0.11513 0.08549 162 2S -0.00378 -0.00646 -0.01260 0.02202 0.07620 163 16 C 1S 0.00010 -0.00008 0.00050 -0.00095 -0.00082 164 2S -0.00018 0.00021 -0.00025 0.00111 0.00166 165 2PX 0.00031 -0.00036 0.00108 -0.00145 -0.00210 166 2PY -0.00016 0.00062 -0.00020 -0.00030 0.00140 167 2PZ -0.00022 -0.00071 -0.00042 0.00168 0.00090 168 3S -0.00037 0.00007 -0.00973 0.01506 -0.01053 169 3PX 0.00015 -0.00037 0.00095 -0.00658 -0.00453 170 3PY 0.00026 0.00074 0.00605 -0.00181 0.00543 171 3PZ -0.00044 -0.00049 0.00412 -0.00067 0.00356 172 4XX 0.00003 -0.00006 0.00009 -0.00002 -0.00095 173 4YY -0.00004 0.00000 -0.00004 -0.00010 0.00011 174 4ZZ 0.00003 0.00002 0.00007 -0.00019 0.00015 175 4XY 0.00004 0.00001 0.00013 -0.00038 -0.00093 176 4XZ -0.00005 -0.00005 0.00010 -0.00040 -0.00057 177 4YZ 0.00001 0.00003 -0.00019 0.00000 0.00021 178 17 C 1S -0.00005 0.00007 -0.00083 0.00363 0.00739 179 2S 0.00011 -0.00009 0.00227 -0.00756 -0.01679 180 2PX 0.00000 0.00026 -0.00516 0.01435 0.03396 181 2PY -0.00002 0.00046 -0.00112 0.00135 0.00928 182 2PZ -0.00018 -0.00038 -0.00032 0.00362 0.00197 183 3S 0.00102 -0.00077 0.00270 -0.00784 -0.04297 184 3PX -0.00056 0.00048 0.00359 0.00467 0.02381 185 3PY -0.00039 0.00085 0.00849 -0.00581 0.02972 186 3PZ 0.00042 -0.00018 0.00402 -0.00161 0.00413 187 4XX -0.00001 0.00000 0.00014 -0.00056 -0.00087 188 4YY 0.00001 0.00003 0.00035 -0.00001 -0.00017 189 4ZZ 0.00000 -0.00003 0.00013 0.00014 0.00010 190 4XY 0.00003 -0.00003 0.00046 -0.00086 -0.00201 191 4XZ -0.00004 0.00001 0.00007 -0.00003 -0.00008 192 4YZ 0.00000 -0.00002 0.00015 -0.00010 -0.00024 193 18 C 1S -0.00001 0.00000 0.00035 -0.00095 -0.00228 194 2S 0.00002 0.00003 -0.00086 0.00220 0.00463 195 2PX -0.00008 0.00005 0.00154 -0.00354 -0.00788 196 2PY 0.00006 -0.00007 -0.00028 -0.00079 0.00195 197 2PZ -0.00010 0.00036 -0.00087 0.00355 0.00682 198 3S 0.00009 0.00023 -0.00050 0.00100 0.01831 199 3PX -0.00004 -0.00024 -0.00359 0.00230 -0.00982 200 3PY 0.00016 -0.00011 -0.00239 0.00003 0.00026 201 3PZ -0.00031 0.00037 -0.00139 0.00272 0.00844 202 4XX 0.00001 -0.00001 0.00029 -0.00057 -0.00124 203 4YY 0.00000 0.00001 -0.00018 0.00020 0.00065 204 4ZZ -0.00002 -0.00000 -0.00005 0.00014 0.00024 205 4XY -0.00001 -0.00002 0.00005 -0.00004 -0.00037 206 4XZ 0.00001 0.00003 -0.00001 -0.00008 -0.00003 207 4YZ -0.00001 0.00001 -0.00009 0.00026 0.00066 208 19 C 1S 0.00000 0.00000 -0.00016 0.00043 0.00144 209 2S -0.00001 -0.00000 0.00046 -0.00115 -0.00324 210 2PX 0.00002 -0.00005 -0.00101 0.00248 0.00561 211 2PY -0.00010 -0.00033 -0.00002 0.00022 -0.00036 212 2PZ 0.00003 0.00061 -0.00034 0.00099 0.00448 213 3S 0.00003 0.00004 0.00301 -0.00295 -0.00584 214 3PX -0.00006 -0.00001 -0.00162 0.00167 0.00363 215 3PY -0.00011 -0.00028 -0.00113 0.00184 -0.00055 216 3PZ 0.00011 0.00038 -0.00098 0.00154 0.00231 217 4XX -0.00000 0.00000 -0.00003 0.00012 0.00046 218 4YY 0.00000 0.00000 -0.00001 0.00008 0.00006 219 4ZZ 0.00000 -0.00000 0.00004 -0.00010 -0.00008 220 4XY -0.00000 -0.00000 0.00003 -0.00002 -0.00029 221 4XZ 0.00000 -0.00001 0.00006 -0.00017 -0.00035 222 4YZ 0.00000 0.00000 -0.00001 -0.00005 -0.00012 223 20 C 1S -0.00000 -0.00004 -0.00003 0.00019 -0.00013 224 2S 0.00000 0.00010 0.00006 -0.00024 0.00056 225 2PX -0.00004 -0.00021 -0.00005 0.00032 -0.00087 226 2PY 0.00003 0.00005 -0.00019 0.00081 0.00218 227 2PZ 0.00003 0.00021 0.00014 -0.00190 -0.00055 228 3S -0.00015 0.00023 -0.00017 -0.00329 -0.00356 229 3PX 0.00007 -0.00010 0.00057 0.00076 0.00168 230 3PY -0.00007 0.00003 -0.00065 0.00068 0.00030 231 3PZ -0.00000 0.00019 -0.00011 -0.00127 -0.00138 232 4XX 0.00001 -0.00001 0.00003 -0.00008 -0.00023 233 4YY 0.00000 0.00003 -0.00002 0.00008 0.00024 234 4ZZ -0.00001 -0.00003 0.00001 -0.00005 -0.00015 235 4XY -0.00001 -0.00001 0.00005 -0.00009 -0.00011 236 4XZ 0.00001 0.00001 0.00001 0.00003 0.00002 237 4YZ -0.00001 -0.00002 0.00001 -0.00004 -0.00010 238 21 C 1S -0.00006 0.00009 -0.00007 0.00006 0.00150 239 2S 0.00013 -0.00018 0.00011 -0.00035 -0.00377 240 2PX -0.00011 0.00035 -0.00059 0.00070 0.00555 241 2PY 0.00005 0.00020 -0.00060 0.00197 0.00166 242 2PZ -0.00036 -0.00061 0.00021 -0.00152 -0.00252 243 3S 0.00029 -0.00035 0.00045 0.00193 -0.00247 244 3PX 0.00002 0.00007 0.00034 0.00140 0.00601 245 3PY -0.00005 0.00013 -0.00148 -0.00019 -0.00280 246 3PZ -0.00030 -0.00040 -0.00064 -0.00200 -0.00384 247 4XX -0.00001 0.00002 -0.00006 0.00002 0.00032 248 4YY -0.00001 -0.00001 -0.00001 0.00004 0.00006 249 4ZZ 0.00000 0.00000 -0.00000 0.00003 0.00005 250 4XY -0.00000 -0.00004 0.00001 0.00012 -0.00007 251 4XZ 0.00001 0.00002 0.00004 -0.00006 -0.00015 252 4YZ 0.00000 0.00000 0.00002 0.00006 0.00012 253 22 H 1S -0.00003 -0.00010 -0.00013 0.00060 -0.00002 254 2S -0.00003 0.00001 0.00034 0.00090 0.00222 255 23 H 1S 0.00000 -0.00008 0.00010 -0.00026 -0.00087 256 2S 0.00001 -0.00011 0.00009 -0.00044 -0.00209 257 24 H 1S 0.00003 0.00001 -0.00040 0.00085 0.00224 258 2S 0.00002 0.00004 -0.00070 0.00163 0.00426 259 25 H 1S -0.00003 -0.00001 -0.00042 0.00127 0.00246 260 2S -0.00012 0.00005 -0.00173 0.00180 0.00349 261 26 H 1S -0.00043 0.00017 0.00142 -0.00761 -0.00770 262 2S -0.00149 0.00098 0.01187 -0.01085 0.03317 263 27 H 1S -0.00005 0.00025 0.00169 -0.00375 0.00551 264 2S 0.00027 0.00080 0.00257 -0.00538 0.01031 81 82 83 84 85 81 2PY 0.40518 82 2PZ -0.00928 0.41810 83 3S 0.04249 0.00545 0.27962 84 3PX -0.03631 -0.01194 0.01926 0.12915 85 3PY 0.15476 -0.01359 0.01936 -0.04081 0.07515 86 3PZ 0.00925 0.14500 0.00009 0.00532 -0.00077 87 4XX -0.00079 -0.00239 -0.00942 -0.00273 -0.00015 88 4YY -0.00675 -0.00999 -0.00392 0.00176 -0.00178 89 4ZZ 0.01255 0.00758 0.00177 0.00143 0.00264 90 4XY -0.00110 -0.00575 0.00592 -0.00177 0.00114 91 4XZ -0.00758 0.00842 -0.00287 0.00200 -0.00336 92 4YZ -0.00806 0.01330 -0.00666 -0.00338 -0.00196 93 7 C 1S 0.06587 0.01764 0.00831 0.00500 0.00823 94 2S -0.13399 -0.03823 0.01574 -0.01901 -0.03033 95 2PX -0.23013 -0.05057 0.04587 0.08207 -0.09240 96 2PY -0.16108 -0.05967 0.07873 -0.10357 -0.02594 97 2PZ -0.05929 -0.00129 0.06948 -0.00992 -0.00654 98 3S -0.12124 -0.01727 -0.02830 -0.01184 -0.02299 99 3PX -0.10040 -0.02697 0.00155 0.06444 -0.04489 100 3PY -0.02414 -0.02946 0.00885 -0.04759 0.00820 101 3PZ -0.01235 0.01008 0.02060 -0.00682 0.00099 102 4XX -0.00204 -0.00081 0.00173 0.00611 -0.00284 103 4YY 0.00445 -0.00419 0.00755 -0.00570 0.00321 104 4ZZ 0.00773 0.00783 -0.00821 0.00139 0.00238 105 4XY -0.00738 -0.00357 0.00683 0.00277 -0.00313 106 4XZ -0.00546 0.00536 0.00032 0.00024 -0.00192 107 4YZ -0.00608 0.00859 0.00188 -0.00246 -0.00199 108 8 C 1S -0.01321 0.00220 -0.00748 -0.00157 -0.00139 109 2S 0.03393 -0.00479 -0.00699 0.00845 0.01278 110 2PX 0.02579 -0.00198 -0.03822 -0.00250 0.03236 111 2PY 0.03543 -0.00028 -0.03953 0.02919 0.02283 112 2PZ -0.02118 0.00839 -0.04436 0.00084 0.00255 113 3S 0.03958 -0.03517 0.01531 0.01071 0.01588 114 3PX 0.01363 -0.00512 -0.01151 -0.01209 0.01798 115 3PY 0.00578 -0.00772 -0.00591 0.01508 0.00208 116 3PZ -0.03489 0.01747 -0.00679 -0.00595 -0.00714 117 4XX -0.00426 -0.00063 0.00119 0.00105 -0.00191 118 4YY -0.00543 -0.00076 0.00419 -0.00394 -0.00174 119 4ZZ 0.00427 0.00104 -0.00430 0.00155 0.00159 120 4XY -0.00671 -0.00076 0.00264 0.00026 -0.00272 121 4XZ 0.00558 0.00037 -0.00122 -0.00557 0.00334 122 4YZ -0.00117 -0.00068 -0.00099 0.00325 -0.00165 123 9 C 1S -0.00570 0.00585 0.02430 -0.00565 -0.00985 124 2S 0.01231 -0.01301 -0.03718 0.00795 0.01464 125 2PX 0.05549 -0.00894 -0.02394 -0.08041 0.04999 126 2PY -0.03676 -0.02967 -0.02027 0.05153 -0.02475 127 2PZ -0.02698 -0.00200 0.06192 -0.00632 -0.01742 128 3S 0.02439 -0.04173 -0.06109 0.01463 0.01789 129 3PX 0.04131 -0.00536 -0.01403 -0.06167 0.03715 130 3PY -0.03524 -0.02146 -0.01014 0.03978 -0.02153 131 3PZ -0.01778 -0.00688 0.02447 -0.00182 -0.00545 132 4XX -0.00050 -0.00026 0.00109 -0.00099 -0.00059 133 4YY -0.00148 -0.00141 0.00129 -0.00027 -0.00154 134 4ZZ 0.00158 0.00178 0.00072 0.00078 0.00118 135 4XY -0.00082 -0.00082 -0.00012 -0.00070 -0.00059 136 4XZ 0.00034 0.00039 0.00032 0.00001 0.00018 137 4YZ -0.00042 0.00024 -0.00009 0.00031 0.00046 138 10 C 1S -0.00169 0.01505 -0.00435 0.00476 0.00797 139 2S 0.00247 -0.03800 -0.01173 -0.00511 -0.00820 140 2PX 0.01741 -0.00583 -0.00345 -0.03632 0.00582 141 2PY -0.00076 -0.01974 0.00652 0.00795 -0.02288 142 2PZ -0.00174 0.04716 0.05863 0.01893 0.02645 143 3S 0.03575 -0.04841 0.00317 -0.00635 0.00098 144 3PX 0.01683 -0.02175 -0.01287 -0.02759 0.01287 145 3PY -0.00643 -0.04288 -0.01121 0.01702 -0.00928 146 3PZ -0.02413 0.00433 0.01055 0.00463 0.00162 147 4XX -0.00399 -0.00208 -0.00072 0.00472 -0.00251 148 4YY 0.00321 -0.00362 -0.00319 -0.00468 0.00301 149 4ZZ 0.00102 0.01181 0.00551 0.00084 0.00024 150 4XY -0.00286 -0.00326 -0.00210 0.00269 -0.00189 151 4XZ 0.00253 -0.00003 0.00000 -0.00166 0.00246 152 4YZ -0.00115 -0.00135 -0.00087 0.00235 0.00088 153 11 H 1S 0.00471 0.03349 0.03554 0.00841 0.01119 154 2S 0.01216 0.06894 0.03714 0.00983 0.01283 155 12 H 1S -0.00244 0.00367 0.02220 -0.00207 -0.00376 156 2S -0.00231 0.00254 0.02247 -0.00293 -0.00688 157 13 H 1S -0.02989 -0.00607 0.03958 -0.01442 -0.02260 158 2S -0.05401 -0.00559 0.03511 -0.01771 -0.02717 159 14 H 1S 0.02979 0.02823 -0.05597 0.00377 0.00618 160 2S 0.05183 0.05461 -0.04755 0.00721 0.01205 161 15 H 1S 0.16600 -0.19412 0.12268 0.03533 0.06174 162 2S 0.13025 -0.15111 0.04134 0.02976 0.04145 163 16 C 1S -0.00024 -0.00118 -0.00140 -0.00137 -0.00049 164 2S -0.00083 0.00222 0.00215 0.00262 0.00024 165 2PX -0.00008 -0.00349 -0.00846 -0.00339 0.00096 166 2PY 0.00033 0.00314 0.00116 0.00655 0.00357 167 2PZ 0.00313 -0.00032 0.00225 -0.00267 0.00549 168 3S 0.02078 0.01564 0.01808 -0.00574 0.01119 169 3PX -0.00550 -0.00918 -0.00778 -0.00097 -0.00169 170 3PY 0.00416 0.01120 0.00167 0.00267 0.00047 171 3PZ 0.00120 -0.00022 0.00193 -0.00093 0.00100 172 4XX 0.00089 0.00049 0.00034 -0.00095 0.00038 173 4YY -0.00053 -0.00051 -0.00061 0.00015 -0.00022 174 4ZZ -0.00032 0.00005 0.00010 0.00018 -0.00031 175 4XY 0.00033 -0.00012 -0.00062 -0.00098 0.00008 176 4XZ 0.00019 -0.00028 -0.00006 -0.00001 0.00012 177 4YZ -0.00037 -0.00002 0.00030 0.00033 -0.00033 178 17 C 1S -0.00277 0.00106 -0.00278 0.00540 0.00144 179 2S 0.00504 -0.00113 0.00290 -0.01134 -0.00142 180 2PX -0.01329 0.00369 0.00703 0.02490 -0.00652 181 2PY -0.00752 0.00060 0.00185 0.00863 -0.00732 182 2PZ -0.00022 -0.00363 -0.01053 -0.00616 0.00231 183 3S 0.02125 -0.00625 0.00071 -0.03034 0.00891 184 3PX -0.01265 0.00389 -0.00004 0.01410 -0.00631 185 3PY -0.01485 0.00279 -0.00204 0.02049 -0.01222 186 3PZ -0.00257 0.00236 -0.00970 -0.00297 0.00027 187 4XX 0.00036 -0.00004 -0.00012 -0.00073 0.00008 188 4YY -0.00006 0.00032 -0.00052 -0.00001 0.00012 189 4ZZ -0.00004 0.00013 -0.00006 0.00007 0.00023 190 4XY 0.00057 -0.00009 -0.00047 -0.00140 0.00024 191 4XZ 0.00034 -0.00034 -0.00036 -0.00027 0.00018 192 4YZ 0.00006 0.00010 0.00018 -0.00020 -0.00001 193 18 C 1S 0.00052 -0.00065 -0.00134 -0.00182 0.00030 194 2S -0.00129 0.00100 0.00232 0.00351 -0.00067 195 2PX 0.00200 -0.00224 -0.00753 -0.00796 0.00170 196 2PY -0.00125 0.00147 0.01017 0.00403 -0.00321 197 2PZ -0.00067 -0.00079 -0.00711 0.00003 0.00068 198 3S -0.00625 0.00364 0.00134 0.01412 -0.00433 199 3PX 0.00379 -0.00356 -0.00040 -0.00694 0.00294 200 3PY 0.00006 0.00158 0.00627 0.00267 -0.00144 201 3PZ -0.00111 -0.00111 -0.00448 0.00331 -0.00047 202 4XX 0.00056 -0.00006 -0.00009 -0.00088 0.00024 203 4YY -0.00045 0.00005 0.00019 0.00059 -0.00031 204 4ZZ -0.00010 -0.00020 -0.00029 0.00003 0.00004 205 4XY 0.00018 -0.00015 -0.00038 -0.00046 0.00025 206 4XZ -0.00009 0.00014 -0.00008 0.00015 -0.00008 207 4YZ -0.00025 -0.00003 -0.00012 0.00038 -0.00012 208 19 C 1S -0.00062 0.00010 0.00046 0.00110 -0.00038 209 2S 0.00138 -0.00022 -0.00119 -0.00255 0.00075 210 2PX -0.00210 0.00097 0.00284 0.00573 -0.00095 211 2PY 0.00040 -0.00021 0.00299 -0.00059 -0.00011 212 2PZ -0.00203 0.00142 -0.00345 0.00430 -0.00135 213 3S 0.00193 0.00009 -0.00160 -0.00516 0.00121 214 3PX -0.00227 -0.00049 0.00075 0.00399 -0.00087 215 3PY 0.00038 -0.00136 0.00292 -0.00072 0.00032 216 3PZ -0.00125 0.00094 -0.00168 0.00219 -0.00076 217 4XX -0.00018 0.00005 0.00018 0.00034 -0.00010 218 4YY 0.00000 -0.00006 -0.00028 -0.00017 0.00005 219 4ZZ -0.00004 0.00003 0.00021 0.00019 -0.00004 220 4XY 0.00017 -0.00005 -0.00041 -0.00036 0.00020 221 4XZ 0.00008 0.00005 0.00028 -0.00005 -0.00000 222 4YZ -0.00001 0.00001 0.00017 0.00009 -0.00004 223 20 C 1S 0.00020 0.00007 -0.00036 0.00003 0.00042 224 2S -0.00048 -0.00009 0.00070 0.00016 -0.00084 225 2PX 0.00106 0.00023 -0.00031 0.00016 0.00189 226 2PY -0.00047 -0.00072 -0.00164 -0.00205 -0.00032 227 2PZ -0.00151 0.00087 0.00459 0.00527 -0.00178 228 3S -0.00414 -0.00384 -0.00472 0.00023 -0.00041 229 3PX 0.00133 0.00155 0.00165 0.00014 0.00026 230 3PY -0.00198 -0.00233 -0.00233 -0.00149 -0.00006 231 3PZ -0.00187 -0.00050 0.00272 0.00349 -0.00124 232 4XX 0.00007 -0.00012 -0.00019 -0.00021 0.00010 233 4YY -0.00007 0.00012 -0.00018 0.00014 -0.00007 234 4ZZ 0.00006 -0.00006 0.00028 -0.00002 0.00005 235 4XY 0.00006 -0.00003 0.00001 -0.00002 0.00007 236 4XZ 0.00004 0.00007 -0.00020 -0.00015 0.00003 237 4YZ 0.00002 -0.00002 0.00021 -0.00002 -0.00002 238 21 C 1S -0.00114 -0.00013 0.00055 0.00127 -0.00074 239 2S 0.00280 0.00032 -0.00067 -0.00329 0.00131 240 2PX -0.00387 0.00021 0.00397 0.00390 -0.00458 241 2PY 0.00039 0.00182 -0.00200 -0.00030 0.00014 242 2PZ 0.00067 -0.00075 0.00749 0.00317 0.00055 243 3S 0.00644 0.00290 0.00268 -0.00552 0.00182 244 3PX 0.00191 0.00426 0.00500 0.00329 -0.00139 245 3PY -0.00188 -0.00308 -0.00409 -0.00133 0.00029 246 3PZ -0.00042 -0.00214 0.00372 0.00181 0.00058 247 4XX -0.00021 -0.00005 -0.00005 0.00038 0.00007 248 4YY -0.00000 0.00002 0.00015 0.00009 -0.00010 249 4ZZ -0.00001 0.00002 -0.00003 -0.00006 -0.00004 250 4XY 0.00018 -0.00002 -0.00011 -0.00031 0.00012 251 4XZ -0.00005 0.00005 0.00005 0.00018 -0.00011 252 4YZ -0.00006 0.00001 -0.00005 -0.00002 -0.00012 253 22 H 1S 0.00040 0.00050 0.00084 0.00010 -0.00037 254 2S -0.00095 0.00137 0.00047 0.00122 -0.00124 255 23 H 1S 0.00057 -0.00020 -0.00038 -0.00059 0.00084 256 2S 0.00133 -0.00024 -0.00089 -0.00154 0.00123 257 24 H 1S -0.00090 0.00026 0.00120 0.00217 -0.00047 258 2S -0.00163 0.00033 0.00204 0.00328 -0.00114 259 25 H 1S -0.00137 0.00004 -0.00179 0.00190 0.00004 260 2S -0.00204 -0.00067 -0.00094 0.00280 -0.00093 261 26 H 1S 0.00098 -0.00145 0.00100 -0.00675 -0.00259 262 2S -0.02187 0.00091 -0.00678 0.01867 -0.01470 263 27 H 1S -0.00763 -0.00635 -0.00808 0.00348 -0.00507 264 2S -0.01463 -0.01454 -0.01179 0.00796 -0.00759 86 87 88 89 90 86 3PZ 0.06293 87 4XX -0.00027 0.00093 88 4YY -0.00285 0.00015 0.00099 89 4ZZ 0.00253 -0.00010 -0.00036 0.00115 90 4XY -0.00199 -0.00002 0.00006 -0.00032 0.00055 91 4XZ 0.00229 0.00023 -0.00027 -0.00004 -0.00004 92 4YZ 0.00317 0.00005 -0.00002 -0.00010 -0.00024 93 7 C 1S 0.00655 -0.00019 -0.00381 0.00269 -0.00404 94 2S -0.00573 -0.00023 0.00662 -0.00657 0.00767 95 2PX -0.03576 -0.00926 0.00868 -0.00549 -0.00263 96 2PY -0.05286 0.00196 -0.00417 -0.00911 0.00669 97 2PZ 0.02307 0.00013 0.00469 -0.00823 0.00489 98 3S 0.00222 0.00083 0.00620 -0.00635 0.00552 99 3PX -0.01448 -0.00548 0.00605 -0.00187 -0.00274 100 3PY -0.01878 0.00275 -0.00243 -0.00337 0.00312 101 3PZ 0.00837 -0.00002 0.00065 -0.00229 0.00108 102 4XX -0.00043 0.00001 -0.00020 0.00008 -0.00022 103 4YY -0.00240 -0.00025 -0.00002 -0.00009 0.00012 104 4ZZ 0.00305 0.00013 -0.00024 0.00060 -0.00026 105 4XY -0.00135 -0.00017 0.00008 -0.00026 0.00032 106 4XZ 0.00089 -0.00030 0.00003 0.00007 -0.00018 107 4YZ 0.00158 -0.00005 -0.00045 0.00006 -0.00000 108 8 C 1S -0.00854 -0.00012 -0.00093 0.00057 -0.00072 109 2S 0.00939 0.00063 0.00222 -0.00082 0.00139 110 2PX 0.00785 -0.00579 0.00921 -0.00031 -0.00194 111 2PY 0.03045 0.00502 0.00061 -0.00189 0.00556 112 2PZ -0.02187 -0.00053 -0.00425 0.00122 -0.00263 113 3S -0.00205 0.00053 0.00210 -0.00167 0.00145 114 3PX -0.00235 -0.00416 0.00514 0.00003 -0.00181 115 3PY 0.00706 0.00289 -0.00128 -0.00084 0.00261 116 3PZ -0.00168 -0.00000 -0.00128 -0.00086 -0.00036 117 4XX -0.00081 -0.00020 0.00012 -0.00005 -0.00015 118 4YY -0.00095 0.00013 -0.00016 -0.00033 0.00024 119 4ZZ 0.00052 0.00003 -0.00005 0.00031 -0.00010 120 4XY -0.00069 -0.00016 0.00022 -0.00026 0.00005 121 4XZ -0.00103 0.00017 -0.00034 0.00010 -0.00001 122 4YZ -0.00172 -0.00014 -0.00018 0.00015 -0.00029 123 9 C 1S 0.00900 -0.00027 -0.00003 -0.00006 0.00018 124 2S -0.01410 0.00037 -0.00006 0.00005 -0.00024 125 2PX -0.01425 -0.00034 0.00157 -0.00078 0.00021 126 2PY -0.01464 0.00077 0.00042 -0.00160 0.00101 127 2PZ 0.00659 0.00019 0.00123 -0.00160 0.00105 128 3S -0.02024 0.00123 0.00129 0.00011 -0.00018 129 3PX -0.00629 0.00008 0.00125 -0.00083 0.00038 130 3PY -0.00458 0.00078 0.00107 -0.00163 0.00077 131 3PZ -0.00032 0.00020 0.00077 -0.00165 0.00086 132 4XX -0.00007 0.00019 -0.00020 0.00000 0.00008 133 4YY -0.00087 -0.00022 0.00010 0.00012 -0.00013 134 4ZZ 0.00191 0.00001 0.00014 -0.00010 0.00008 135 4XY -0.00068 0.00008 -0.00012 0.00006 0.00002 136 4XZ -0.00006 0.00028 -0.00033 -0.00010 0.00013 137 4YZ -0.00081 -0.00017 0.00008 -0.00011 -0.00016 138 10 C 1S 0.00181 0.00046 0.00045 -0.00121 0.00033 139 2S -0.01392 -0.00048 -0.00034 0.00271 -0.00062 140 2PX 0.00357 0.00411 -0.00398 0.00175 0.00156 141 2PY 0.00344 -0.00331 0.00151 0.00455 -0.00221 142 2PZ 0.03405 0.00104 0.00157 -0.00717 0.00126 143 3S -0.01714 -0.00074 -0.00171 0.00374 -0.00147 144 3PX -0.00409 0.00373 -0.00222 -0.00033 0.00182 145 3PY -0.00903 -0.00163 0.00278 0.00056 -0.00092 146 3PZ 0.00526 0.00051 0.00172 -0.00342 0.00081 147 4XX -0.00059 0.00021 0.00000 -0.00020 0.00009 148 4YY -0.00227 -0.00002 0.00028 -0.00011 0.00003 149 4ZZ 0.00512 -0.00023 -0.00035 0.00022 -0.00010 150 4XY -0.00147 0.00012 0.00001 -0.00001 0.00007 151 4XZ 0.00013 -0.00002 0.00009 -0.00020 0.00003 152 4YZ -0.00011 0.00014 0.00010 -0.00039 0.00005 153 11 H 1S 0.02427 -0.00004 -0.00021 -0.00190 0.00008 154 2S 0.03510 -0.00042 -0.00144 -0.00096 -0.00027 155 12 H 1S 0.00713 0.00000 0.00038 0.00042 0.00015 156 2S 0.01041 -0.00007 0.00071 0.00060 0.00032 157 13 H 1S -0.01466 -0.00051 -0.00147 -0.00045 -0.00091 158 2S -0.01684 -0.00058 -0.00135 -0.00124 -0.00057 159 14 H 1S 0.00479 0.00046 -0.00138 0.00470 -0.00103 160 2S 0.01276 0.00003 -0.00317 0.00560 -0.00262 161 15 H 1S -0.06067 -0.00430 0.00094 0.00297 0.00420 162 2S -0.03728 -0.00129 0.00149 0.00282 0.00172 163 16 C 1S -0.00037 0.00015 0.00007 -0.00003 0.00000 164 2S 0.00076 -0.00025 -0.00009 0.00008 -0.00003 165 2PX -0.00430 0.00038 0.00024 -0.00008 -0.00004 166 2PY 0.00268 0.00065 -0.00054 -0.00019 -0.00021 167 2PZ -0.00358 -0.00025 0.00055 0.00043 -0.00016 168 3S 0.00897 -0.00176 -0.00011 0.00127 -0.00012 169 3PX -0.00460 0.00106 -0.00024 -0.00037 0.00049 170 3PY 0.00708 0.00009 -0.00057 -0.00002 -0.00061 171 3PZ -0.00151 -0.00039 0.00039 0.00034 -0.00036 172 4XX 0.00004 0.00002 -0.00002 0.00003 -0.00003 173 4YY -0.00042 -0.00000 0.00003 -0.00002 0.00002 174 4ZZ 0.00019 0.00001 -0.00001 -0.00002 0.00000 175 4XY -0.00040 0.00006 -0.00002 -0.00003 -0.00002 176 4XZ 0.00011 0.00003 -0.00001 -0.00002 -0.00000 177 4YZ 0.00021 -0.00001 -0.00000 -0.00003 0.00002 178 17 C 1S -0.00015 -0.00015 0.00029 0.00050 0.00008 179 2S 0.00070 0.00031 -0.00040 -0.00079 -0.00021 180 2PX 0.00142 -0.00175 0.00073 0.00136 0.00094 181 2PY 0.00486 -0.00032 -0.00012 -0.00003 0.00032 182 2PZ -0.00916 -0.00048 0.00080 0.00049 0.00006 183 3S -0.00114 0.00052 -0.00049 -0.00082 -0.00006 184 3PX 0.00098 -0.00179 0.00123 0.00063 -0.00065 185 3PY 0.00506 0.00038 -0.00038 -0.00031 -0.00021 186 3PZ -0.00408 0.00034 0.00005 0.00011 -0.00001 187 4XX -0.00007 0.00008 -0.00004 -0.00005 -0.00005 188 4YY 0.00004 -0.00003 0.00001 0.00002 -0.00000 189 4ZZ 0.00000 -0.00004 0.00004 0.00004 0.00001 190 4XY 0.00005 0.00008 -0.00003 -0.00007 -0.00003 191 4XZ -0.00031 0.00000 0.00002 -0.00002 -0.00002 192 4YZ 0.00007 -0.00002 0.00001 0.00000 -0.00000 193 18 C 1S -0.00041 0.00008 -0.00003 -0.00010 -0.00007 194 2S 0.00049 -0.00026 0.00007 0.00022 0.00010 195 2PX -0.00105 0.00066 -0.00006 -0.00032 -0.00037 196 2PY 0.00518 -0.00009 -0.00026 -0.00005 0.00009 197 2PZ -0.00608 -0.00021 0.00029 0.00024 -0.00010 198 3S 0.00190 0.00083 -0.00079 0.00013 0.00070 199 3PX -0.00180 -0.00018 0.00024 0.00003 0.00001 200 3PY 0.00339 0.00044 -0.00054 -0.00008 0.00041 201 3PZ -0.00404 0.00001 0.00009 0.00014 0.00004 202 4XX 0.00002 0.00006 -0.00003 -0.00005 -0.00003 203 4YY 0.00017 -0.00002 0.00000 0.00001 0.00003 204 4ZZ -0.00026 -0.00002 0.00003 0.00001 -0.00000 205 4XY -0.00022 0.00001 0.00002 0.00001 -0.00002 206 4XZ 0.00024 0.00003 -0.00003 -0.00002 -0.00001 207 4YZ -0.00014 -0.00002 0.00002 0.00002 0.00002 208 19 C 1S 0.00012 -0.00006 0.00003 0.00004 0.00005 209 2S -0.00007 0.00021 -0.00006 -0.00008 -0.00010 210 2PX -0.00035 -0.00050 0.00012 0.00019 0.00028 211 2PY 0.00006 -0.00010 0.00019 0.00015 0.00010 212 2PZ 0.00055 0.00016 -0.00025 -0.00009 -0.00002 213 3S -0.00023 -0.00004 0.00016 -0.00019 -0.00047 214 3PX -0.00053 -0.00010 0.00002 0.00008 0.00028 215 3PY -0.00067 -0.00038 0.00031 0.00019 0.00004 216 3PZ 0.00029 -0.00002 -0.00011 -0.00003 -0.00002 217 4XX 0.00004 -0.00002 0.00001 0.00001 0.00000 218 4YY -0.00026 -0.00001 0.00002 0.00001 -0.00000 219 4ZZ 0.00023 0.00001 -0.00002 -0.00001 0.00001 220 4XY -0.00020 0.00002 0.00001 -0.00000 -0.00001 221 4XZ 0.00027 0.00002 -0.00002 -0.00001 -0.00000 222 4YZ 0.00019 0.00000 -0.00001 -0.00001 0.00000 223 20 C 1S -0.00050 -0.00001 0.00001 0.00003 -0.00000 224 2S 0.00089 0.00000 -0.00004 -0.00004 -0.00000 225 2PX -0.00140 0.00005 0.00005 0.00003 0.00002 226 2PY -0.00230 -0.00017 0.00017 0.00006 -0.00006 227 2PZ 0.00635 0.00014 -0.00049 -0.00025 0.00005 228 3S -0.00098 0.00044 0.00004 -0.00040 0.00018 229 3PX 0.00014 -0.00011 -0.00001 0.00010 -0.00011 230 3PY -0.00295 -0.00021 0.00037 -0.00003 -0.00005 231 3PZ 0.00360 0.00009 -0.00024 -0.00023 0.00005 232 4XX -0.00010 0.00001 0.00000 -0.00001 -0.00001 233 4YY -0.00006 0.00000 -0.00001 -0.00000 0.00000 234 4ZZ 0.00005 -0.00001 0.00001 0.00001 0.00000 235 4XY 0.00005 0.00002 -0.00000 -0.00000 -0.00000 236 4XZ -0.00013 0.00001 -0.00000 -0.00000 -0.00001 237 4YZ 0.00008 -0.00001 0.00000 0.00000 0.00001 238 21 C 1S 0.00049 -0.00005 0.00002 -0.00001 0.00004 239 2S -0.00068 0.00012 -0.00009 0.00003 -0.00008 240 2PX 0.00324 -0.00043 -0.00001 -0.00001 0.00016 241 2PY -0.00268 -0.00002 0.00002 0.00007 0.00005 242 2PZ 0.00393 -0.00016 0.00002 0.00006 0.00013 243 3S -0.00100 -0.00020 0.00001 0.00016 -0.00038 244 3PX 0.00385 -0.00017 -0.00038 0.00032 0.00008 245 3PY -0.00367 0.00019 0.00007 -0.00009 0.00017 246 3PZ 0.00251 -0.00002 0.00005 -0.00005 0.00014 247 4XX -0.00002 0.00001 -0.00000 -0.00001 -0.00000 248 4YY 0.00011 -0.00002 0.00000 0.00001 0.00001 249 4ZZ -0.00005 -0.00001 0.00000 0.00000 0.00000 250 4XY -0.00026 -0.00003 0.00003 0.00002 -0.00001 251 4XZ 0.00021 0.00001 -0.00003 -0.00001 0.00000 252 4YZ -0.00007 -0.00001 0.00001 0.00000 0.00000 253 22 H 1S -0.00041 -0.00009 0.00003 0.00006 0.00007 254 2S 0.00051 -0.00021 0.00012 0.00005 0.00004 255 23 H 1S -0.00050 0.00008 -0.00000 -0.00003 -0.00003 256 2S -0.00061 0.00013 -0.00002 -0.00002 -0.00003 257 24 H 1S -0.00007 -0.00022 0.00003 0.00006 0.00008 258 2S 0.00020 -0.00032 0.00007 0.00012 0.00008 259 25 H 1S -0.00067 -0.00011 0.00012 0.00012 0.00012 260 2S -0.00063 -0.00006 0.00008 0.00008 0.00021 261 26 H 1S -0.00014 0.00107 -0.00063 -0.00103 -0.00073 262 2S 0.00102 -0.00001 0.00058 -0.00075 -0.00166 263 27 H 1S -0.00134 0.00011 0.00038 -0.00047 0.00020 264 2S -0.00791 0.00079 0.00026 -0.00086 0.00055 91 92 93 94 95 91 4XZ 0.00079 92 4YZ 0.00049 0.00141 93 7 C 1S -0.00131 -0.00229 2.05290 94 2S 0.00233 0.00422 -0.06358 0.32962 95 2PX -0.00080 0.00384 0.00087 -0.00132 0.34945 96 2PY 0.00337 0.00332 0.00099 -0.00082 0.04222 97 2PZ -0.00583 -0.00942 0.00221 0.00236 0.00495 98 3S 0.00323 0.00611 -0.17105 0.26401 0.00395 99 3PX -0.00141 0.00207 0.00085 -0.00568 0.19455 100 3PY 0.00158 0.00034 0.00174 -0.00762 -0.03820 101 3PZ -0.00172 -0.00281 0.00235 -0.02300 0.00177 102 4XX 0.00012 -0.00035 -0.01272 -0.01267 0.00405 103 4YY -0.00046 -0.00023 -0.01515 -0.00717 0.00250 104 4ZZ 0.00031 0.00045 -0.02041 0.00268 -0.00781 105 4XY 0.00010 -0.00020 -0.00273 0.00618 0.00396 106 4XZ 0.00025 0.00052 -0.00113 0.00208 0.00811 107 4YZ 0.00047 0.00070 -0.00091 0.00151 0.00107 108 8 C 1S 0.00089 0.00145 0.01679 -0.03378 0.02587 109 2S -0.00195 -0.00317 -0.03399 0.05920 -0.05472 110 2PX -0.00558 0.00057 -0.02696 0.05345 0.12200 111 2PY -0.00028 -0.00625 -0.04907 0.09865 -0.15387 112 2PZ 0.00301 0.00451 0.05671 -0.12048 0.07394 113 3S -0.00249 -0.00418 0.00661 0.01858 -0.03551 114 3PX -0.00366 0.00141 -0.00221 0.01387 0.09268 115 3PY 0.00093 -0.00300 -0.00415 0.02491 -0.07401 116 3PZ 0.00175 0.00262 0.00849 -0.02097 0.03056 117 4XX 0.00004 0.00011 0.00116 -0.00299 0.00824 118 4YY 0.00006 0.00007 -0.00079 0.00073 -0.00148 119 4ZZ 0.00012 0.00019 -0.00219 0.00259 -0.00264 120 4XY -0.00002 0.00002 -0.00155 0.00290 0.00580 121 4XZ 0.00010 0.00002 0.00278 -0.00552 -0.00513 122 4YZ 0.00004 0.00014 0.00506 -0.00996 0.00643 123 9 C 1S -0.00014 -0.00023 -0.00326 0.00876 -0.00180 124 2S 0.00047 0.00079 0.00868 -0.02045 0.00564 125 2PX -0.00007 0.00008 0.00072 -0.00095 -0.00588 126 2PY 0.00005 0.00005 0.00212 -0.00403 0.00690 127 2PZ -0.00033 -0.00045 -0.01461 0.03920 -0.00916 128 3S 0.00019 0.00041 -0.00674 -0.00543 -0.00502 129 3PX -0.00059 0.00009 -0.00445 0.00601 -0.01269 130 3PY -0.00002 -0.00054 -0.00721 0.00910 0.00753 131 3PZ -0.00001 -0.00010 -0.00181 0.01317 0.00369 132 4XX 0.00026 -0.00018 0.00030 -0.00029 -0.00383 133 4YY -0.00029 0.00011 0.00045 -0.00058 0.00444 134 4ZZ -0.00009 -0.00012 -0.00145 0.00316 -0.00196 135 4XY 0.00012 -0.00016 0.00031 -0.00061 -0.00167 136 4XZ 0.00027 0.00003 0.00079 -0.00176 -0.00575 137 4YZ 0.00005 0.00037 0.00144 -0.00321 0.00619 138 10 C 1S 0.00081 0.00127 -0.00340 0.00593 0.00045 139 2S -0.00177 -0.00268 0.00588 -0.01225 0.00033 140 2PX 0.00518 -0.00656 -0.00157 0.00345 -0.10044 141 2PY -0.00616 -0.00098 -0.00251 0.00488 0.04669 142 2PZ 0.00284 0.00544 -0.00817 0.01819 0.01008 143 3S -0.00207 -0.00361 0.02472 -0.03797 -0.00795 144 3PX 0.00351 -0.00436 -0.00334 0.00490 -0.08000 145 3PY -0.00393 -0.00043 -0.00502 0.00702 0.04529 146 3PZ 0.00089 0.00258 -0.01353 0.02107 0.01733 147 4XX 0.00026 -0.00007 -0.00032 0.00051 -0.00040 148 4YY -0.00021 0.00022 -0.00025 0.00057 0.00121 149 4ZZ 0.00018 0.00020 0.00015 -0.00061 -0.00056 150 4XY 0.00013 -0.00011 0.00010 0.00005 0.00001 151 4XZ -0.00021 0.00026 0.00008 -0.00027 0.00016 152 4YZ 0.00021 0.00003 0.00018 -0.00051 0.00122 153 11 H 1S 0.00106 0.00180 -0.00119 0.00270 0.00117 154 2S 0.00179 0.00234 0.00206 -0.00334 -0.00660 155 12 H 1S -0.00061 -0.00100 -0.00821 0.01933 -0.01008 156 2S -0.00134 -0.00218 -0.01253 0.02684 -0.01610 157 13 H 1S 0.00075 0.00126 0.01289 -0.02727 0.02187 158 2S 0.00119 0.00203 0.01562 -0.02776 0.04121 159 14 H 1S 0.00461 0.00726 -0.06136 0.11660 -0.04854 160 2S 0.00371 0.00567 -0.01375 0.02651 -0.03912 161 15 H 1S -0.00746 -0.01348 0.01244 -0.02682 -0.02336 162 2S -0.00627 -0.01151 0.01466 -0.02698 -0.04271 163 16 C 1S 0.00007 0.00006 -0.00007 0.00017 -0.00035 164 2S -0.00012 -0.00010 0.00036 -0.00054 0.00125 165 2PX 0.00030 0.00007 -0.00011 0.00026 -0.00004 166 2PY 0.00030 -0.00034 0.00064 -0.00189 -0.00836 167 2PZ -0.00031 0.00008 0.00042 -0.00117 0.00307 168 3S -0.00191 -0.00006 -0.00217 0.00066 0.00314 169 3PX 0.00059 -0.00013 -0.00541 0.00312 -0.01421 170 3PY 0.00015 -0.00022 0.00568 -0.00679 -0.00206 171 3PZ -0.00041 0.00007 0.00293 -0.00319 0.00872 172 4XX -0.00006 -0.00000 0.00010 -0.00022 -0.00025 173 4YY 0.00003 0.00003 -0.00018 0.00028 0.00031 174 4ZZ 0.00003 0.00002 -0.00001 0.00003 -0.00005 175 4XY -0.00000 0.00001 -0.00003 -0.00004 -0.00069 176 4XZ -0.00002 0.00002 -0.00003 0.00001 -0.00019 177 4YZ 0.00003 0.00002 -0.00013 0.00019 0.00009 178 17 C 1S 0.00016 -0.00020 0.00007 0.00002 0.00345 179 2S -0.00042 0.00054 -0.00041 0.00030 -0.00559 180 2PX 0.00105 -0.00072 -0.00081 0.00211 0.01612 181 2PY 0.00036 -0.00003 -0.00079 0.00200 0.00441 182 2PZ -0.00028 0.00005 -0.00044 0.00099 0.00741 183 3S -0.00124 0.00066 0.00281 -0.00183 -0.01704 184 3PX 0.00003 0.00019 0.00629 -0.00360 0.03835 185 3PY 0.00134 -0.00039 0.00401 -0.00461 0.00389 186 3PZ 0.00067 -0.00013 0.00169 -0.00183 -0.00399 187 4XX -0.00001 0.00003 0.00020 -0.00020 -0.00049 188 4YY -0.00001 0.00002 0.00016 -0.00007 0.00029 189 4ZZ -0.00001 0.00002 0.00006 0.00000 0.00052 190 4XY -0.00004 0.00005 0.00004 -0.00004 -0.00086 191 4XZ -0.00004 0.00000 0.00005 -0.00010 0.00026 192 4YZ -0.00002 0.00002 0.00008 -0.00004 0.00017 193 18 C 1S -0.00012 0.00007 0.00002 0.00007 -0.00029 194 2S 0.00015 -0.00014 0.00023 -0.00020 0.00220 195 2PX -0.00037 0.00015 0.00010 -0.00041 -0.00267 196 2PY 0.00017 -0.00006 0.00005 -0.00011 -0.00065 197 2PZ 0.00005 -0.00030 0.00021 -0.00062 0.00286 198 3S 0.00142 -0.00078 -0.00363 0.00104 -0.01913 199 3PX -0.00062 0.00014 -0.00177 0.00239 0.00232 200 3PY 0.00039 -0.00022 -0.00326 0.00234 -0.01206 201 3PZ 0.00010 -0.00030 -0.00143 0.00048 -0.00086 202 4XX -0.00003 0.00002 0.00004 -0.00012 -0.00074 203 4YY 0.00003 -0.00001 -0.00009 0.00015 0.00024 204 4ZZ -0.00001 -0.00000 0.00001 0.00003 0.00042 205 4XY -0.00003 0.00001 0.00003 -0.00003 0.00018 206 4XZ 0.00001 -0.00001 0.00002 -0.00002 -0.00024 207 4YZ 0.00002 -0.00001 -0.00008 0.00007 0.00023 208 19 C 1S 0.00007 -0.00001 -0.00007 0.00009 0.00055 209 2S -0.00012 0.00002 -0.00008 -0.00017 -0.00186 210 2PX 0.00024 -0.00003 -0.00017 0.00074 0.00298 211 2PY -0.00004 0.00006 -0.00007 0.00023 0.00202 212 2PZ 0.00032 -0.00026 0.00011 -0.00033 -0.00237 213 3S -0.00037 0.00028 0.00396 -0.00281 0.00619 214 3PX 0.00022 -0.00010 -0.00203 0.00192 -0.00121 215 3PY -0.00022 0.00007 0.00063 0.00025 0.00610 216 3PZ 0.00017 -0.00017 0.00046 -0.00015 -0.00008 217 4XX 0.00001 -0.00001 0.00003 -0.00003 0.00024 218 4YY -0.00000 0.00000 -0.00001 0.00001 0.00015 219 4ZZ 0.00001 0.00000 -0.00003 0.00002 -0.00016 220 4XY -0.00001 0.00000 0.00002 -0.00003 -0.00005 221 4XZ -0.00000 0.00001 0.00000 -0.00000 -0.00018 222 4YZ 0.00000 0.00000 0.00001 0.00002 -0.00005 223 20 C 1S -0.00001 -0.00001 0.00006 -0.00000 0.00025 224 2S 0.00002 0.00000 0.00012 -0.00009 -0.00030 225 2PX 0.00006 0.00002 0.00009 -0.00008 0.00007 226 2PY -0.00010 0.00001 -0.00002 -0.00009 0.00186 227 2PZ 0.00016 0.00001 -0.00010 0.00015 -0.00358 228 3S 0.00015 0.00025 -0.00405 0.00309 -0.00484 229 3PX 0.00001 -0.00007 0.00227 -0.00172 0.00238 230 3PY -0.00012 0.00013 0.00008 0.00065 0.00535 231 3PZ 0.00010 0.00006 -0.00007 0.00054 -0.00078 232 4XX -0.00001 0.00000 -0.00001 -0.00001 -0.00003 233 4YY 0.00001 -0.00001 0.00001 -0.00001 -0.00011 234 4ZZ -0.00001 0.00001 0.00002 0.00001 0.00013 235 4XY 0.00000 0.00000 0.00002 -0.00003 -0.00011 236 4XZ 0.00001 -0.00001 0.00002 -0.00003 -0.00012 237 4YZ -0.00001 0.00001 -0.00003 0.00003 0.00007 238 21 C 1S 0.00006 0.00004 -0.00013 0.00025 0.00053 239 2S -0.00015 -0.00010 -0.00002 -0.00051 -0.00187 240 2PX 0.00001 0.00006 -0.00035 0.00094 0.00304 241 2PY 0.00012 -0.00017 0.00015 -0.00003 -0.00025 242 2PZ -0.00017 0.00020 -0.00011 0.00047 0.00215 243 3S -0.00034 -0.00011 0.00481 -0.00320 0.00537 244 3PX 0.00010 -0.00031 0.00034 -0.00150 -0.00450 245 3PY 0.00003 -0.00002 -0.00311 0.00244 -0.00289 246 3PZ -0.00016 0.00020 -0.00180 0.00159 0.00011 247 4XX 0.00002 -0.00001 0.00002 -0.00002 -0.00012 248 4YY -0.00000 0.00000 0.00001 0.00003 0.00020 249 4ZZ -0.00000 0.00000 -0.00004 0.00002 0.00003 250 4XY -0.00002 0.00000 0.00005 -0.00002 0.00048 251 4XZ 0.00001 -0.00001 0.00002 0.00001 -0.00014 252 4YZ 0.00000 -0.00000 0.00004 0.00001 0.00019 253 22 H 1S -0.00001 -0.00005 0.00011 0.00016 0.00112 254 2S 0.00004 0.00004 0.00092 -0.00022 0.00397 255 23 H 1S 0.00001 0.00002 -0.00003 -0.00010 -0.00051 256 2S -0.00004 0.00002 -0.00043 0.00008 -0.00156 257 24 H 1S 0.00006 -0.00001 0.00000 0.00023 0.00122 258 2S 0.00009 -0.00005 0.00040 -0.00001 0.00291 259 25 H 1S 0.00009 -0.00001 -0.00026 0.00049 0.00153 260 2S 0.00010 -0.00005 -0.00164 0.00185 0.00034 261 26 H 1S -0.00019 0.00020 0.00018 -0.00152 -0.00506 262 2S 0.00060 0.00008 0.00606 -0.00629 0.03348 263 27 H 1S 0.00077 0.00062 -0.00111 0.00252 0.00219 264 2S 0.00142 0.00040 -0.00188 0.00361 -0.00125 96 97 98 99 100 96 2PY 0.39480 97 2PZ -0.00116 0.43031 98 3S -0.00572 -0.01771 0.24140 99 3PX -0.04193 -0.00168 0.00163 0.12219 100 3PY 0.14559 0.00466 -0.00600 -0.04397 0.06772 101 3PZ 0.01088 0.13468 -0.02159 -0.00199 0.00614 102 4XX 0.00136 0.00183 -0.00965 0.00205 0.00015 103 4YY 0.00745 0.00654 -0.00674 0.00006 0.00228 104 4ZZ -0.01016 -0.01565 0.00512 -0.00224 -0.00235 105 4XY 0.00437 0.00324 0.00347 0.00120 0.00084 106 4XZ 0.00128 -0.00816 0.00261 0.00416 -0.00123 107 4YZ 0.01116 -0.01111 0.00212 -0.00146 0.00324 108 8 C 1S 0.04824 -0.05758 0.00576 0.00414 0.00755 109 2S -0.10164 0.11627 0.02304 -0.00865 -0.01734 110 2PX -0.15390 0.07195 0.06594 0.09660 -0.07207 111 2PY -0.05852 0.14972 0.10221 -0.07445 0.01110 112 2PZ 0.15431 -0.15838 -0.07025 0.03146 0.06557 113 3S -0.06697 0.11317 -0.01310 -0.00331 -0.00630 114 3PX -0.07120 0.01707 0.01921 0.06530 -0.04074 115 3PY 0.01154 0.04267 0.02416 -0.04330 0.01903 116 3PZ 0.07048 -0.03998 -0.00531 0.00907 0.02599 117 4XX 0.00180 -0.00237 -0.00223 0.00406 -0.00097 118 4YY 0.01070 0.00441 -0.00166 -0.00292 0.00384 119 4ZZ -0.00466 -0.01095 0.00447 -0.00049 -0.00141 120 4XY 0.00054 0.00574 0.00008 0.00309 -0.00060 121 4XZ 0.00679 -0.00422 -0.00528 -0.00399 0.00411 122 4YZ 0.00339 -0.00721 -0.00928 0.00401 0.00110 123 9 C 1S -0.00458 0.01399 -0.00659 -0.00429 -0.00717 124 2S 0.01396 -0.03644 -0.00594 0.00755 0.01403 125 2PX 0.00733 0.00135 -0.01670 -0.00936 0.01473 126 2PY 0.00311 -0.00074 -0.03493 0.01587 0.01187 127 2PZ -0.02118 0.05022 0.03266 -0.01925 -0.03378 128 3S -0.01523 -0.04830 0.01706 0.00611 0.00434 129 3PX 0.00504 0.01781 0.00174 -0.01195 0.00929 130 3PY -0.00998 0.02720 -0.00084 0.01164 -0.00024 131 3PZ 0.00874 0.03026 0.01261 -0.00396 -0.00380 132 4XX 0.00319 -0.00081 -0.00090 -0.00342 0.00165 133 4YY -0.00115 -0.00169 -0.00175 0.00272 -0.00218 134 4ZZ -0.00494 0.00771 0.00382 -0.00026 -0.00134 135 4XY 0.00202 -0.00086 -0.00143 -0.00173 0.00090 136 4XZ 0.00617 -0.00238 -0.00230 -0.00389 0.00405 137 4YZ 0.00136 -0.00545 -0.00360 0.00410 0.00068 138 10 C 1S 0.00156 0.00841 0.02519 0.00158 0.00310 139 2S -0.00450 -0.01725 -0.03321 -0.00015 -0.00419 140 2PX 0.04354 0.01330 0.00688 -0.08212 0.03245 141 2PY -0.05644 0.01013 0.01187 0.03726 -0.04672 142 2PZ 0.01259 0.02214 0.05111 0.00604 0.00866 143 3S 0.00187 -0.06622 -0.05781 -0.00487 -0.00068 144 3PX 0.04291 0.00918 0.00738 -0.06157 0.03398 145 3PY -0.03584 0.00499 0.01277 0.03690 -0.02428 146 3PZ 0.00814 0.02073 0.02982 0.00936 0.00210 147 4XX 0.00068 0.00022 0.00111 -0.00019 0.00063 148 4YY 0.00040 -0.00004 0.00130 0.00086 0.00027 149 4ZZ -0.00111 -0.00003 0.00009 -0.00048 -0.00087 150 4XY 0.00089 -0.00015 -0.00012 -0.00000 0.00062 151 4XZ 0.00136 -0.00037 0.00014 0.00073 0.00104 152 4YZ 0.00160 -0.00080 0.00019 0.00100 0.00198 153 11 H 1S 0.00236 0.00400 0.01582 0.00017 0.00130 154 2S -0.00102 -0.00098 0.01246 -0.00355 0.00151 155 12 H 1S -0.02076 0.02718 0.03408 -0.01197 -0.02229 156 2S -0.03571 0.05356 0.03202 -0.01322 -0.02669 157 13 H 1S 0.03866 -0.01665 -0.05763 0.00418 0.00831 158 2S 0.07325 -0.02575 -0.04916 0.00896 0.01737 159 14 H 1S -0.05638 -0.25886 0.11064 -0.01707 -0.01982 160 2S -0.04438 -0.21382 0.03499 -0.01236 -0.01330 161 15 H 1S -0.03892 0.01027 -0.04790 -0.00598 -0.00742 162 2S -0.07531 0.02294 -0.03899 -0.01078 -0.01839 163 16 C 1S 0.00085 0.00021 -0.00005 -0.00025 0.00059 164 2S -0.00121 -0.00098 0.00005 0.00077 -0.00095 165 2PX 0.00171 0.00079 0.00250 -0.00002 0.00174 166 2PY 0.00234 -0.00026 0.00225 -0.00595 0.00423 167 2PZ -0.00405 -0.00071 0.00071 0.00450 -0.00359 168 3S -0.01362 0.00316 -0.00159 0.00441 -0.00775 169 3PX 0.01269 0.00049 0.00391 -0.00965 0.00829 170 3PY -0.00646 -0.00289 -0.00545 -0.00173 -0.00193 171 3PZ -0.00697 -0.00229 -0.00272 0.00691 -0.00543 172 4XX -0.00031 -0.00011 -0.00053 -0.00017 -0.00034 173 4YY 0.00029 0.00018 0.00043 0.00024 0.00018 174 4ZZ 0.00020 -0.00005 -0.00004 -0.00009 0.00012 175 4XY 0.00045 -0.00012 -0.00011 -0.00052 0.00013 176 4XZ 0.00011 0.00001 0.00017 -0.00019 0.00023 177 4YZ 0.00020 0.00011 0.00011 0.00001 0.00012 178 17 C 1S -0.00227 -0.00024 0.00214 0.00265 0.00022 179 2S 0.00448 0.00014 -0.00283 -0.00430 0.00010 180 2PX -0.00899 -0.00017 0.00208 0.01170 -0.00410 181 2PY -0.00007 0.00044 -0.00007 0.00106 0.00104 182 2PZ -0.00283 0.00003 0.00182 0.00699 -0.00373 183 3S 0.01380 0.00191 -0.00508 -0.01216 0.00566 184 3PX -0.01949 -0.00693 -0.00148 0.02521 -0.01332 185 3PY -0.00546 -0.00388 -0.00317 0.00143 -0.00074 186 3PZ 0.00197 -0.00116 0.00005 -0.00207 0.00098 187 4XX 0.00023 -0.00014 -0.00017 -0.00038 0.00006 188 4YY -0.00009 -0.00020 0.00007 0.00020 -0.00002 189 4ZZ -0.00028 -0.00012 0.00013 0.00042 -0.00015 190 4XY 0.00061 0.00011 -0.00009 -0.00065 0.00030 191 4XZ -0.00030 0.00005 -0.00002 0.00028 -0.00020 192 4YZ -0.00007 -0.00006 -0.00011 0.00013 -0.00014 193 18 C 1S 0.00050 0.00007 -0.00019 -0.00049 0.00021 194 2S -0.00154 -0.00049 0.00020 0.00185 -0.00091 195 2PX 0.00220 0.00020 0.00050 -0.00237 0.00177 196 2PY -0.00003 -0.00021 -0.00232 -0.00154 0.00009 197 2PZ -0.00287 -0.00049 0.00042 0.00343 -0.00256 198 3S 0.00547 0.00283 0.00166 -0.01196 0.00658 199 3PX 0.00119 0.00190 0.00156 0.00142 -0.00006 200 3PY 0.00494 0.00300 0.00035 -0.00846 0.00423 201 3PZ -0.00220 0.00100 0.00097 0.00092 -0.00114 202 4XX 0.00031 -0.00000 -0.00015 -0.00053 0.00015 203 4YY -0.00001 0.00006 0.00008 0.00011 0.00004 204 4ZZ -0.00017 -0.00003 0.00008 0.00032 -0.00014 205 4XY -0.00007 -0.00004 0.00007 0.00015 -0.00007 206 4XZ 0.00016 -0.00002 0.00002 -0.00025 0.00020 207 4YZ -0.00013 0.00006 0.00010 0.00022 -0.00007 208 19 C 1S -0.00026 0.00000 0.00023 0.00055 -0.00014 209 2S 0.00079 0.00005 -0.00022 -0.00147 0.00055 210 2PX -0.00151 0.00007 0.00021 0.00221 -0.00115 211 2PY -0.00112 0.00001 -0.00058 0.00159 -0.00143 212 2PZ 0.00091 -0.00022 0.00073 -0.00186 0.00178 213 3S -0.00216 -0.00276 -0.00241 0.00340 -0.00250 214 3PX 0.00088 0.00144 0.00168 -0.00060 0.00091 215 3PY -0.00212 -0.00009 -0.00048 0.00409 -0.00232 216 3PZ 0.00057 -0.00021 0.00025 -0.00046 0.00080 217 4XX -0.00015 -0.00006 -0.00003 0.00016 -0.00009 218 4YY -0.00007 -0.00000 0.00002 0.00017 -0.00012 219 4ZZ 0.00012 0.00002 0.00004 -0.00015 0.00015 220 4XY 0.00002 -0.00000 0.00007 0.00000 -0.00000 221 4XZ 0.00012 0.00001 -0.00003 -0.00019 0.00012 222 4YZ 0.00008 0.00002 0.00001 -0.00007 0.00010 223 20 C 1S -0.00023 -0.00003 -0.00003 0.00004 -0.00014 224 2S 0.00035 -0.00007 -0.00017 -0.00007 0.00021 225 2PX -0.00038 0.00002 0.00053 -0.00004 -0.00015 226 2PY -0.00116 -0.00020 -0.00047 0.00209 -0.00184 227 2PZ 0.00260 0.00036 0.00068 -0.00375 0.00389 228 3S 0.00607 0.00206 0.00508 -0.00275 0.00449 229 3PX -0.00244 -0.00125 -0.00212 0.00132 -0.00186 230 3PY -0.00067 0.00011 0.00092 0.00398 -0.00167 231 3PZ 0.00231 0.00042 0.00102 -0.00171 0.00272 232 4XX 0.00005 0.00000 0.00007 -0.00001 0.00004 233 4YY 0.00001 -0.00003 -0.00003 -0.00009 0.00001 234 4ZZ -0.00006 -0.00001 -0.00003 0.00007 -0.00005 235 4XY 0.00003 0.00001 0.00004 -0.00009 0.00007 236 4XZ 0.00003 -0.00002 -0.00004 -0.00007 -0.00002 237 4YZ -0.00004 0.00002 -0.00002 0.00004 -0.00004 238 21 C 1S 0.00009 0.00007 0.00028 0.00043 0.00011 239 2S -0.00000 -0.00020 -0.00074 -0.00132 -0.00021 240 2PX -0.00073 0.00002 -0.00124 0.00199 -0.00089 241 2PY -0.00062 -0.00041 -0.00135 -0.00037 -0.00149 242 2PZ -0.00114 0.00035 0.00031 0.00080 0.00028 243 3S -0.00581 -0.00160 -0.00523 0.00293 -0.00513 244 3PX -0.00212 -0.00124 -0.00305 -0.00271 -0.00056 245 3PY 0.00399 0.00044 0.00248 -0.00181 0.00177 246 3PZ 0.00103 0.00076 0.00213 -0.00014 0.00156 247 4XX 0.00011 0.00001 0.00023 -0.00006 0.00016 248 4YY -0.00012 0.00001 -0.00008 0.00011 -0.00008 249 4ZZ -0.00003 -0.00002 -0.00006 0.00003 -0.00007 250 4XY -0.00033 -0.00003 -0.00010 0.00036 -0.00032 251 4XZ 0.00014 0.00001 -0.00002 -0.00022 0.00017 252 4YZ -0.00008 -0.00001 -0.00010 0.00011 -0.00011 253 22 H 1S -0.00086 -0.00010 -0.00111 0.00036 -0.00107 254 2S -0.00206 0.00022 -0.00111 0.00235 -0.00167 255 23 H 1S 0.00019 0.00006 0.00034 -0.00028 0.00020 256 2S 0.00043 0.00033 0.00045 -0.00093 0.00045 257 24 H 1S -0.00061 -0.00002 -0.00008 0.00080 -0.00046 258 2S -0.00140 -0.00022 -0.00039 0.00195 -0.00105 259 25 H 1S -0.00036 0.00021 0.00134 0.00136 0.00005 260 2S -0.00001 0.00148 0.00178 0.00055 0.00038 261 26 H 1S 0.00269 0.00021 -0.00265 -0.00463 -0.00004 262 2S -0.02136 -0.00896 -0.00289 0.02101 -0.01382 263 27 H 1S 0.00432 0.00129 0.00508 0.00198 0.00411 264 2S 0.01109 0.00209 0.00599 -0.00171 0.00822 101 102 103 104 105 101 3PZ 0.04585 102 4XX 0.00125 0.00105 103 4YY 0.00258 0.00022 0.00122 104 4ZZ -0.00481 -0.00027 -0.00070 0.00170 105 4XY 0.00039 0.00012 0.00002 -0.00040 0.00054 106 4XZ -0.00246 -0.00015 -0.00007 0.00022 -0.00005 107 4YZ -0.00311 -0.00003 -0.00016 0.00023 0.00004 108 8 C 1S -0.00580 0.00111 -0.00103 -0.00186 -0.00173 109 2S 0.03164 -0.00308 0.00061 0.00273 0.00285 110 2PX 0.02196 -0.00828 0.00032 0.00370 -0.00554 111 2PY 0.04365 -0.00316 -0.01138 0.00692 -0.00092 112 2PZ -0.02529 0.00220 -0.00276 0.00978 -0.00385 113 3S 0.03093 -0.00090 0.00255 -0.00060 0.00279 114 3PX 0.00513 -0.00443 0.00241 0.00052 -0.00315 115 3PY 0.01203 0.00052 -0.00466 0.00166 0.00057 116 3PZ -0.00472 0.00035 -0.00094 0.00239 -0.00071 117 4XX -0.00079 0.00021 0.00020 -0.00037 -0.00002 118 4YY 0.00091 0.00017 0.00049 -0.00079 0.00035 119 4ZZ -0.00327 -0.00026 -0.00060 0.00094 -0.00028 120 4XY 0.00121 0.00003 0.00037 -0.00050 0.00037 121 4XZ -0.00068 -0.00009 0.00039 0.00009 -0.00021 122 4YZ -0.00182 0.00051 0.00010 0.00004 0.00003 123 9 C 1S -0.00242 0.00046 0.00103 -0.00215 0.00063 124 2S -0.00656 -0.00066 -0.00194 0.00485 -0.00139 125 2PX -0.00321 -0.00591 0.00710 -0.00153 -0.00365 126 2PY -0.01610 0.00393 -0.00304 -0.00127 0.00305 127 2PZ 0.00415 0.00202 0.00387 -0.01202 0.00268 128 3S -0.01156 -0.00109 -0.00327 0.00538 -0.00213 129 3PX 0.00581 -0.00457 0.00488 -0.00098 -0.00273 130 3PY 0.00162 0.00257 -0.00261 -0.00108 0.00212 131 3PZ 0.00672 0.00078 0.00153 -0.00442 0.00121 132 4XX -0.00035 0.00013 0.00008 -0.00024 0.00009 133 4YY -0.00115 0.00009 0.00024 -0.00039 0.00008 134 4ZZ 0.00280 -0.00019 -0.00013 0.00020 -0.00001 135 4XY -0.00047 0.00007 0.00008 -0.00013 0.00007 136 4XZ -0.00074 0.00020 -0.00009 0.00012 0.00014 137 4YZ -0.00182 0.00002 0.00025 0.00011 -0.00002 138 10 C 1S 0.01205 -0.00030 -0.00032 0.00023 0.00009 139 2S -0.01529 0.00047 0.00073 -0.00083 0.00011 140 2PX 0.01233 -0.00074 0.00001 0.00083 -0.00065 141 2PY 0.00707 -0.00030 -0.00118 0.00116 -0.00054 142 2PZ 0.00859 -0.00005 -0.00006 -0.00012 0.00001 143 3S -0.02713 0.00106 0.00131 0.00076 -0.00012 144 3PX 0.00703 -0.00074 -0.00006 0.00064 -0.00049 145 3PY 0.00142 -0.00020 -0.00117 0.00086 -0.00031 146 3PZ 0.00449 -0.00021 0.00029 -0.00154 0.00042 147 4XX 0.00009 0.00036 -0.00036 -0.00004 0.00023 148 4YY 0.00014 -0.00036 0.00038 -0.00011 -0.00024 149 4ZZ 0.00045 -0.00003 -0.00015 0.00038 -0.00005 150 4XY -0.00034 0.00022 -0.00023 -0.00004 0.00014 151 4XZ -0.00011 -0.00018 0.00008 0.00016 -0.00012 152 4YZ -0.00025 0.00004 -0.00017 0.00025 -0.00001 153 11 H 1S 0.00111 -0.00010 -0.00043 0.00120 -0.00032 154 2S 0.00342 -0.00026 -0.00125 0.00290 -0.00068 155 12 H 1S 0.01122 0.00003 0.00023 -0.00276 0.00020 156 2S 0.01702 -0.00016 0.00033 -0.00341 0.00044 157 13 H 1S -0.00936 0.00300 0.00704 -0.00646 0.00434 158 2S -0.01112 0.00302 0.00602 -0.00688 0.00349 159 14 H 1S -0.08943 -0.00635 -0.00835 0.01432 -0.00119 160 2S -0.06731 -0.00310 -0.00615 0.01227 -0.00256 161 15 H 1S -0.00033 0.00151 0.00460 -0.00277 0.00218 162 2S 0.00282 0.00121 0.00170 -0.00100 0.00039 163 16 C 1S -0.00016 0.00000 0.00000 -0.00005 -0.00003 164 2S 0.00031 0.00002 -0.00004 0.00008 0.00008 165 2PX 0.00118 0.00001 0.00011 -0.00014 -0.00012 166 2PY -0.00037 0.00021 -0.00016 0.00005 -0.00003 167 2PZ 0.00123 0.00003 -0.00005 0.00005 -0.00009 168 3S 0.00117 -0.00118 0.00090 0.00062 -0.00043 169 3PX 0.00043 0.00034 -0.00046 -0.00008 0.00032 170 3PY -0.00108 0.00010 -0.00001 0.00029 -0.00033 171 3PZ 0.00009 0.00001 0.00004 0.00006 -0.00020 172 4XX -0.00005 -0.00005 0.00005 0.00002 -0.00005 173 4YY 0.00013 0.00001 -0.00001 -0.00002 0.00002 174 4ZZ -0.00011 0.00001 -0.00002 -0.00000 0.00001 175 4XY 0.00005 -0.00002 0.00002 -0.00000 -0.00003 176 4XZ -0.00008 -0.00002 0.00003 -0.00001 -0.00002 177 4YZ -0.00006 0.00001 -0.00002 -0.00001 0.00002 178 17 C 1S 0.00036 0.00036 -0.00015 0.00016 0.00022 179 2S -0.00067 -0.00072 0.00044 -0.00020 -0.00048 180 2PX 0.00114 0.00101 -0.00106 0.00030 0.00118 181 2PY -0.00160 0.00034 -0.00027 0.00005 0.00040 182 2PZ 0.00319 0.00007 0.00002 0.00001 0.00017 183 3S 0.00017 -0.00158 0.00162 -0.00047 -0.00109 184 3PX -0.00155 0.00029 -0.00002 -0.00002 0.00009 185 3PY -0.00231 0.00132 -0.00122 0.00017 0.00052 186 3PZ 0.00212 0.00035 -0.00033 0.00011 0.00010 187 4XX -0.00009 -0.00002 0.00002 -0.00002 -0.00004 188 4YY 0.00001 -0.00001 0.00001 0.00001 -0.00000 189 4ZZ -0.00000 -0.00000 0.00000 0.00001 -0.00000 190 4XY -0.00003 -0.00006 0.00006 -0.00001 -0.00006 191 4XZ 0.00008 -0.00000 0.00002 -0.00001 -0.00001 192 4YZ -0.00001 -0.00002 0.00001 0.00000 -0.00001 193 18 C 1S -0.00018 -0.00003 0.00012 0.00000 -0.00008 194 2S 0.00030 0.00008 -0.00015 0.00002 0.00014 195 2PX -0.00013 -0.00010 0.00031 -0.00009 -0.00028 196 2PY -0.00173 -0.00000 -0.00010 -0.00001 0.00000 197 2PZ 0.00239 0.00028 -0.00022 0.00004 0.00024 198 3S 0.00132 0.00109 -0.00140 0.00036 0.00082 199 3PX 0.00042 -0.00046 0.00053 -0.00015 -0.00016 200 3PY -0.00024 0.00015 -0.00037 0.00012 0.00021 201 3PZ 0.00172 0.00040 -0.00042 0.00010 0.00033 202 4XX -0.00005 -0.00004 0.00004 -0.00001 -0.00005 203 4YY -0.00003 0.00002 -0.00002 0.00000 0.00003 204 4ZZ 0.00005 0.00001 0.00000 -0.00000 0.00001 205 4XY 0.00004 -0.00001 0.00002 -0.00000 -0.00002 206 4XZ -0.00008 0.00001 0.00000 0.00000 -0.00000 207 4YZ 0.00009 0.00002 -0.00003 0.00000 0.00003 208 19 C 1S 0.00006 0.00003 -0.00007 -0.00001 0.00006 209 2S -0.00003 -0.00007 0.00011 0.00001 -0.00011 210 2PX 0.00010 0.00012 -0.00018 0.00008 0.00021 211 2PY -0.00002 -0.00010 0.00002 -0.00000 -0.00005 212 2PZ 0.00024 0.00023 -0.00020 0.00005 0.00019 213 3S -0.00086 -0.00030 0.00048 -0.00013 -0.00042 214 3PX 0.00046 0.00016 -0.00025 0.00006 0.00024 215 3PY -0.00004 -0.00017 0.00019 -0.00009 -0.00005 216 3PZ 0.00012 0.00010 -0.00004 -0.00000 0.00011 217 4XX -0.00001 0.00001 -0.00001 0.00000 0.00001 218 4YY 0.00008 0.00000 -0.00000 0.00000 0.00000 219 4ZZ -0.00008 -0.00000 0.00000 -0.00000 -0.00000 220 4XY 0.00007 -0.00001 0.00001 -0.00000 -0.00001 221 4XZ -0.00010 -0.00001 0.00001 -0.00000 -0.00001 222 4YZ -0.00006 -0.00001 0.00001 -0.00000 -0.00000 223 20 C 1S 0.00008 0.00000 0.00004 0.00003 -0.00002 224 2S -0.00020 0.00002 -0.00005 -0.00003 0.00004 225 2PX 0.00018 -0.00006 0.00008 0.00002 -0.00009 226 2PY 0.00068 0.00011 -0.00011 -0.00002 0.00009 227 2PZ -0.00191 -0.00000 -0.00000 -0.00005 0.00002 228 3S 0.00050 0.00007 -0.00023 -0.00009 0.00017 229 3PX -0.00034 -0.00002 0.00010 -0.00000 -0.00010 230 3PY 0.00066 -0.00000 0.00004 -0.00012 0.00004 231 3PZ -0.00125 -0.00005 0.00007 -0.00010 0.00000 232 4XX 0.00002 -0.00001 0.00001 -0.00001 -0.00001 233 4YY 0.00003 0.00001 -0.00001 0.00001 0.00001 234 4ZZ -0.00004 -0.00001 0.00001 -0.00000 -0.00001 235 4XY -0.00002 -0.00000 0.00000 -0.00000 -0.00001 236 4XZ 0.00004 0.00000 -0.00000 0.00000 -0.00000 237 4YZ -0.00003 -0.00001 0.00000 0.00000 -0.00000 238 21 C 1S -0.00018 0.00005 -0.00009 -0.00003 0.00007 239 2S 0.00036 -0.00016 0.00016 0.00003 -0.00014 240 2PX -0.00102 0.00017 -0.00025 0.00000 0.00028 241 2PY 0.00078 0.00005 -0.00004 0.00014 0.00005 242 2PZ -0.00154 -0.00023 0.00019 -0.00002 -0.00015 243 3S -0.00017 -0.00034 0.00051 -0.00004 -0.00042 244 3PX -0.00070 0.00021 -0.00028 0.00026 0.00015 245 3PY 0.00088 0.00001 -0.00009 0.00002 0.00015 246 3PZ -0.00098 -0.00019 0.00011 -0.00004 -0.00006 247 4XX 0.00003 0.00002 -0.00002 -0.00001 0.00001 248 4YY -0.00004 -0.00001 0.00001 0.00000 0.00000 249 4ZZ -0.00000 0.00000 -0.00000 0.00000 0.00000 250 4XY 0.00008 -0.00001 0.00002 0.00000 -0.00001 251 4XZ -0.00007 -0.00001 0.00001 -0.00000 -0.00000 252 4YZ 0.00002 0.00000 -0.00000 0.00000 0.00000 253 22 H 1S 0.00001 -0.00006 0.00006 0.00006 -0.00002 254 2S -0.00003 0.00000 0.00003 0.00002 0.00001 255 23 H 1S 0.00004 -0.00003 0.00003 -0.00002 -0.00005 256 2S 0.00017 -0.00006 0.00006 0.00000 -0.00008 257 24 H 1S -0.00005 0.00007 -0.00006 0.00003 0.00008 258 2S -0.00010 0.00011 -0.00010 0.00001 0.00013 259 25 H 1S 0.00044 0.00008 -0.00008 0.00002 0.00012 260 2S 0.00049 0.00014 -0.00019 0.00004 0.00022 261 26 H 1S -0.00112 -0.00016 0.00017 -0.00028 -0.00043 262 2S -0.00360 0.00094 -0.00077 -0.00008 -0.00010 263 27 H 1S -0.00022 0.00043 -0.00037 -0.00029 0.00031 264 2S 0.00047 0.00086 -0.00070 -0.00051 0.00064 106 107 108 109 110 106 4XZ 0.00058 107 4YZ 0.00042 0.00097 108 8 C 1S 0.00280 0.00503 2.05297 109 2S -0.00553 -0.00988 -0.06414 0.33123 110 2PX 0.00529 -0.00695 0.00105 0.00163 0.34916 111 2PY -0.00684 -0.00337 0.00189 0.00220 0.04945 112 2PZ 0.00385 0.00661 0.00048 0.00084 0.00446 113 3S -0.00550 -0.00915 -0.17075 0.26282 -0.01461 114 3PX 0.00405 -0.00308 0.00161 -0.01306 0.19016 115 3PY -0.00327 0.00027 0.00306 -0.02249 -0.03668 116 3PZ 0.00167 0.00314 0.00088 -0.00653 -0.00301 117 4XX 0.00033 0.00018 -0.01381 -0.01088 0.00288 118 4YY -0.00016 0.00024 -0.01803 -0.00227 -0.01170 119 4ZZ 0.00020 0.00021 -0.01651 -0.00410 0.00483 120 4XY -0.00001 -0.00024 -0.00472 0.00961 -0.00180 121 4XZ 0.00005 0.00012 -0.00084 0.00156 -0.00156 122 4YZ 0.00006 0.00016 -0.00092 0.00152 -0.00653 123 9 C 1S -0.00005 0.00012 0.01689 -0.03414 -0.01431 124 2S 0.00024 -0.00001 -0.03402 0.05951 0.02717 125 2PX 0.00426 -0.00206 0.01308 -0.02882 0.15110 126 2PY -0.00275 0.00119 0.01724 -0.03875 -0.10086 127 2PZ 0.00009 0.00164 0.07663 -0.15710 -0.06024 128 3S 0.00004 -0.00074 0.00551 0.02323 0.04440 129 3PX 0.00227 -0.00194 0.00260 -0.00208 0.10750 130 3PY -0.00236 -0.00046 0.00410 -0.00169 -0.05393 131 3PZ -0.00028 0.00030 0.00892 -0.03668 -0.02036 132 4XX 0.00000 0.00012 0.00190 -0.00462 -0.00486 133 4YY 0.00007 0.00011 0.00227 -0.00575 -0.00231 134 4ZZ -0.00020 -0.00040 -0.00595 0.01060 0.00498 135 4XY 0.00002 0.00005 0.00019 -0.00085 -0.00273 136 4XZ -0.00022 0.00018 -0.00191 0.00357 -0.01089 137 4YZ 0.00021 0.00001 -0.00259 0.00479 0.00101 138 10 C 1S 0.00011 0.00013 -0.00311 0.00847 0.00482 139 2S -0.00032 -0.00047 0.00857 -0.01999 -0.01147 140 2PX 0.00007 -0.00128 -0.00630 0.01677 0.00507 141 2PY -0.00138 -0.00178 -0.01048 0.02782 0.01909 142 2PZ 0.00041 0.00073 -0.00884 0.02208 0.00779 143 3S -0.00007 0.00008 -0.00673 -0.00745 -0.03474 144 3PX -0.00052 -0.00085 -0.00290 0.00935 -0.00224 145 3PY -0.00088 -0.00178 -0.00529 0.01598 0.02870 146 3PZ 0.00016 0.00006 0.00687 -0.00202 0.00587 147 4XX -0.00019 0.00004 0.00015 -0.00003 -0.00742 148 4YY 0.00012 -0.00015 0.00031 -0.00049 0.00791 149 4ZZ 0.00016 0.00022 -0.00108 0.00266 0.00112 150 4XY -0.00014 -0.00001 0.00005 -0.00023 -0.00436 151 4XZ -0.00004 0.00003 -0.00100 0.00211 0.00174 152 4YZ 0.00003 -0.00005 -0.00157 0.00329 0.00188 153 11 H 1S 0.00034 0.00044 -0.00810 0.01874 0.00732 154 2S 0.00080 0.00124 -0.01230 0.02542 0.01085 155 12 H 1S -0.00018 -0.00007 0.01268 -0.02717 0.00259 156 2S -0.00080 -0.00113 0.01502 -0.02676 0.00900 157 13 H 1S -0.00078 -0.00054 -0.06125 0.11623 -0.13765 158 2S 0.00069 0.00201 -0.01332 0.02524 -0.11469 159 14 H 1S 0.00508 0.00631 0.01266 -0.02715 -0.00678 160 2S 0.00415 0.00538 0.01493 -0.02662 -0.00798 161 15 H 1S -0.00420 -0.00658 -0.00816 0.01873 0.01305 162 2S -0.00437 -0.00693 -0.01202 0.02473 0.01925 163 16 C 1S -0.00004 -0.00003 -0.00004 -0.00000 -0.00022 164 2S 0.00010 0.00009 0.00029 -0.00044 -0.00019 165 2PX -0.00005 -0.00012 -0.00013 0.00006 0.00119 166 2PY -0.00003 0.00019 0.00019 -0.00047 -0.00551 167 2PZ 0.00007 -0.00009 -0.00001 0.00000 0.00277 168 3S 0.00039 0.00003 -0.00207 0.00385 0.02244 169 3PX -0.00070 0.00016 -0.00201 0.00151 -0.02133 170 3PY 0.00037 0.00011 0.00183 -0.00196 0.00547 171 3PZ 0.00026 -0.00017 0.00094 -0.00077 0.00834 172 4XX 0.00001 0.00001 0.00002 -0.00003 0.00070 173 4YY -0.00001 -0.00001 -0.00003 0.00005 -0.00017 174 4ZZ -0.00000 0.00001 0.00001 -0.00004 -0.00035 175 4XY -0.00001 0.00001 -0.00000 -0.00005 -0.00016 176 4XZ -0.00001 -0.00001 -0.00002 0.00001 0.00028 177 4YZ -0.00001 0.00000 -0.00003 0.00005 -0.00026 178 17 C 1S 0.00008 0.00002 0.00000 0.00004 -0.00103 179 2S -0.00011 0.00003 -0.00002 -0.00017 0.00349 180 2PX 0.00015 -0.00005 -0.00028 0.00115 -0.00757 181 2PY -0.00001 0.00002 -0.00011 0.00027 -0.00350 182 2PZ 0.00009 -0.00019 -0.00015 0.00035 0.00360 183 3S -0.00023 -0.00004 0.00152 -0.00186 0.01069 184 3PX 0.00130 -0.00033 0.00355 -0.00426 0.02686 185 3PY -0.00001 0.00003 0.00134 -0.00157 -0.01381 186 3PZ 0.00005 0.00004 0.00058 -0.00074 -0.00484 187 4XX 0.00000 0.00001 0.00008 -0.00014 0.00017 188 4YY 0.00002 0.00001 0.00008 -0.00009 0.00028 189 4ZZ 0.00002 -0.00000 0.00003 -0.00004 0.00038 190 4XY -0.00001 0.00001 0.00001 -0.00004 0.00036 191 4XZ -0.00000 -0.00002 -0.00002 0.00005 0.00034 192 4YZ 0.00001 0.00000 0.00004 -0.00005 0.00022 193 18 C 1S -0.00000 -0.00000 0.00002 -0.00008 0.00100 194 2S 0.00006 0.00000 0.00016 -0.00012 -0.00045 195 2PX 0.00001 -0.00003 0.00003 -0.00046 0.00301 196 2PY -0.00000 0.00004 0.00007 -0.00015 -0.00103 197 2PZ 0.00003 -0.00005 -0.00007 0.00014 -0.00173 198 3S -0.00083 0.00028 -0.00257 0.00345 -0.03188 199 3PX 0.00006 -0.00011 -0.00053 0.00060 0.00797 200 3PY -0.00046 0.00015 -0.00185 0.00242 -0.01245 201 3PZ -0.00023 -0.00002 -0.00107 0.00151 -0.00750 202 4XX -0.00001 0.00000 0.00000 -0.00002 0.00022 203 4YY -0.00000 0.00000 -0.00003 0.00005 -0.00030 204 4ZZ 0.00001 -0.00001 0.00001 -0.00001 0.00018 205 4XY 0.00001 -0.00001 0.00002 -0.00004 0.00046 206 4XZ 0.00000 0.00001 0.00002 -0.00004 -0.00014 207 4YZ -0.00001 -0.00000 -0.00004 0.00007 -0.00031 208 19 C 1S -0.00000 -0.00001 -0.00002 0.00007 -0.00054 209 2S -0.00001 0.00001 -0.00007 -0.00003 0.00061 210 2PX -0.00001 0.00001 -0.00004 0.00042 -0.00186 211 2PY 0.00003 -0.00005 -0.00002 0.00010 0.00205 212 2PZ -0.00005 0.00010 0.00004 -0.00008 -0.00494 213 3S 0.00039 -0.00005 0.00211 -0.00281 0.01137 214 3PX -0.00017 0.00002 -0.00099 0.00141 -0.00510 215 3PY 0.00016 -0.00011 0.00049 -0.00051 0.00629 216 3PZ 0.00005 0.00006 0.00033 -0.00044 -0.00119 217 4XX 0.00001 -0.00000 0.00002 -0.00002 -0.00005 218 4YY 0.00000 -0.00000 -0.00000 0.00001 0.00003 219 4ZZ -0.00000 0.00000 -0.00001 0.00001 -0.00009 220 4XY 0.00000 -0.00000 0.00000 -0.00001 0.00018 221 4XZ -0.00000 0.00000 0.00001 -0.00002 0.00010 222 4YZ -0.00000 0.00000 0.00001 -0.00001 0.00004 223 20 C 1S 0.00001 0.00000 0.00002 -0.00000 0.00040 224 2S -0.00001 0.00000 0.00009 -0.00014 -0.00075 225 2PX 0.00002 -0.00001 0.00000 0.00008 0.00134 226 2PY 0.00002 -0.00005 -0.00004 0.00003 -0.00031 227 2PZ -0.00006 0.00008 0.00006 -0.00013 -0.00221 228 3S -0.00030 0.00003 -0.00166 0.00171 -0.00745 229 3PX 0.00015 -0.00001 0.00102 -0.00117 0.00339 230 3PY 0.00011 -0.00009 0.00027 -0.00039 0.00321 231 3PZ 0.00000 0.00003 0.00019 -0.00031 0.00003 232 4XX 0.00000 -0.00000 -0.00001 -0.00000 0.00012 233 4YY -0.00000 0.00001 0.00000 0.00000 -0.00027 234 4ZZ 0.00000 -0.00000 0.00001 -0.00001 0.00023 235 4XY -0.00000 -0.00000 0.00000 -0.00001 0.00004 236 4XZ -0.00000 0.00000 0.00000 -0.00001 -0.00011 237 4YZ -0.00000 -0.00000 -0.00001 0.00002 0.00012 238 21 C 1S -0.00001 -0.00001 -0.00002 0.00006 -0.00085 239 2S 0.00000 0.00003 -0.00010 0.00001 0.00144 240 2PX -0.00001 -0.00001 -0.00002 0.00015 -0.00229 241 2PY 0.00002 0.00007 0.00005 0.00005 -0.00127 242 2PZ 0.00002 -0.00007 -0.00001 0.00017 0.00427 243 3S 0.00037 -0.00008 0.00201 -0.00220 0.01265 244 3PX -0.00009 0.00010 -0.00021 0.00042 -0.00562 245 3PY -0.00018 0.00006 -0.00113 0.00109 -0.00524 246 3PZ -0.00007 -0.00004 -0.00065 0.00069 0.00116 247 4XX -0.00000 0.00000 0.00001 -0.00002 -0.00030 248 4YY 0.00000 -0.00000 0.00000 0.00001 0.00017 249 4ZZ -0.00000 0.00000 -0.00002 0.00002 -0.00006 250 4XY 0.00001 -0.00001 0.00001 -0.00000 0.00055 251 4XZ 0.00000 0.00001 0.00001 -0.00002 0.00004 252 4YZ 0.00000 -0.00000 0.00002 -0.00001 0.00008 253 22 H 1S 0.00002 0.00001 0.00005 0.00006 0.00107 254 2S 0.00010 -0.00003 0.00036 -0.00020 0.00270 255 23 H 1S -0.00000 -0.00001 -0.00003 0.00002 0.00043 256 2S -0.00004 -0.00001 -0.00029 0.00035 0.00021 257 24 H 1S -0.00000 0.00000 0.00002 0.00011 -0.00072 258 2S 0.00005 -0.00001 0.00025 -0.00017 -0.00018 259 25 H 1S -0.00000 -0.00001 -0.00008 0.00022 -0.00078 260 2S -0.00013 -0.00001 -0.00082 0.00123 -0.00334 261 26 H 1S -0.00005 0.00002 0.00012 -0.00079 0.00092 262 2S 0.00115 -0.00040 0.00280 -0.00407 0.01909 263 27 H 1S -0.00021 -0.00022 -0.00030 0.00047 -0.00563 264 2S -0.00050 -0.00025 -0.00029 0.00033 -0.01598 111 112 113 114 115 111 2PY 0.40063 112 2PZ 0.00008 0.42268 113 3S -0.01981 -0.00690 0.23318 114 3PX -0.03433 -0.00301 -0.01483 0.11495 115 3PY 0.15383 0.00152 -0.02232 -0.04356 0.07118 116 3PZ 0.00218 0.13054 -0.00700 -0.00399 0.00130 117 4XX -0.00697 -0.00279 -0.00692 0.00309 -0.00240 118 4YY -0.00668 -0.00853 0.00082 -0.00508 -0.00054 119 4ZZ 0.00746 0.00945 -0.00501 0.00151 0.00240 120 4XY -0.00978 -0.00588 0.00866 0.00023 -0.00409 121 4XZ -0.00630 0.00682 0.00188 0.00007 -0.00208 122 4YZ -0.00892 0.01088 0.00259 -0.00226 -0.00215 123 9 C 1S -0.01830 -0.07642 0.00630 -0.00059 -0.00012 124 2S 0.03395 0.15924 0.01961 0.00933 0.01315 125 2PX -0.09997 -0.06235 -0.01146 0.10498 -0.05352 126 2PY 0.05206 -0.07032 -0.00780 -0.05381 0.05216 127 2PZ -0.06572 -0.29433 -0.13393 -0.01369 -0.00792 128 3S 0.05881 0.12141 -0.01212 0.01507 0.01978 129 3PX -0.05395 -0.03090 0.00274 0.06996 -0.03638 130 3PY 0.05243 -0.03695 0.00843 -0.03569 0.03309 131 3PZ -0.01612 -0.07616 -0.02952 -0.00630 -0.00088 132 4XX -0.00243 -0.00640 -0.00265 -0.00252 0.00009 133 4YY -0.00694 -0.00877 -0.00436 0.00047 -0.00216 134 4ZZ 0.00669 0.00296 0.00792 0.00101 0.00061 135 4XY -0.00255 -0.00181 -0.00130 -0.00113 -0.00011 136 4XZ 0.00105 0.00442 0.00460 -0.00646 0.00215 137 4YZ -0.01070 0.00586 0.00670 0.00220 -0.00452 138 10 C 1S 0.00830 0.01134 -0.00666 -0.00318 -0.00475 139 2S -0.02056 -0.03231 -0.00745 0.00093 -0.00012 140 2PX 0.01479 0.01859 0.01045 -0.01355 0.00136 141 2PY 0.01944 0.03000 0.01514 0.00433 -0.01324 142 2PZ 0.01048 0.02701 0.05389 0.00037 -0.00381 143 3S -0.05674 0.00893 0.01150 -0.00807 -0.01228 144 3PX 0.02618 0.01712 0.00768 -0.01297 0.01134 145 3PY 0.02503 0.02842 0.01215 0.01221 -0.00121 146 3PZ -0.00095 -0.01933 0.01006 0.00389 -0.00291 147 4XX 0.00468 0.00037 -0.00019 -0.00514 0.00319 148 4YY -0.00419 -0.00024 -0.00132 0.00546 -0.00288 149 4ZZ 0.00170 0.00558 0.00279 -0.00011 -0.00021 150 4XY 0.00335 0.00090 -0.00062 -0.00299 0.00240 151 4XZ 0.00142 0.00481 0.00268 0.00117 0.00018 152 4YZ 0.00272 0.00766 0.00426 0.00046 0.00119 153 11 H 1S 0.00934 0.03308 0.03777 0.00030 -0.00222 154 2S 0.02180 0.05853 0.03402 -0.00091 0.00149 155 12 H 1S 0.00789 -0.04713 -0.05098 -0.00057 0.00003 156 2S 0.02028 -0.08803 -0.04213 0.00133 0.00325 157 13 H 1S -0.22268 -0.06492 0.11441 -0.04653 -0.07479 158 2S -0.18435 -0.05403 0.03738 -0.03521 -0.05548 159 14 H 1S -0.01321 0.04564 -0.05108 -0.00353 -0.00565 160 2S -0.02019 0.08815 -0.04168 -0.00332 -0.00722 161 15 H 1S 0.02240 -0.02412 0.03841 0.00650 0.01118 162 2S 0.04471 -0.04086 0.03282 0.00467 0.01665 163 16 C 1S 0.00016 0.00008 0.00076 0.00020 0.00035 164 2S -0.00109 -0.00001 -0.00186 -0.00071 -0.00088 165 2PX -0.00033 0.00010 0.00056 0.00202 -0.00063 166 2PY 0.00292 0.00013 -0.00213 -0.00429 0.00125 167 2PZ -0.00166 -0.00067 -0.00270 0.00159 -0.00283 168 3S -0.00317 -0.00163 -0.00025 0.01360 -0.00683 169 3PX 0.01174 0.00145 0.00110 -0.01404 0.00801 170 3PY -0.00467 0.00078 -0.00116 0.00363 -0.00228 171 3PZ -0.00592 0.00153 -0.00159 0.00570 -0.00450 172 4XX -0.00045 -0.00006 -0.00013 0.00066 -0.00032 173 4YY 0.00017 -0.00003 0.00010 -0.00020 0.00011 174 4ZZ 0.00011 0.00007 0.00009 -0.00021 0.00016 175 4XY -0.00004 0.00007 -0.00004 0.00003 -0.00001 176 4XZ -0.00016 -0.00002 0.00002 0.00024 -0.00016 177 4YZ 0.00025 0.00003 0.00015 -0.00022 0.00020 178 17 C 1S 0.00058 0.00004 -0.00065 -0.00123 0.00034 179 2S -0.00242 0.00016 0.00098 0.00360 -0.00153 180 2PX 0.00536 0.00014 -0.00061 -0.00850 0.00434 181 2PY 0.00227 0.00043 0.00265 -0.00289 0.00308 182 2PZ -0.00189 -0.00033 -0.00082 0.00181 -0.00185 183 3S -0.00808 -0.00072 0.00109 0.01000 -0.00506 184 3PX -0.02335 0.00122 -0.00391 0.01749 -0.01300 185 3PY 0.00493 0.00218 0.00090 -0.01017 0.00585 186 3PZ 0.00106 0.00095 -0.00123 -0.00403 0.00125 187 4XX -0.00027 0.00003 -0.00006 0.00028 -0.00018 188 4YY -0.00039 0.00010 -0.00013 0.00017 -0.00019 189 4ZZ -0.00035 0.00001 -0.00014 0.00024 -0.00024 190 4XY -0.00024 -0.00000 0.00010 0.00043 -0.00018 191 4XZ -0.00011 -0.00006 0.00010 0.00029 -0.00013 192 4YZ -0.00024 0.00000 -0.00007 0.00016 -0.00014 193 18 C 1S -0.00067 -0.00003 0.00019 0.00094 -0.00040 194 2S -0.00008 0.00005 -0.00068 -0.00079 0.00001 195 2PX -0.00207 -0.00006 0.00127 0.00338 -0.00131 196 2PY 0.00032 0.00010 0.00065 -0.00052 0.00065 197 2PZ 0.00132 -0.00010 -0.00065 -0.00175 0.00068 198 3S 0.02407 0.00062 0.00193 -0.02369 0.01500 199 3PX -0.00311 -0.00093 0.00074 0.00593 -0.00280 200 3PY 0.01160 -0.00027 0.00216 -0.00890 0.00677 201 3PZ 0.00721 -0.00041 0.00073 -0.00575 0.00397 202 4XX -0.00014 -0.00000 0.00003 0.00026 -0.00013 203 4YY 0.00023 0.00001 0.00006 -0.00027 0.00020 204 4ZZ -0.00014 -0.00001 -0.00004 0.00010 -0.00010 205 4XY -0.00032 -0.00001 -0.00006 0.00036 -0.00025 206 4XZ 0.00004 0.00003 0.00004 -0.00007 0.00008 207 4YZ 0.00028 -0.00001 0.00002 -0.00029 0.00017 208 19 C 1S 0.00037 0.00003 -0.00002 -0.00056 0.00025 209 2S -0.00032 -0.00004 0.00012 0.00081 -0.00032 210 2PX 0.00141 0.00005 -0.00095 -0.00231 0.00089 211 2PY -0.00119 -0.00018 -0.00049 0.00142 -0.00104 212 2PZ 0.00287 0.00034 0.00028 -0.00360 0.00243 213 3S -0.01121 0.00010 -0.00183 0.00888 -0.00631 214 3PX 0.00515 -0.00001 0.00044 -0.00430 0.00283 215 3PY -0.00437 -0.00045 -0.00077 0.00434 -0.00290 216 3PZ 0.00018 0.00011 -0.00006 -0.00093 0.00069 217 4XX -0.00003 0.00001 -0.00004 -0.00006 0.00000 218 4YY -0.00001 -0.00001 -0.00003 -0.00000 -0.00001 219 4ZZ 0.00005 0.00001 0.00003 -0.00007 0.00004 220 4XY -0.00011 -0.00001 -0.00004 0.00016 -0.00011 221 4XZ -0.00008 0.00000 0.00003 0.00012 -0.00005 222 4YZ -0.00004 0.00000 0.00003 0.00003 -0.00001 223 20 C 1S -0.00025 -0.00003 -0.00031 0.00033 -0.00026 224 2S 0.00025 0.00001 0.00048 -0.00061 0.00044 225 2PX -0.00069 -0.00009 -0.00125 0.00110 -0.00107 226 2PY 0.00025 -0.00003 0.00034 -0.00050 0.00025 227 2PZ 0.00118 0.00024 0.00134 -0.00155 0.00132 228 3S 0.00634 0.00078 0.00167 -0.00568 0.00343 229 3PX -0.00365 -0.00037 -0.00118 0.00271 -0.00195 230 3PY -0.00252 -0.00016 -0.00036 0.00203 -0.00160 231 3PZ -0.00047 0.00015 0.00067 0.00005 0.00011 232 4XX -0.00008 0.00001 0.00001 0.00013 -0.00007 233 4YY 0.00015 0.00001 -0.00002 -0.00020 0.00013 234 4ZZ -0.00016 -0.00002 -0.00005 0.00016 -0.00013 235 4XY -0.00003 -0.00001 -0.00001 0.00006 -0.00004 236 4XZ 0.00005 0.00000 -0.00002 -0.00006 0.00004 237 4YZ -0.00004 -0.00001 0.00001 0.00008 -0.00005 238 21 C 1S 0.00052 0.00006 0.00017 -0.00086 0.00047 239 2S -0.00081 -0.00009 -0.00035 0.00159 -0.00084 240 2PX 0.00140 0.00019 0.00195 -0.00260 0.00209 241 2PY 0.00068 0.00006 -0.00124 -0.00103 0.00051 242 2PZ -0.00234 -0.00038 -0.00041 0.00300 -0.00218 243 3S -0.00938 -0.00138 -0.00177 0.01016 -0.00565 244 3PX 0.00377 0.00023 0.00045 -0.00445 0.00284 245 3PY 0.00379 0.00077 -0.00009 -0.00389 0.00206 246 3PZ -0.00003 -0.00024 0.00020 0.00072 -0.00071 247 4XX 0.00015 -0.00001 -0.00008 -0.00027 0.00007 248 4YY -0.00009 -0.00001 0.00004 0.00012 -0.00004 249 4ZZ 0.00003 0.00002 0.00001 -0.00005 0.00004 250 4XY -0.00032 -0.00004 -0.00009 0.00041 -0.00025 251 4XZ -0.00005 0.00004 0.00004 0.00006 0.00001 252 4YZ -0.00005 0.00001 0.00001 0.00006 -0.00001 253 22 H 1S -0.00065 -0.00009 -0.00046 0.00082 -0.00040 254 2S -0.00177 -0.00016 -0.00002 0.00183 -0.00088 255 23 H 1S -0.00019 -0.00002 -0.00024 0.00046 -0.00039 256 2S 0.00053 0.00003 0.00003 0.00040 -0.00012 257 24 H 1S 0.00048 0.00002 -0.00025 -0.00090 0.00037 258 2S -0.00021 -0.00002 -0.00029 -0.00058 0.00014 259 25 H 1S 0.00067 0.00003 -0.00030 -0.00098 0.00037 260 2S 0.00414 -0.00030 0.00082 -0.00282 0.00227 261 26 H 1S -0.00111 -0.00002 0.00047 0.00242 -0.00084 262 2S -0.01869 0.00242 -0.00250 0.01314 -0.00986 263 27 H 1S 0.00392 0.00065 0.00405 -0.00436 0.00366 264 2S 0.00929 0.00119 0.00411 -0.01159 0.00781 116 117 118 119 120 116 3PZ 0.04670 117 4XX -0.00061 0.00074 118 4YY -0.00195 0.00030 0.00113 119 4ZZ 0.00239 -0.00001 -0.00058 0.00121 120 4XY -0.00176 -0.00001 0.00044 -0.00062 0.00082 121 4XZ 0.00161 -0.00005 0.00013 -0.00008 0.00006 122 4YZ 0.00239 0.00005 0.00011 -0.00012 0.00024 123 9 C 1S -0.00987 0.00195 0.00241 -0.00613 0.00029 124 2S 0.03216 -0.00459 -0.00573 0.01056 -0.00084 125 2PX -0.02869 0.00480 0.00136 -0.00407 0.00341 126 2PY -0.03594 0.00110 0.00712 -0.00524 0.00295 127 2PZ -0.08762 0.00632 0.00795 -0.00221 0.00077 128 3S 0.02044 -0.00354 -0.00668 0.01069 -0.00288 129 3PX -0.01173 0.00215 -0.00015 -0.00200 0.00150 130 3PY -0.01423 -0.00033 0.00261 -0.00235 0.00102 131 3PZ -0.02104 0.00155 0.00255 -0.00059 0.00056 132 4XX -0.00149 0.00025 0.00038 -0.00041 0.00001 133 4YY -0.00304 0.00033 0.00041 -0.00028 0.00018 134 4ZZ 0.00157 -0.00041 -0.00043 0.00018 -0.00002 135 4XY -0.00114 0.00003 0.00016 0.00006 0.00013 136 4XZ 0.00168 -0.00023 0.00033 -0.00025 0.00008 137 4YZ 0.00194 0.00012 0.00013 -0.00044 0.00042 138 10 C 1S 0.00462 -0.00027 -0.00079 0.00044 -0.00072 139 2S -0.01573 0.00101 0.00214 -0.00096 0.00164 140 2PX 0.01713 -0.00048 -0.00209 -0.00039 -0.00216 141 2PY 0.02161 -0.00171 -0.00397 0.00083 -0.00281 142 2PZ 0.03756 -0.00052 -0.00140 -0.00063 -0.00130 143 3S -0.00206 0.00076 0.00163 -0.00126 0.00121 144 3PX 0.00975 -0.00071 -0.00084 0.00011 -0.00144 145 3PY 0.01149 -0.00090 -0.00277 0.00128 -0.00131 146 3PZ 0.00407 0.00050 0.00064 -0.00108 0.00038 147 4XX 0.00005 -0.00010 0.00005 0.00007 -0.00008 148 4YY -0.00089 0.00008 -0.00010 0.00018 0.00004 149 4ZZ 0.00345 -0.00013 -0.00026 0.00001 -0.00015 150 4XY -0.00027 -0.00008 0.00004 0.00017 0.00000 151 4XZ 0.00164 -0.00015 -0.00004 0.00004 -0.00003 152 4YZ 0.00253 -0.00009 -0.00019 0.00006 0.00003 153 11 H 1S 0.02887 -0.00065 -0.00145 -0.00033 -0.00098 154 2S 0.03448 -0.00130 -0.00252 0.00072 -0.00164 155 12 H 1S -0.01359 -0.00051 -0.00196 0.00598 -0.00214 156 2S -0.02415 0.00016 -0.00075 0.00260 -0.00156 157 13 H 1S -0.02180 -0.00021 0.00899 -0.00910 0.01081 158 2S -0.01633 0.00214 0.00863 -0.00758 0.00766 159 14 H 1S 0.01209 -0.00121 -0.00456 0.00927 -0.00372 160 2S 0.02302 -0.00090 -0.00477 0.00765 -0.00397 161 15 H 1S -0.02582 -0.00080 -0.00200 0.00035 -0.00128 162 2S -0.02987 -0.00122 -0.00253 0.00071 -0.00152 163 16 C 1S 0.00009 -0.00002 0.00002 -0.00002 -0.00000 164 2S -0.00009 0.00006 -0.00002 0.00002 0.00003 165 2PX -0.00008 -0.00006 -0.00000 -0.00008 -0.00003 166 2PY -0.00119 -0.00008 0.00009 -0.00004 -0.00012 167 2PZ -0.00109 0.00002 -0.00012 -0.00001 -0.00003 168 3S -0.00161 -0.00013 -0.00052 0.00026 -0.00003 169 3PX 0.00052 -0.00049 0.00059 -0.00004 -0.00019 170 3PY 0.00021 0.00020 -0.00034 0.00007 -0.00010 171 3PZ 0.00010 0.00019 -0.00037 0.00005 -0.00000 172 4XX -0.00005 -0.00001 -0.00001 0.00000 -0.00001 173 4YY 0.00002 0.00001 0.00001 -0.00001 0.00001 174 4ZZ 0.00007 0.00000 0.00001 -0.00000 0.00000 175 4XY 0.00010 -0.00002 0.00002 -0.00000 -0.00001 176 4XZ -0.00007 -0.00000 0.00000 -0.00000 -0.00000 177 4YZ 0.00006 0.00000 0.00001 -0.00000 0.00001 178 17 C 1S -0.00081 0.00008 -0.00011 0.00002 0.00007 179 2S 0.00141 -0.00012 0.00021 -0.00003 -0.00010 180 2PX -0.00072 0.00031 -0.00034 0.00019 0.00033 181 2PY 0.00084 0.00011 -0.00000 0.00005 0.00016 182 2PZ 0.00020 0.00009 -0.00017 0.00001 0.00008 183 3S 0.00097 -0.00021 0.00048 -0.00023 -0.00027 184 3PX -0.00008 0.00116 -0.00103 0.00009 0.00058 185 3PY 0.00120 0.00020 -0.00022 0.00010 0.00000 186 3PZ 0.00102 0.00004 -0.00003 -0.00003 -0.00007 187 4XX 0.00003 -0.00001 0.00001 -0.00001 -0.00002 188 4YY 0.00003 0.00001 -0.00001 0.00000 0.00000 189 4ZZ -0.00005 0.00001 -0.00001 0.00000 0.00001 190 4XY 0.00008 -0.00002 0.00002 -0.00001 -0.00001 191 4XZ -0.00003 -0.00000 -0.00001 -0.00000 -0.00000 192 4YZ 0.00003 0.00001 -0.00000 0.00000 0.00000 193 18 C 1S 0.00006 0.00000 0.00002 -0.00002 0.00000 194 2S -0.00014 0.00005 -0.00007 0.00003 0.00003 195 2PX 0.00031 -0.00006 0.00003 -0.00008 -0.00006 196 2PY 0.00014 0.00001 0.00001 0.00002 0.00001 197 2PZ 0.00011 0.00001 -0.00013 0.00004 -0.00001 198 3S 0.00024 -0.00065 0.00041 0.00011 -0.00030 199 3PX -0.00044 -0.00000 0.00001 -0.00005 0.00008 200 3PY 0.00006 -0.00041 0.00030 0.00003 -0.00015 201 3PZ -0.00018 -0.00019 0.00000 0.00007 -0.00007 202 4XX 0.00003 -0.00001 0.00001 -0.00001 -0.00001 203 4YY 0.00001 0.00000 0.00000 0.00000 0.00001 204 4ZZ -0.00002 0.00001 -0.00001 0.00000 0.00001 205 4XY -0.00002 0.00000 -0.00001 -0.00000 -0.00000 206 4XZ 0.00001 -0.00000 0.00000 -0.00000 -0.00000 207 4YZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 208 19 C 1S -0.00001 0.00001 -0.00001 0.00001 0.00001 209 2S 0.00004 -0.00004 0.00002 -0.00001 -0.00003 210 2PX -0.00029 0.00008 -0.00001 0.00004 0.00007 211 2PY -0.00011 0.00003 -0.00004 0.00001 0.00003 212 2PZ 0.00012 -0.00004 0.00004 0.00002 -0.00003 213 3S 0.00018 0.00033 -0.00017 -0.00006 0.00007 214 3PX -0.00017 -0.00011 0.00008 0.00003 0.00001 215 3PY -0.00033 0.00016 -0.00011 -0.00002 0.00010 216 3PZ 0.00009 0.00004 0.00001 -0.00000 0.00002 217 4XX -0.00001 0.00001 -0.00001 0.00000 0.00000 218 4YY 0.00002 0.00000 -0.00000 0.00000 0.00000 219 4ZZ -0.00002 -0.00000 0.00001 -0.00000 -0.00000 220 4XY -0.00001 -0.00000 -0.00000 -0.00000 -0.00000 221 4XZ -0.00001 -0.00000 0.00001 -0.00000 -0.00000 222 4YZ -0.00001 0.00000 0.00000 -0.00000 0.00000 223 20 C 1S -0.00011 0.00001 -0.00000 -0.00000 0.00000 224 2S 0.00019 -0.00000 0.00000 0.00000 0.00000 225 2PX -0.00058 0.00000 0.00001 -0.00001 -0.00002 226 2PY 0.00047 0.00001 -0.00005 0.00001 0.00001 227 2PZ -0.00021 -0.00001 0.00009 -0.00001 -0.00001 228 3S 0.00041 -0.00022 0.00026 -0.00004 -0.00001 229 3PX -0.00026 0.00013 -0.00010 -0.00000 0.00001 230 3PY 0.00017 0.00012 -0.00005 -0.00004 0.00010 231 3PZ -0.00018 0.00004 0.00007 -0.00003 0.00004 232 4XX -0.00001 -0.00000 -0.00000 -0.00000 -0.00000 233 4YY 0.00002 -0.00000 0.00000 0.00000 -0.00000 234 4ZZ -0.00003 0.00000 -0.00000 -0.00000 0.00000 235 4XY -0.00003 -0.00000 0.00000 -0.00000 -0.00000 236 4XZ 0.00002 -0.00000 0.00000 -0.00000 -0.00000 237 4YZ -0.00001 0.00000 -0.00000 0.00000 0.00000 238 21 C 1S 0.00001 0.00001 0.00000 -0.00000 0.00002 239 2S -0.00001 -0.00007 -0.00000 0.00001 -0.00006 240 2PX 0.00081 0.00008 -0.00002 0.00006 0.00010 241 2PY 0.00023 0.00000 0.00002 0.00003 -0.00000 242 2PZ -0.00102 0.00007 -0.00002 -0.00000 0.00004 243 3S -0.00038 0.00023 -0.00026 -0.00001 0.00001 244 3PX 0.00016 -0.00011 -0.00005 0.00013 -0.00011 245 3PY 0.00037 -0.00015 0.00017 0.00001 -0.00002 246 3PZ -0.00071 -0.00003 0.00007 -0.00001 0.00003 247 4XX -0.00004 0.00000 0.00000 -0.00000 -0.00000 248 4YY -0.00000 0.00001 -0.00000 0.00000 0.00000 249 4ZZ 0.00002 -0.00000 0.00000 0.00000 0.00000 250 4XY -0.00002 0.00001 -0.00001 0.00000 0.00000 251 4XZ 0.00001 0.00000 0.00000 0.00000 -0.00000 252 4YZ 0.00004 0.00000 -0.00000 0.00000 0.00000 253 22 H 1S 0.00000 0.00002 -0.00001 0.00002 0.00002 254 2S 0.00013 0.00011 -0.00006 -0.00000 0.00008 255 23 H 1S -0.00019 -0.00002 0.00001 -0.00001 -0.00002 256 2S -0.00016 -0.00007 0.00002 -0.00001 -0.00004 257 24 H 1S -0.00007 0.00004 -0.00001 0.00002 0.00003 258 2S -0.00007 0.00009 -0.00005 0.00002 0.00006 259 25 H 1S -0.00014 0.00002 -0.00001 0.00001 0.00003 260 2S -0.00017 -0.00009 0.00005 0.00002 0.00003 261 26 H 1S 0.00076 -0.00012 0.00012 -0.00011 -0.00014 262 2S 0.00098 0.00102 -0.00110 0.00009 0.00040 263 27 H 1S 0.00091 0.00004 0.00007 -0.00008 0.00009 264 2S 0.00095 -0.00001 0.00036 -0.00017 0.00011 121 122 123 124 125 121 4XZ 0.00081 122 4YZ 0.00026 0.00108 123 9 C 1S -0.00177 -0.00233 2.05285 124 2S 0.00366 0.00495 -0.06363 0.32995 125 2PX 0.01089 -0.00135 0.00113 -0.00019 0.35044 126 2PY -0.00119 0.01032 0.00195 0.00009 0.04324 127 2PZ -0.00582 -0.00828 -0.00130 -0.00279 0.00015 128 3S 0.00185 0.00236 -0.17048 0.26209 -0.00734 129 3PX 0.00631 -0.00301 0.00130 -0.00936 0.19346 130 3PY -0.00301 0.00340 0.00250 -0.01732 -0.03843 131 3PZ -0.00168 -0.00237 -0.00135 0.01664 -0.00735 132 4XX 0.00017 -0.00021 -0.01313 -0.01204 0.00516 133 4YY -0.00026 0.00018 -0.01659 -0.00474 -0.00046 134 4ZZ -0.00022 -0.00041 -0.01870 -0.00034 -0.00719 135 4XY 0.00025 0.00007 -0.00360 0.00766 0.00508 136 4XZ 0.00027 0.00041 0.00113 -0.00187 -0.00134 137 4YZ 0.00039 0.00070 0.00239 -0.00415 0.00813 138 10 C 1S -0.00090 -0.00159 0.01694 -0.03426 -0.04031 139 2S 0.00179 0.00336 -0.03460 0.06052 0.08350 140 2PX 0.00589 -0.00883 0.03958 -0.08176 0.07767 141 2PY -0.00891 -0.00349 0.06562 -0.13524 -0.22907 142 2PZ -0.00200 -0.00296 0.02014 -0.03879 -0.04364 143 3S 0.00298 0.00463 0.00938 0.01608 0.06274 144 3PX 0.00510 -0.00479 0.00600 -0.01861 0.07876 145 3PY -0.00478 -0.00010 0.01039 -0.03068 -0.10438 146 3PZ -0.00130 -0.00122 -0.00165 -0.01209 -0.00299 147 4XX -0.00031 0.00008 -0.00030 -0.00026 -0.00985 148 4YY 0.00027 -0.00013 -0.00403 0.00667 0.00782 149 4ZZ -0.00009 -0.00016 0.00255 -0.00620 -0.00462 150 4XY -0.00008 0.00022 -0.00404 0.00753 -0.00282 151 4XZ 0.00006 0.00025 -0.00128 0.00268 0.00019 152 4YZ 0.00027 0.00032 -0.00224 0.00469 0.00544 153 11 H 1S -0.00072 -0.00126 0.01233 -0.02683 -0.01845 154 2S -0.00044 -0.00120 0.01480 -0.02704 -0.03427 155 12 H 1S -0.00370 -0.00646 -0.06141 0.11661 -0.09065 156 2S -0.00437 -0.00722 -0.01383 0.02630 -0.07410 157 13 H 1S 0.00367 0.00631 0.01291 -0.02731 0.01695 158 2S 0.00302 0.00544 0.01554 -0.02756 0.03390 159 14 H 1S 0.00031 -0.00040 -0.00821 0.01928 -0.00439 160 2S 0.00175 0.00211 -0.01260 0.02691 -0.00470 161 15 H 1S 0.00005 -0.00000 -0.00118 0.00261 0.00279 162 2S -0.00077 -0.00099 0.00194 -0.00308 -0.00520 163 16 C 1S 0.00001 -0.00001 -0.00004 0.00010 -0.00014 164 2S -0.00001 0.00003 0.00018 -0.00038 0.00025 165 2PX -0.00003 -0.00000 -0.00003 -0.00003 -0.00107 166 2PY 0.00029 -0.00016 -0.00001 -0.00023 0.00244 167 2PZ -0.00020 0.00009 0.00018 -0.00114 -0.00359 168 3S -0.00017 -0.00018 -0.00077 0.00020 0.00419 169 3PX 0.00004 0.00000 -0.00104 0.00031 -0.01157 170 3PY 0.00037 -0.00010 0.00121 -0.00098 0.00921 171 3PZ -0.00025 0.00011 0.00136 -0.00228 -0.00222 172 4XX -0.00000 -0.00001 0.00006 -0.00015 -0.00009 173 4YY -0.00001 0.00000 -0.00008 0.00012 0.00006 174 4ZZ 0.00000 0.00001 -0.00003 0.00008 -0.00002 175 4XY 0.00002 -0.00001 -0.00000 -0.00002 0.00007 176 4XZ 0.00001 -0.00001 0.00002 -0.00008 0.00019 177 4YZ -0.00000 0.00001 -0.00009 0.00017 0.00006 178 17 C 1S -0.00015 0.00009 0.00004 -0.00012 -0.00190 179 2S 0.00030 -0.00015 -0.00015 0.00030 0.00413 180 2PX -0.00072 0.00043 -0.00020 0.00099 -0.00866 181 2PY -0.00014 0.00012 -0.00036 0.00119 -0.00079 182 2PZ -0.00026 0.00015 0.00006 -0.00029 -0.00277 183 3S 0.00116 -0.00060 0.00087 -0.00063 0.01941 184 3PX -0.00051 0.00037 0.00219 -0.00216 0.00973 185 3PY -0.00034 0.00035 0.00101 -0.00061 -0.00867 186 3PZ 0.00030 -0.00010 0.00059 -0.00077 0.00361 187 4XX 0.00002 -0.00001 0.00005 -0.00008 0.00009 188 4YY 0.00001 0.00000 0.00006 -0.00002 0.00028 189 4ZZ -0.00001 0.00000 0.00003 -0.00005 0.00003 190 4XY 0.00004 -0.00002 0.00002 -0.00003 0.00053 191 4XZ -0.00002 0.00001 -0.00000 0.00000 -0.00033 192 4YZ -0.00000 0.00000 0.00004 -0.00005 0.00008 193 18 C 1S 0.00003 -0.00002 0.00001 -0.00004 0.00071 194 2S -0.00007 0.00004 0.00011 -0.00011 -0.00058 195 2PX 0.00015 -0.00009 0.00003 -0.00040 0.00193 196 2PY 0.00003 -0.00005 0.00008 -0.00023 0.00055 197 2PZ -0.00021 0.00018 -0.00005 0.00018 -0.00407 198 3S -0.00020 0.00012 -0.00150 0.00179 -0.01757 199 3PX 0.00004 -0.00009 -0.00056 0.00052 0.00365 200 3PY 0.00003 -0.00009 -0.00118 0.00130 -0.00571 201 3PZ -0.00039 0.00025 -0.00072 0.00097 -0.01026 202 4XX 0.00003 -0.00002 0.00001 -0.00004 0.00035 203 4YY -0.00001 0.00001 -0.00003 0.00006 -0.00014 204 4ZZ -0.00001 0.00001 0.00001 -0.00002 -0.00011 205 4XY 0.00000 -0.00000 0.00002 -0.00006 0.00011 206 4XZ 0.00001 -0.00000 -0.00001 0.00002 0.00018 207 4YZ -0.00002 0.00001 -0.00003 0.00005 -0.00040 208 19 C 1S -0.00003 0.00002 -0.00002 0.00008 -0.00045 209 2S 0.00007 -0.00004 -0.00003 -0.00014 0.00065 210 2PX -0.00014 0.00009 -0.00006 0.00045 -0.00153 211 2PY -0.00006 -0.00000 0.00011 -0.00035 -0.00029 212 2PZ 0.00003 0.00005 -0.00017 0.00067 -0.00090 213 3S 0.00020 -0.00007 0.00138 -0.00157 0.00842 214 3PX -0.00013 0.00006 -0.00073 0.00098 -0.00378 215 3PY -0.00007 0.00001 0.00031 -0.00043 0.00218 216 3PZ 0.00007 0.00001 0.00000 0.00040 0.00160 217 4XX -0.00001 0.00001 0.00002 -0.00002 -0.00010 218 4YY -0.00001 0.00001 -0.00001 0.00002 -0.00009 219 4ZZ 0.00001 -0.00001 -0.00001 0.00001 0.00012 220 4XY 0.00000 -0.00000 0.00001 -0.00002 0.00004 221 4XZ 0.00001 -0.00001 0.00001 -0.00001 0.00017 222 4YZ 0.00001 -0.00000 0.00000 0.00001 0.00016 223 20 C 1S -0.00001 0.00001 0.00004 -0.00008 -0.00015 224 2S 0.00003 -0.00001 -0.00002 0.00009 0.00052 225 2PX -0.00003 -0.00001 0.00011 -0.00023 -0.00046 226 2PY -0.00009 0.00008 -0.00007 0.00008 -0.00163 227 2PZ 0.00020 -0.00014 -0.00006 0.00022 0.00317 228 3S 0.00003 0.00000 -0.00133 0.00145 -0.00302 229 3PX 0.00001 -0.00000 0.00075 -0.00080 0.00187 230 3PY -0.00008 0.00008 -0.00003 0.00018 0.00097 231 3PZ 0.00015 -0.00009 -0.00007 0.00029 0.00351 232 4XX 0.00000 -0.00000 0.00000 -0.00002 -0.00001 233 4YY -0.00000 0.00000 -0.00001 0.00004 -0.00009 234 4ZZ -0.00000 -0.00000 0.00002 -0.00005 0.00006 235 4XY 0.00000 -0.00000 0.00001 -0.00003 0.00001 236 4XZ 0.00000 0.00000 -0.00000 0.00001 -0.00003 237 4YZ -0.00000 -0.00000 0.00000 -0.00002 0.00000 238 21 C 1S -0.00001 0.00001 -0.00008 0.00020 -0.00003 239 2S 0.00003 -0.00004 0.00013 -0.00049 -0.00028 240 2PX -0.00006 0.00007 -0.00021 0.00073 0.00018 241 2PY -0.00003 0.00007 -0.00001 0.00031 -0.00098 242 2PZ -0.00004 -0.00009 0.00029 -0.00082 0.00102 243 3S 0.00003 -0.00005 0.00141 -0.00137 0.00567 244 3PX -0.00002 -0.00001 0.00020 -0.00047 -0.00313 245 3PY -0.00003 0.00003 -0.00079 0.00072 -0.00359 246 3PZ -0.00002 -0.00007 -0.00029 -0.00014 -0.00019 247 4XX 0.00001 -0.00000 -0.00001 0.00001 0.00006 248 4YY -0.00000 0.00000 0.00001 -0.00000 0.00004 249 4ZZ -0.00000 0.00000 -0.00000 0.00000 -0.00009 250 4XY -0.00002 0.00001 0.00003 -0.00005 -0.00012 251 4XZ 0.00001 -0.00001 0.00002 0.00000 0.00021 252 4YZ -0.00001 0.00001 0.00001 0.00001 -0.00003 253 22 H 1S -0.00005 0.00002 0.00012 -0.00007 -0.00041 254 2S -0.00008 0.00007 0.00026 0.00000 0.00073 255 23 H 1S 0.00001 -0.00001 0.00001 -0.00010 -0.00013 256 2S 0.00000 -0.00002 -0.00010 -0.00005 -0.00086 257 24 H 1S -0.00005 0.00004 -0.00001 0.00015 -0.00047 258 2S -0.00008 0.00006 0.00012 0.00004 -0.00032 259 25 H 1S -0.00007 0.00004 -0.00008 0.00024 -0.00085 260 2S -0.00019 0.00009 -0.00060 0.00092 -0.00401 261 26 H 1S 0.00012 -0.00009 0.00009 -0.00076 -0.00047 262 2S -0.00067 0.00046 0.00192 -0.00267 0.00166 263 27 H 1S -0.00000 0.00008 -0.00089 0.00213 0.00058 264 2S 0.00011 0.00022 -0.00184 0.00422 -0.00037 126 127 128 129 130 126 2PY 0.39692 127 2PZ -0.00611 0.42722 128 3S -0.01334 0.01226 0.23546 129 3PX -0.03885 -0.00517 -0.00787 0.11945 130 3PY 0.15220 -0.00316 -0.01449 -0.04415 0.07220 131 3PZ -0.00893 0.12661 0.01611 -0.00398 -0.00187 132 4XX 0.00024 0.00250 -0.00872 0.00291 -0.00020 133 4YY 0.00787 0.00972 -0.00316 -0.00166 0.00289 134 4ZZ -0.01234 -0.00658 0.00091 -0.00150 -0.00292 135 4XY 0.00226 0.00656 0.00561 0.00194 -0.00051 136 4XZ 0.00813 -0.00758 -0.00311 -0.00191 0.00339 137 4YZ 0.00842 -0.01238 -0.00574 0.00342 0.00206 138 10 C 1S -0.06719 -0.01803 0.00445 -0.00529 -0.00929 139 2S 0.14040 0.04278 0.02565 0.01983 0.03571 140 2PX -0.22705 -0.04643 -0.06333 0.07874 -0.09588 141 2PY -0.16160 -0.06591 -0.10320 -0.09841 -0.02382 142 2PZ -0.06498 -0.00328 -0.04808 -0.00735 -0.00868 143 3S 0.10032 -0.01532 -0.01773 0.01277 0.01910 144 3PX -0.10358 -0.02901 -0.01159 0.06087 -0.04952 145 3PY -0.03265 -0.04195 -0.01741 -0.05024 0.00695 146 3PZ 0.00255 0.02875 -0.01306 0.00121 0.00706 147 4XX 0.00151 0.00100 0.00109 -0.00598 0.00256 148 4YY -0.00486 0.00377 0.00711 0.00551 -0.00338 149 4ZZ -0.00732 -0.00799 -0.00756 -0.00149 -0.00233 150 4XY 0.00640 0.00298 0.00649 -0.00295 0.00290 151 4XZ 0.00522 -0.00554 0.00131 -0.00025 0.00185 152 4YZ 0.00612 -0.00896 0.00281 0.00214 0.00183 153 11 H 1S -0.02984 -0.03029 -0.04358 -0.00328 -0.00561 154 2S -0.05592 -0.06071 -0.03872 -0.00854 -0.01491 155 12 H 1S -0.16159 0.19533 0.11102 -0.03148 -0.05567 156 2S -0.13176 0.16250 0.03589 -0.02318 -0.04033 157 13 H 1S 0.02648 0.03542 -0.05724 0.00241 0.00333 158 2S 0.05300 0.06232 -0.04887 0.00682 0.01025 159 14 H 1S -0.00633 -0.03475 0.03426 -0.00881 -0.01442 160 2S -0.00804 -0.06567 0.03198 -0.00876 -0.01597 161 15 H 1S 0.00330 -0.00212 0.01364 0.00085 0.00105 162 2S 0.00050 0.00019 0.01238 -0.00246 0.00367 163 16 C 1S 0.00039 0.00006 -0.00071 -0.00027 -0.00006 164 2S -0.00087 0.00022 0.00155 0.00059 0.00033 165 2PX 0.00113 0.00011 -0.00117 -0.00118 0.00040 166 2PY -0.00163 0.00002 0.00464 0.00344 -0.00068 167 2PZ 0.00144 0.00004 0.00391 -0.00265 0.00372 168 3S -0.00456 -0.00471 0.00110 0.00483 -0.00299 169 3PX 0.00618 -0.00056 0.00163 -0.00728 0.00489 170 3PY -0.00702 -0.00033 -0.00142 0.00649 -0.00523 171 3PZ -0.00357 -0.00148 -0.00021 -0.00122 0.00010 172 4XX -0.00026 -0.00004 -0.00052 -0.00006 -0.00036 173 4YY 0.00025 0.00007 0.00022 0.00004 0.00018 174 4ZZ 0.00021 0.00002 0.00002 -0.00007 0.00013 175 4XY -0.00012 -0.00001 -0.00014 0.00009 -0.00014 176 4XZ -0.00028 -0.00001 0.00004 0.00027 -0.00016 177 4YZ 0.00037 -0.00002 0.00016 -0.00002 0.00022 178 17 C 1S 0.00081 0.00001 0.00134 -0.00177 0.00132 179 2S -0.00190 -0.00007 -0.00238 0.00371 -0.00279 180 2PX 0.00569 -0.00003 0.00093 -0.00953 0.00599 181 2PY 0.00231 0.00007 -0.00144 -0.00145 0.00111 182 2PZ 0.00091 0.00015 -0.00020 -0.00271 0.00142 183 3S -0.01038 0.00063 -0.00357 0.01525 -0.00962 184 3PX -0.01089 0.00127 -0.00227 0.00465 -0.00525 185 3PY 0.00361 0.00072 -0.00084 -0.00713 0.00376 186 3PZ -0.00362 0.00023 -0.00050 0.00156 -0.00133 187 4XX -0.00016 0.00005 -0.00007 0.00019 -0.00018 188 4YY -0.00032 -0.00001 -0.00004 0.00021 -0.00023 189 4ZZ -0.00015 0.00002 0.00013 -0.00001 0.00005 190 4XY -0.00028 0.00000 -0.00017 0.00050 -0.00031 191 4XZ 0.00027 0.00001 -0.00003 -0.00019 0.00010 192 4YZ -0.00012 0.00003 -0.00005 0.00004 -0.00003 193 18 C 1S -0.00037 0.00003 -0.00000 0.00074 -0.00036 194 2S -0.00011 0.00005 -0.00005 -0.00087 0.00029 195 2PX -0.00122 0.00009 -0.00052 0.00255 -0.00144 196 2PY -0.00083 -0.00008 -0.00028 0.00028 0.00013 197 2PZ 0.00260 0.00011 -0.00050 -0.00336 0.00103 198 3S 0.01303 -0.00124 0.00275 -0.01296 0.00945 199 3PX -0.00084 -0.00037 0.00004 0.00298 -0.00140 200 3PY 0.00584 -0.00114 0.00122 -0.00394 0.00383 201 3PZ 0.00782 -0.00032 0.00064 -0.00735 0.00446 202 4XX -0.00025 -0.00002 -0.00003 0.00037 -0.00024 203 4YY 0.00018 -0.00000 -0.00001 -0.00018 0.00014 204 4ZZ 0.00002 0.00002 0.00002 -0.00009 0.00004 205 4XY -0.00018 0.00000 0.00003 0.00013 -0.00008 206 4XZ -0.00006 0.00000 -0.00003 0.00016 -0.00012 207 4YZ 0.00030 -0.00001 0.00001 -0.00034 0.00022 208 19 C 1S 0.00035 -0.00000 0.00004 -0.00048 0.00029 209 2S -0.00056 -0.00008 -0.00005 0.00087 -0.00051 210 2PX 0.00130 -0.00001 0.00070 -0.00195 0.00126 211 2PY -0.00055 -0.00002 0.00002 -0.00055 0.00052 212 2PZ 0.00160 0.00006 -0.00065 -0.00072 -0.00043 213 3S -0.00721 0.00140 -0.00157 0.00623 -0.00484 214 3PX 0.00373 -0.00067 0.00140 -0.00299 0.00264 215 3PY -0.00191 0.00039 -0.00020 0.00116 -0.00070 216 3PZ -0.00009 0.00025 -0.00081 0.00084 -0.00119 217 4XX -0.00000 0.00001 -0.00000 -0.00010 0.00004 218 4YY 0.00009 0.00001 -0.00000 -0.00010 0.00006 219 4ZZ -0.00007 -0.00001 0.00004 0.00011 -0.00004 220 4XY -0.00004 0.00000 -0.00002 0.00005 -0.00007 221 4XZ -0.00012 -0.00000 -0.00000 0.00015 -0.00007 222 4YZ -0.00008 0.00001 0.00001 0.00013 -0.00006 223 20 C 1S -0.00009 -0.00000 -0.00003 -0.00014 -0.00006 224 2S -0.00003 0.00014 0.00003 0.00040 0.00000 225 2PX -0.00020 -0.00006 0.00040 -0.00034 -0.00010 226 2PY 0.00134 0.00006 0.00000 -0.00139 0.00112 227 2PZ -0.00168 -0.00004 0.00059 0.00304 -0.00138 228 3S 0.00464 -0.00121 0.00393 -0.00117 0.00356 229 3PX -0.00236 0.00096 -0.00161 0.00087 -0.00176 230 3PY 0.00054 0.00038 0.00064 0.00034 0.00053 231 3PZ -0.00148 0.00016 0.00082 0.00300 -0.00118 232 4XX -0.00002 -0.00001 -0.00001 0.00002 -0.00002 233 4YY 0.00011 0.00000 -0.00005 -0.00009 -0.00000 234 4ZZ -0.00013 0.00001 0.00004 0.00005 -0.00001 235 4XY -0.00005 0.00001 0.00004 0.00004 -0.00001 236 4XZ 0.00006 0.00001 -0.00004 -0.00004 0.00000 237 4YZ -0.00004 -0.00002 0.00003 0.00001 0.00003 238 21 C 1S 0.00042 0.00005 0.00041 -0.00008 0.00034 239 2S -0.00097 -0.00024 -0.00120 0.00002 -0.00089 240 2PX 0.00086 0.00006 -0.00032 -0.00027 0.00060 241 2PY 0.00077 -0.00002 -0.00108 -0.00140 -0.00038 242 2PZ -0.00230 -0.00014 0.00128 0.00127 -0.00008 243 3S -0.00517 0.00179 -0.00503 0.00300 -0.00493 244 3PX -0.00055 -0.00046 -0.00110 -0.00219 0.00012 245 3PY 0.00238 -0.00099 0.00151 -0.00209 0.00164 246 3PZ -0.00041 -0.00040 0.00205 0.00063 0.00083 247 4XX 0.00005 0.00004 0.00031 0.00008 0.00013 248 4YY -0.00007 0.00000 -0.00012 -0.00001 -0.00006 249 4ZZ 0.00003 -0.00002 -0.00006 -0.00009 0.00001 250 4XY -0.00002 -0.00000 -0.00016 -0.00015 -0.00001 251 4XZ -0.00021 -0.00002 -0.00013 0.00019 -0.00022 252 4YZ 0.00004 0.00000 -0.00012 -0.00007 -0.00001 253 22 H 1S -0.00020 -0.00004 -0.00108 -0.00069 -0.00040 254 2S 0.00004 0.00021 -0.00143 -0.00023 -0.00040 255 23 H 1S -0.00003 -0.00003 0.00022 0.00004 -0.00003 256 2S 0.00031 -0.00037 0.00011 -0.00033 0.00011 257 24 H 1S 0.00045 0.00002 0.00038 -0.00058 0.00049 258 2S 0.00025 0.00023 0.00003 -0.00069 0.00041 259 25 H 1S 0.00083 0.00001 0.00031 -0.00094 0.00066 260 2S 0.00420 -0.00038 0.00062 -0.00318 0.00257 261 26 H 1S -0.00007 0.00031 -0.00138 0.00128 -0.00125 262 2S -0.00732 0.00067 -0.00174 0.00050 -0.00281 263 27 H 1S 0.00452 0.00076 0.00269 -0.00019 0.00340 264 2S 0.01095 0.00127 0.00671 -0.00161 0.00736 131 132 133 134 135 131 3PZ 0.04174 132 4XX -0.00002 0.00090 133 4YY 0.00206 0.00018 0.00098 134 4ZZ -0.00121 -0.00009 -0.00036 0.00113 135 4XY 0.00200 0.00000 0.00010 -0.00033 0.00056 136 4XZ -0.00204 0.00022 -0.00016 -0.00010 -0.00002 137 4YZ -0.00375 0.00009 0.00005 -0.00020 -0.00019 138 10 C 1S -0.00615 -0.00024 -0.00402 0.00257 -0.00409 139 2S 0.00430 -0.00035 0.00704 -0.00661 0.00783 140 2PX -0.01767 0.00954 -0.00884 0.00534 0.00195 141 2PY -0.02797 -0.00214 0.00345 0.00887 -0.00766 142 2PZ 0.01742 -0.00036 -0.00470 0.00806 -0.00471 143 3S -0.01392 0.00099 0.00533 -0.00547 0.00531 144 3PX -0.00838 0.00570 -0.00619 0.00207 0.00237 145 3PY -0.01344 -0.00294 0.00199 0.00365 -0.00359 146 3PZ 0.01419 -0.00011 0.00003 0.00157 -0.00080 147 4XX 0.00084 0.00002 -0.00020 0.00010 -0.00019 148 4YY 0.00163 -0.00024 -0.00003 -0.00006 0.00010 149 4ZZ -0.00241 0.00010 -0.00025 0.00057 -0.00030 150 4XY 0.00123 -0.00017 0.00010 -0.00020 0.00033 151 4XZ -0.00120 -0.00032 0.00001 0.00006 -0.00017 152 4YZ -0.00189 -0.00007 -0.00043 0.00006 0.00000 153 11 H 1S -0.00309 0.00016 -0.00135 0.00453 -0.00118 154 2S -0.01209 -0.00012 -0.00349 0.00550 -0.00277 155 12 H 1S 0.06699 -0.00422 0.00019 0.00365 0.00389 156 2S 0.05073 -0.00129 0.00109 0.00324 0.00177 157 13 H 1S 0.01253 0.00218 0.00385 -0.00245 0.00243 158 2S 0.01890 0.00267 0.00467 -0.00519 0.00267 159 14 H 1S -0.02157 -0.00010 -0.00042 -0.00199 -0.00014 160 2S -0.02875 -0.00049 -0.00117 -0.00160 -0.00038 161 15 H 1S -0.00023 0.00004 0.00016 0.00041 0.00007 162 2S -0.00287 0.00013 0.00035 0.00079 0.00031 163 16 C 1S 0.00024 -0.00003 -0.00002 -0.00001 -0.00003 164 2S -0.00037 0.00007 0.00003 -0.00002 0.00009 165 2PX -0.00060 -0.00019 0.00004 -0.00001 -0.00016 166 2PY -0.00209 0.00033 -0.00032 -0.00004 0.00019 167 2PZ -0.00222 -0.00036 0.00045 -0.00005 -0.00008 168 3S -0.00316 -0.00094 0.00090 0.00032 -0.00023 169 3PX -0.00004 0.00032 -0.00032 -0.00006 0.00009 170 3PY -0.00028 0.00027 -0.00040 0.00004 0.00004 171 3PZ -0.00190 -0.00035 0.00037 0.00008 -0.00019 172 4XX -0.00021 -0.00005 0.00005 0.00000 -0.00003 173 4YY 0.00015 0.00001 -0.00002 -0.00000 0.00001 174 4ZZ 0.00010 0.00001 -0.00001 -0.00001 0.00000 175 4XY 0.00003 -0.00001 0.00000 -0.00001 -0.00001 176 4XZ -0.00012 -0.00001 0.00001 0.00000 -0.00001 177 4YZ 0.00013 0.00001 -0.00002 -0.00000 0.00001 178 17 C 1S -0.00078 0.00009 -0.00007 0.00003 0.00008 179 2S 0.00123 -0.00026 0.00021 -0.00003 -0.00020 180 2PX 0.00075 0.00058 -0.00048 0.00013 0.00043 181 2PY 0.00221 0.00030 -0.00029 0.00003 0.00018 182 2PZ 0.00081 -0.00021 0.00017 0.00001 -0.00010 183 3S 0.00163 -0.00027 0.00030 -0.00013 -0.00021 184 3PX 0.00007 -0.00012 0.00025 0.00003 -0.00006 185 3PY 0.00154 0.00069 -0.00078 0.00002 0.00019 186 3PZ 0.00066 0.00050 -0.00058 -0.00000 0.00021 187 4XX -0.00005 -0.00002 0.00002 -0.00001 -0.00002 188 4YY 0.00003 0.00001 -0.00001 0.00000 -0.00000 189 4ZZ -0.00008 -0.00001 0.00002 0.00000 -0.00000 190 4XY 0.00001 -0.00003 0.00002 -0.00000 -0.00002 191 4XZ 0.00003 -0.00004 0.00003 0.00000 -0.00003 192 4YZ 0.00001 -0.00001 0.00001 -0.00000 -0.00000 193 18 C 1S 0.00000 -0.00004 0.00005 -0.00001 -0.00003 194 2S -0.00007 0.00008 -0.00005 0.00001 0.00006 195 2PX 0.00046 -0.00022 0.00014 -0.00006 -0.00015 196 2PY -0.00003 0.00009 -0.00003 -0.00000 0.00010 197 2PZ 0.00092 -0.00002 -0.00009 -0.00001 -0.00007 198 3S -0.00001 0.00075 -0.00089 0.00008 0.00039 199 3PX -0.00011 -0.00035 0.00038 -0.00003 -0.00009 200 3PY -0.00028 0.00019 -0.00024 0.00004 0.00017 201 3PZ 0.00054 -0.00009 -0.00004 0.00002 -0.00009 202 4XX -0.00004 -0.00002 0.00001 -0.00000 -0.00001 203 4YY 0.00005 0.00002 -0.00002 0.00000 0.00001 204 4ZZ 0.00000 -0.00001 0.00001 -0.00000 -0.00000 205 4XY -0.00006 -0.00002 0.00002 -0.00000 -0.00001 206 4XZ 0.00002 0.00001 -0.00001 -0.00000 0.00001 207 4YZ 0.00004 0.00001 -0.00001 0.00000 0.00000 208 19 C 1S 0.00007 0.00003 -0.00003 0.00001 0.00002 209 2S -0.00014 -0.00007 0.00005 -0.00001 -0.00004 210 2PX -0.00045 0.00016 -0.00010 0.00005 0.00010 211 2PY -0.00058 -0.00010 0.00015 0.00002 -0.00001 212 2PZ 0.00077 0.00022 -0.00029 -0.00001 0.00006 213 3S 0.00011 -0.00015 0.00021 -0.00006 -0.00014 214 3PX -0.00025 0.00010 -0.00011 0.00003 0.00009 215 3PY -0.00033 -0.00015 0.00024 -0.00001 -0.00002 216 3PZ 0.00064 0.00016 -0.00018 -0.00003 0.00006 217 4XX -0.00000 0.00001 -0.00000 0.00000 0.00000 218 4YY 0.00003 -0.00000 0.00000 -0.00000 -0.00000 219 4ZZ -0.00002 0.00001 -0.00001 0.00000 0.00001 220 4XY -0.00002 -0.00001 0.00001 -0.00000 -0.00001 221 4XZ -0.00004 -0.00000 0.00001 -0.00000 -0.00000 222 4YZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 223 20 C 1S -0.00032 -0.00002 0.00003 0.00001 -0.00001 224 2S 0.00062 0.00005 -0.00006 -0.00002 0.00004 225 2PX -0.00149 -0.00008 0.00010 0.00002 -0.00006 226 2PY 0.00101 -0.00003 -0.00000 -0.00002 -0.00002 227 2PZ 0.00024 0.00023 -0.00020 0.00000 0.00014 228 3S 0.00051 0.00006 -0.00017 -0.00002 0.00004 229 3PX -0.00037 -0.00001 0.00007 -0.00000 -0.00002 230 3PY 0.00060 -0.00009 0.00010 -0.00005 -0.00003 231 3PZ 0.00015 0.00014 -0.00011 -0.00002 0.00009 232 4XX -0.00003 -0.00001 0.00001 -0.00000 -0.00001 233 4YY 0.00004 0.00001 -0.00001 -0.00000 0.00000 234 4ZZ -0.00007 -0.00001 0.00001 0.00000 -0.00000 235 4XY -0.00006 -0.00001 0.00001 -0.00000 -0.00000 236 4XZ 0.00002 0.00000 -0.00001 -0.00000 -0.00000 237 4YZ -0.00003 -0.00001 0.00001 0.00000 -0.00000 238 21 C 1S 0.00018 0.00006 -0.00006 -0.00000 0.00003 239 2S -0.00053 -0.00014 0.00014 0.00001 -0.00008 240 2PX 0.00249 0.00023 -0.00021 0.00001 0.00015 241 2PY -0.00006 0.00007 -0.00007 0.00002 -0.00001 242 2PZ -0.00180 -0.00016 0.00030 0.00005 -0.00000 243 3S -0.00058 -0.00031 0.00037 -0.00001 -0.00019 244 3PX 0.00029 0.00023 -0.00021 0.00007 0.00012 245 3PY -0.00003 0.00004 -0.00006 -0.00000 0.00001 246 3PZ -0.00108 -0.00012 0.00021 0.00002 0.00001 247 4XX -0.00003 0.00002 -0.00002 -0.00000 0.00001 248 4YY 0.00002 -0.00000 0.00001 0.00000 -0.00000 249 4ZZ 0.00002 0.00000 -0.00000 0.00000 -0.00000 250 4XY -0.00007 -0.00003 0.00003 0.00000 -0.00002 251 4XZ -0.00001 0.00001 -0.00001 0.00000 0.00000 252 4YZ 0.00005 -0.00000 0.00000 0.00000 -0.00000 253 22 H 1S -0.00023 -0.00004 0.00008 0.00003 -0.00003 254 2S 0.00030 -0.00003 0.00004 0.00002 -0.00003 255 23 H 1S -0.00047 -0.00005 0.00004 -0.00000 -0.00003 256 2S -0.00059 -0.00009 0.00007 0.00001 -0.00006 257 24 H 1S -0.00006 0.00007 -0.00004 0.00001 0.00004 258 2S 0.00017 0.00009 -0.00005 0.00001 0.00006 259 25 H 1S -0.00011 0.00006 -0.00004 0.00002 0.00004 260 2S 0.00007 -0.00000 -0.00003 0.00003 0.00002 261 26 H 1S -0.00029 -0.00028 0.00022 -0.00011 -0.00022 262 2S -0.00062 -0.00011 0.00003 -0.00002 -0.00021 263 27 H 1S 0.00302 0.00026 -0.00051 -0.00004 0.00007 264 2S 0.00367 0.00062 -0.00094 -0.00021 0.00023 136 137 138 139 140 136 4XZ 0.00077 137 4YZ 0.00054 0.00139 138 10 C 1S -0.00145 -0.00254 2.05302 139 2S 0.00262 0.00476 -0.06377 0.33034 140 2PX 0.00036 -0.00399 0.00108 -0.00649 0.35021 141 2PY -0.00395 -0.00399 0.00029 -0.00451 0.04019 142 2PZ 0.00553 0.00896 -0.00278 -0.00055 0.00669 143 3S 0.00406 0.00691 -0.17338 0.26406 0.02098 144 3PX 0.00140 -0.00184 -0.00208 0.00496 0.20171 145 3PY -0.00168 -0.00053 -0.00406 0.01099 -0.03212 146 3PZ 0.00143 0.00298 -0.00264 0.02692 -0.01448 147 4XX 0.00011 -0.00039 -0.01274 -0.01260 -0.00287 148 4YY -0.00047 -0.00022 -0.01537 -0.00670 -0.00269 149 4ZZ 0.00027 0.00042 -0.02038 0.00234 0.00704 150 4XY 0.00009 -0.00021 -0.00293 0.00660 -0.00293 151 4XZ 0.00024 0.00050 -0.00099 0.00184 -0.00833 152 4YZ 0.00047 0.00072 -0.00105 0.00186 -0.00142 153 11 H 1S 0.00439 0.00707 -0.06107 0.11541 0.04390 154 2S 0.00348 0.00511 -0.01210 0.02176 0.04111 155 12 H 1S -0.00773 -0.01343 0.01323 -0.02835 0.02260 156 2S -0.00666 -0.01132 0.01599 -0.02881 0.04067 157 13 H 1S 0.00405 0.00690 -0.00828 0.01937 -0.01713 158 2S 0.00287 0.00514 -0.01253 0.02673 -0.03035 159 14 H 1S 0.00076 0.00137 -0.00092 0.00140 0.00019 160 2S 0.00132 0.00230 0.00142 -0.00221 0.00141 161 15 H 1S -0.00059 -0.00101 -0.00751 0.01685 0.01088 162 2S -0.00132 -0.00262 -0.01224 0.02402 0.02267 163 16 C 1S 0.00002 0.00003 0.00008 -0.00013 -0.00036 164 2S -0.00003 -0.00006 0.00032 -0.00057 0.00087 165 2PX -0.00004 0.00014 -0.00015 0.00080 -0.00219 166 2PY 0.00018 -0.00024 0.00045 -0.00009 0.00677 167 2PZ -0.00017 0.00012 -0.00016 -0.00031 -0.00759 168 3S -0.00085 0.00021 -0.00543 0.00967 -0.01616 169 3PX 0.00075 -0.00055 0.00104 -0.00380 0.00436 170 3PY -0.00014 0.00015 0.00434 -0.00468 0.00679 171 3PZ -0.00038 0.00026 0.00096 -0.00038 -0.00541 172 4XX -0.00004 0.00001 -0.00003 0.00017 -0.00099 173 4YY 0.00001 0.00000 -0.00005 -0.00003 0.00017 174 4ZZ 0.00002 0.00000 0.00011 -0.00019 0.00011 175 4XY 0.00000 -0.00000 0.00005 -0.00022 -0.00012 176 4XZ -0.00001 0.00000 -0.00005 0.00017 -0.00015 177 4YZ 0.00002 0.00000 -0.00002 -0.00004 0.00006 178 17 C 1S 0.00002 -0.00005 -0.00008 0.00066 0.00234 179 2S -0.00011 0.00014 0.00034 -0.00165 -0.00662 180 2PX 0.00034 -0.00025 -0.00080 0.00275 0.01451 181 2PY 0.00021 -0.00007 -0.00004 0.00043 0.00558 182 2PZ -0.00015 0.00014 -0.00047 -0.00086 -0.00346 183 3S -0.00032 0.00024 0.00069 -0.00076 -0.00408 184 3PX -0.00116 0.00071 0.00187 0.00005 0.00214 185 3PY 0.00057 -0.00015 0.00508 -0.00695 0.01195 186 3PZ 0.00029 -0.00003 0.00260 -0.00454 0.01342 187 4XX -0.00001 0.00001 0.00007 -0.00013 -0.00061 188 4YY -0.00001 0.00001 0.00019 -0.00019 0.00013 189 4ZZ -0.00002 0.00001 0.00006 -0.00001 -0.00016 190 4XY -0.00001 0.00002 0.00007 -0.00008 -0.00062 191 4XZ -0.00001 0.00002 0.00010 -0.00016 -0.00108 192 4YZ -0.00001 0.00001 0.00007 -0.00007 -0.00017 193 18 C 1S -0.00004 0.00003 0.00003 -0.00013 -0.00124 194 2S 0.00001 -0.00003 -0.00014 0.00046 0.00252 195 2PX -0.00014 0.00013 0.00020 -0.00121 -0.00537 196 2PY 0.00004 -0.00006 -0.00018 0.00087 0.00273 197 2PZ 0.00004 -0.00000 0.00029 -0.00182 -0.00099 198 3S 0.00136 -0.00076 0.00063 -0.00232 0.01298 199 3PX -0.00033 0.00013 -0.00276 0.00401 -0.00625 200 3PY 0.00057 -0.00034 -0.00111 0.00119 0.00313 201 3PZ 0.00028 -0.00014 -0.00031 -0.00105 -0.00487 202 4XX -0.00001 0.00001 0.00005 -0.00012 -0.00041 203 4YY 0.00002 -0.00001 -0.00005 0.00011 0.00044 204 4ZZ -0.00001 0.00000 -0.00004 0.00002 -0.00014 205 4XY -0.00002 0.00001 -0.00003 0.00002 -0.00038 206 4XZ 0.00001 -0.00000 0.00002 -0.00001 0.00023 207 4YZ 0.00001 -0.00001 -0.00003 0.00001 0.00008 208 19 C 1S 0.00003 -0.00001 -0.00002 0.00009 0.00070 209 2S -0.00003 0.00001 0.00002 -0.00029 -0.00150 210 2PX 0.00009 -0.00008 -0.00011 0.00099 0.00342 211 2PY -0.00009 0.00004 -0.00028 0.00068 -0.00111 212 2PZ 0.00021 -0.00012 0.00047 -0.00106 0.00364 213 3S -0.00050 0.00032 0.00163 -0.00184 -0.00245 214 3PX 0.00023 -0.00015 -0.00089 0.00122 0.00168 215 3PY -0.00028 0.00012 -0.00096 0.00203 -0.00168 216 3PZ 0.00006 -0.00004 0.00001 0.00003 0.00338 217 4XX 0.00000 -0.00000 0.00002 0.00000 0.00018 218 4YY -0.00000 0.00000 0.00000 -0.00005 -0.00011 219 4ZZ 0.00000 -0.00000 -0.00000 0.00005 0.00020 220 4XY -0.00001 0.00001 0.00001 -0.00005 -0.00026 221 4XZ -0.00000 0.00000 -0.00001 0.00006 -0.00004 222 4YZ -0.00000 -0.00000 -0.00001 0.00005 0.00011 223 20 C 1S -0.00003 0.00000 -0.00004 0.00023 -0.00031 224 2S 0.00004 -0.00001 0.00011 -0.00043 0.00104 225 2PX -0.00008 0.00002 -0.00015 0.00091 -0.00126 226 2PY 0.00002 0.00004 0.00011 -0.00101 -0.00118 227 2PZ 0.00012 -0.00011 0.00003 0.00071 0.00483 228 3S 0.00036 -0.00013 0.00003 -0.00175 -0.00083 229 3PX -0.00017 0.00008 0.00032 0.00034 0.00062 230 3PY -0.00013 0.00013 -0.00028 -0.00005 -0.00218 231 3PZ 0.00002 -0.00003 -0.00016 0.00079 0.00301 232 4XX -0.00001 0.00000 -0.00001 0.00001 -0.00020 233 4YY 0.00001 -0.00001 0.00003 -0.00008 0.00016 234 4ZZ -0.00001 0.00000 -0.00003 0.00009 -0.00008 235 4XY -0.00000 0.00000 -0.00001 0.00003 -0.00008 236 4XZ 0.00000 -0.00000 0.00003 -0.00007 0.00002 237 4YZ -0.00000 0.00000 -0.00002 0.00004 -0.00009 238 21 C 1S 0.00005 -0.00001 0.00008 -0.00022 0.00102 239 2S -0.00010 0.00001 -0.00027 0.00050 -0.00222 240 2PX 0.00016 -0.00006 0.00019 -0.00107 0.00373 241 2PY 0.00004 -0.00006 0.00022 -0.00062 0.00110 242 2PZ -0.00020 0.00003 -0.00074 0.00252 -0.00226 243 3S -0.00056 0.00031 -0.00049 0.00241 -0.00448 244 3PX 0.00021 -0.00023 0.00067 -0.00098 0.00527 245 3PY 0.00018 -0.00017 -0.00041 -0.00082 0.00000 246 3PZ -0.00008 -0.00005 -0.00072 0.00143 -0.00238 247 4XX 0.00001 -0.00001 -0.00001 -0.00002 0.00035 248 4YY -0.00001 0.00000 -0.00002 0.00006 -0.00000 249 4ZZ 0.00000 -0.00000 -0.00001 -0.00001 0.00002 250 4XY -0.00003 0.00001 -0.00002 0.00007 -0.00054 251 4XZ -0.00000 -0.00001 -0.00000 0.00009 0.00029 252 4YZ -0.00000 0.00000 0.00001 -0.00001 -0.00003 253 22 H 1S -0.00006 -0.00000 -0.00012 0.00044 -0.00062 254 2S -0.00008 0.00010 0.00002 0.00052 -0.00061 255 23 H 1S -0.00003 0.00002 -0.00004 0.00021 -0.00082 256 2S -0.00002 0.00000 -0.00015 0.00029 -0.00188 257 24 H 1S 0.00004 -0.00003 -0.00004 0.00034 0.00137 258 2S 0.00001 -0.00001 -0.00008 0.00052 0.00204 259 25 H 1S 0.00004 -0.00002 -0.00014 0.00043 0.00116 260 2S 0.00016 -0.00008 -0.00080 0.00105 -0.00114 261 26 H 1S -0.00012 0.00009 0.00019 -0.00191 -0.00810 262 2S -0.00091 0.00068 0.00448 -0.00570 -0.00109 263 27 H 1S 0.00042 0.00013 0.00106 -0.00266 0.00483 264 2S 0.00089 -0.00000 0.00350 -0.00732 0.00907 141 142 143 144 145 141 2PY 0.39966 142 2PZ 0.00485 0.42474 143 3S 0.02685 0.01509 0.25364 144 3PX -0.03775 0.00809 0.01519 0.12994 145 3PY 0.16324 0.01490 0.01755 -0.03994 0.08227 146 3PZ -0.00604 0.13683 0.01463 -0.00598 0.00479 147 4XX -0.00170 -0.00212 -0.00993 -0.00158 -0.00061 148 4YY -0.00620 -0.00620 -0.00679 -0.00066 -0.00211 149 4ZZ 0.01024 0.01567 0.00580 0.00233 0.00313 150 4XY -0.00298 -0.00359 0.00356 -0.00088 -0.00027 151 4XZ -0.00141 0.00835 0.00205 -0.00407 0.00129 152 4YZ -0.01104 0.01194 0.00238 0.00152 -0.00293 153 11 H 1S 0.05991 0.25839 0.11521 0.02246 0.03139 154 2S 0.04746 0.20938 0.03860 0.01931 0.02031 155 12 H 1S 0.03890 -0.00819 -0.05597 0.00426 0.00785 156 2S 0.07059 -0.02043 -0.04708 0.00924 0.01696 157 13 H 1S -0.02914 -0.01077 0.03942 -0.01538 -0.02640 158 2S -0.05163 -0.02415 0.03492 -0.01860 -0.03243 159 14 H 1S -0.00096 -0.00462 0.02158 0.00017 -0.00049 160 2S -0.00120 -0.00398 0.02222 0.00010 -0.00191 161 15 H 1S 0.01811 -0.02643 0.03770 0.01144 0.01885 162 2S 0.03639 -0.05402 0.03687 0.01577 0.02432 163 16 C 1S -0.00004 0.00064 0.00076 -0.00080 -0.00067 164 2S -0.00068 -0.00134 -0.00179 0.00186 0.00115 165 2PX 0.00164 0.00204 0.00039 -0.00354 -0.00160 166 2PY -0.00435 -0.00093 -0.00950 0.00414 -0.00184 167 2PZ 0.00386 -0.00047 -0.00780 -0.00022 0.00163 168 3S 0.01891 -0.00422 0.00475 -0.01086 0.01219 169 3PX -0.00259 -0.00402 -0.00440 0.00409 -0.00253 170 3PY -0.00803 0.00469 -0.00168 0.00313 -0.00372 171 3PZ 0.00788 0.00155 -0.00182 -0.00281 0.00344 172 4XX 0.00096 -0.00011 0.00030 -0.00102 0.00027 173 4YY -0.00030 0.00001 0.00010 0.00026 -0.00008 174 4ZZ -0.00044 0.00007 -0.00025 0.00012 -0.00025 175 4XY 0.00005 -0.00001 0.00027 -0.00011 -0.00003 176 4XZ 0.00043 -0.00003 -0.00013 -0.00030 0.00018 177 4YZ -0.00049 0.00005 -0.00013 0.00019 -0.00018 178 17 C 1S -0.00088 -0.00048 -0.00294 0.00131 -0.00054 179 2S 0.00252 0.00122 0.00449 -0.00397 0.00123 180 2PX -0.00766 -0.00199 -0.00306 0.01111 -0.00511 181 2PY -0.00467 -0.00010 0.00398 0.00193 -0.00093 182 2PZ 0.00303 -0.00017 0.00692 0.00049 0.00276 183 3S 0.00256 -0.00045 0.00770 -0.00205 0.00054 184 3PX 0.00311 0.00138 0.00071 -0.00135 0.00176 185 3PY -0.01224 0.00607 -0.00347 0.00685 -0.00571 186 3PZ -0.01068 0.00365 0.00125 0.01138 -0.00624 187 4XX 0.00039 0.00005 0.00004 -0.00052 0.00015 188 4YY -0.00007 0.00005 -0.00001 0.00001 0.00006 189 4ZZ 0.00016 -0.00005 -0.00047 -0.00002 0.00006 190 4XY 0.00027 0.00021 0.00023 -0.00050 0.00013 191 4XZ 0.00043 0.00028 0.00029 -0.00070 0.00038 192 4YZ 0.00008 0.00002 -0.00005 -0.00003 0.00004 193 18 C 1S 0.00068 0.00013 0.00035 -0.00111 0.00067 194 2S -0.00077 -0.00063 -0.00042 0.00196 -0.00091 195 2PX 0.00279 0.00080 0.00492 -0.00460 0.00355 196 2PY -0.00089 -0.00063 -0.00256 0.00182 -0.00138 197 2PZ -0.00042 0.00057 0.00626 0.00095 0.00107 198 3S -0.01314 0.00160 -0.00577 0.01133 -0.00764 199 3PX 0.00665 -0.00340 0.00463 -0.00482 0.00413 200 3PY -0.00389 -0.00048 -0.00277 0.00306 -0.00270 201 3PZ 0.00071 0.00040 0.00339 -0.00200 0.00185 202 4XX 0.00019 0.00012 0.00005 -0.00029 0.00012 203 4YY -0.00028 -0.00005 -0.00005 0.00025 -0.00018 204 4ZZ 0.00019 -0.00006 0.00015 -0.00007 0.00015 205 4XY 0.00039 -0.00007 0.00010 -0.00026 0.00024 206 4XZ -0.00020 -0.00001 0.00007 0.00001 -0.00006 207 4YZ -0.00010 0.00001 0.00011 0.00012 -0.00004 208 19 C 1S -0.00043 -0.00003 -0.00019 0.00055 -0.00036 209 2S 0.00089 0.00003 0.00073 -0.00108 0.00076 210 2PX -0.00195 -0.00038 -0.00434 0.00246 -0.00236 211 2PY 0.00171 -0.00043 -0.00198 0.00014 -0.00030 212 2PZ -0.00386 0.00042 0.00327 0.00162 -0.00121 213 3S 0.00182 0.00180 0.00062 -0.00255 0.00121 214 3PX -0.00136 -0.00117 -0.00197 0.00176 -0.00098 215 3PY 0.00333 -0.00137 -0.00005 -0.00103 0.00106 216 3PZ -0.00272 -0.00018 0.00300 0.00151 -0.00098 217 4XX -0.00006 -0.00002 -0.00009 0.00012 -0.00005 218 4YY -0.00000 0.00003 0.00013 0.00001 0.00002 219 4ZZ -0.00009 -0.00003 -0.00019 0.00008 -0.00007 220 4XY 0.00015 0.00004 0.00016 -0.00019 0.00011 221 4XZ 0.00006 -0.00001 -0.00021 -0.00011 -0.00002 222 4YZ -0.00005 -0.00002 -0.00007 0.00002 -0.00003 223 20 C 1S 0.00048 -0.00005 -0.00070 -0.00049 -0.00006 224 2S -0.00116 0.00009 0.00123 0.00120 -0.00007 225 2PX 0.00166 -0.00002 -0.00395 -0.00188 -0.00058 226 2PY -0.00024 0.00035 0.00282 0.00058 0.00106 227 2PZ -0.00254 -0.00045 -0.00159 0.00151 -0.00071 228 3S -0.00263 -0.00091 -0.00316 0.00187 0.00057 229 3PX 0.00039 0.00112 -0.00002 -0.00085 -0.00092 230 3PY 0.00039 -0.00023 0.00117 -0.00022 0.00111 231 3PZ -0.00168 -0.00056 -0.00177 0.00082 -0.00045 232 4XX 0.00018 0.00000 0.00003 -0.00020 0.00008 233 4YY -0.00022 0.00002 0.00015 0.00010 -0.00008 234 4ZZ 0.00020 -0.00005 -0.00028 -0.00005 0.00003 235 4XY 0.00010 0.00002 -0.00013 -0.00009 0.00002 236 4XZ -0.00012 0.00005 0.00010 0.00003 -0.00007 237 4YZ 0.00012 -0.00003 -0.00012 -0.00003 0.00004 238 21 C 1S -0.00110 0.00004 -0.00065 0.00087 -0.00053 239 2S 0.00281 -0.00039 0.00177 -0.00214 0.00107 240 2PX -0.00357 -0.00032 0.00417 0.00402 0.00032 241 2PY -0.00145 -0.00004 0.00101 0.00078 -0.00120 242 2PZ 0.00461 -0.00128 -0.00639 -0.00202 0.00122 243 3S 0.00453 0.00281 0.00520 -0.00620 0.00037 244 3PX -0.00155 -0.00058 0.00138 0.00365 -0.00097 245 3PY 0.00051 -0.00270 -0.00048 0.00113 0.00082 246 3PZ 0.00336 -0.00236 -0.00499 -0.00132 0.00160 247 4XX -0.00034 0.00002 -0.00041 0.00036 -0.00009 248 4YY 0.00009 -0.00001 0.00015 -0.00005 0.00001 249 4ZZ 0.00003 -0.00001 0.00011 0.00002 -0.00000 250 4XY 0.00043 0.00003 0.00013 -0.00039 0.00013 251 4XZ 0.00001 -0.00002 0.00009 -0.00009 -0.00004 252 4YZ -0.00001 0.00005 0.00022 -0.00003 -0.00002 253 22 H 1S 0.00101 -0.00028 0.00052 -0.00075 -0.00002 254 2S -0.00020 0.00135 0.00142 -0.00079 -0.00031 255 23 H 1S 0.00072 0.00010 -0.00113 -0.00096 0.00003 256 2S 0.00165 -0.00006 -0.00069 -0.00175 0.00051 257 24 H 1S -0.00080 -0.00016 -0.00153 0.00094 -0.00065 258 2S -0.00096 -0.00023 -0.00075 0.00137 -0.00075 259 25 H 1S -0.00068 -0.00014 -0.00071 0.00059 -0.00056 260 2S -0.00022 -0.00044 0.00013 -0.00069 0.00011 261 26 H 1S 0.00403 0.00114 0.00220 -0.00687 0.00219 262 2S 0.00117 0.00633 -0.00049 -0.00477 0.00201 263 27 H 1S -0.00829 0.00381 -0.00041 0.00494 -0.00467 264 2S -0.02047 0.00361 -0.00760 0.00926 -0.00917 146 147 148 149 150 146 3PZ 0.05373 147 4XX -0.00140 0.00108 148 4YY -0.00164 0.00015 0.00118 149 4ZZ 0.00379 -0.00025 -0.00062 0.00165 150 4XY -0.00023 0.00012 -0.00004 -0.00034 0.00054 151 4XZ 0.00274 -0.00019 -0.00002 0.00023 -0.00008 152 4YZ 0.00352 -0.00004 -0.00020 0.00028 0.00001 153 11 H 1S 0.08649 -0.00637 -0.00777 0.01413 -0.00092 154 2S 0.05934 -0.00298 -0.00593 0.01236 -0.00250 155 12 H 1S 0.00019 0.00189 0.00453 -0.00281 0.00246 156 2S -0.00355 0.00132 0.00222 -0.00140 0.00061 157 13 H 1S 0.00101 -0.00025 -0.00039 -0.00182 -0.00027 158 2S 0.00049 -0.00024 0.00012 -0.00303 0.00025 159 14 H 1S -0.00851 -0.00014 -0.00032 0.00125 -0.00024 160 2S -0.01337 -0.00042 -0.00079 0.00242 -0.00054 161 15 H 1S -0.01734 0.00008 0.00058 -0.00299 0.00057 162 2S -0.02472 0.00007 0.00005 -0.00312 0.00086 163 16 C 1S -0.00050 0.00009 0.00003 -0.00004 0.00007 164 2S 0.00053 -0.00016 -0.00007 0.00008 -0.00015 165 2PX 0.00101 0.00040 -0.00005 -0.00009 0.00026 166 2PY 0.00620 0.00014 0.00024 0.00009 -0.00006 167 2PZ 0.00352 -0.00002 -0.00067 -0.00010 -0.00040 168 3S -0.00084 -0.00189 0.00025 0.00114 -0.00094 169 3PX -0.00026 0.00098 -0.00033 -0.00061 0.00052 170 3PY -0.00042 -0.00020 0.00015 0.00048 -0.00044 171 3PZ 0.00098 -0.00025 -0.00049 0.00019 -0.00049 172 4XX -0.00000 -0.00002 -0.00003 0.00005 -0.00005 173 4YY 0.00000 -0.00000 0.00004 -0.00005 0.00003 174 4ZZ -0.00008 0.00003 0.00001 -0.00001 0.00002 175 4XY -0.00017 0.00001 0.00002 -0.00002 -0.00001 176 4XZ 0.00024 -0.00002 0.00003 0.00000 -0.00003 177 4YZ -0.00008 0.00001 0.00002 -0.00002 0.00003 178 17 C 1S 0.00155 0.00024 -0.00022 0.00015 0.00014 179 2S -0.00258 -0.00054 0.00055 -0.00027 -0.00034 180 2PX -0.00120 0.00077 -0.00106 0.00045 0.00107 181 2PY -0.00383 0.00022 0.00006 0.00016 0.00044 182 2PZ -0.00269 -0.00018 -0.00031 -0.00035 -0.00002 183 3S -0.00423 -0.00144 0.00156 -0.00054 -0.00086 184 3PX -0.00048 -0.00046 0.00015 0.00043 -0.00023 185 3PY -0.00095 0.00125 -0.00081 0.00018 0.00054 186 3PZ -0.00118 0.00023 -0.00044 -0.00013 -0.00000 187 4XX 0.00006 -0.00001 0.00002 -0.00002 -0.00003 188 4YY -0.00000 -0.00002 0.00004 0.00001 -0.00001 189 4ZZ 0.00016 -0.00000 -0.00001 0.00001 -0.00001 190 4XY -0.00003 -0.00004 0.00005 -0.00001 -0.00004 191 4XZ 0.00001 -0.00001 0.00001 -0.00002 -0.00001 192 4YZ -0.00006 -0.00002 -0.00001 0.00000 -0.00002 193 18 C 1S 0.00012 -0.00006 0.00011 -0.00003 -0.00008 194 2S -0.00040 0.00005 -0.00018 0.00010 0.00012 195 2PX -0.00166 -0.00018 0.00028 -0.00014 -0.00030 196 2PY -0.00066 0.00003 -0.00016 0.00022 0.00002 197 2PZ -0.00204 0.00011 -0.00024 -0.00022 0.00021 198 3S 0.00099 0.00150 -0.00138 0.00010 0.00095 199 3PX -0.00107 -0.00054 0.00044 -0.00011 -0.00015 200 3PY 0.00028 0.00043 -0.00045 0.00011 0.00030 201 3PZ -0.00082 0.00042 -0.00041 -0.00018 0.00037 202 4XX 0.00005 -0.00003 0.00003 -0.00001 -0.00004 203 4YY -0.00005 0.00002 -0.00002 0.00001 0.00003 204 4ZZ -0.00000 -0.00000 -0.00000 -0.00001 0.00000 205 4XY 0.00002 -0.00002 0.00001 -0.00001 -0.00002 206 4XZ -0.00002 0.00001 0.00002 0.00001 0.00000 207 4YZ -0.00007 0.00002 -0.00003 -0.00000 0.00003 208 19 C 1S -0.00000 0.00004 -0.00004 0.00000 0.00006 209 2S -0.00024 -0.00007 0.00007 -0.00001 -0.00012 210 2PX 0.00229 0.00017 -0.00010 0.00006 0.00023 211 2PY 0.00032 -0.00004 -0.00018 0.00004 -0.00008 212 2PZ -0.00091 0.00022 0.00009 0.00000 0.00028 213 3S 0.00020 -0.00047 0.00048 -0.00000 -0.00051 214 3PX 0.00101 0.00024 -0.00018 -0.00004 0.00029 215 3PY 0.00007 -0.00025 0.00003 0.00003 -0.00011 216 3PZ -0.00091 0.00003 0.00014 0.00002 0.00016 217 4XX 0.00000 0.00001 -0.00001 0.00001 0.00001 218 4YY -0.00005 0.00000 -0.00000 -0.00001 0.00000 219 4ZZ 0.00008 -0.00000 0.00001 0.00001 -0.00000 220 4XY 0.00002 -0.00001 0.00001 -0.00001 -0.00001 221 4XZ 0.00007 -0.00000 0.00001 0.00001 -0.00001 222 4YZ 0.00001 -0.00001 0.00001 0.00001 -0.00000 223 20 C 1S 0.00063 0.00002 -0.00001 0.00002 -0.00001 224 2S -0.00121 -0.00004 0.00003 -0.00003 0.00001 225 2PX 0.00359 0.00011 -0.00005 0.00003 -0.00001 226 2PY -0.00202 -0.00002 -0.00012 -0.00013 0.00002 227 2PZ 0.00031 -0.00005 0.00030 0.00015 0.00003 228 3S 0.00070 0.00021 0.00023 -0.00045 0.00021 229 3PX 0.00084 -0.00003 -0.00008 0.00017 -0.00010 230 3PY -0.00039 -0.00011 0.00010 -0.00021 0.00000 231 3PZ 0.00082 -0.00008 0.00034 0.00003 0.00003 232 4XX 0.00003 0.00000 0.00000 -0.00000 -0.00000 233 4YY -0.00005 0.00001 -0.00000 -0.00000 0.00001 234 4ZZ 0.00013 -0.00001 -0.00000 0.00000 -0.00001 235 4XY 0.00012 0.00000 -0.00000 0.00000 -0.00001 236 4XZ -0.00004 0.00001 -0.00000 -0.00000 0.00000 237 4YZ 0.00002 -0.00001 -0.00000 0.00000 -0.00001 238 21 C 1S 0.00011 0.00001 0.00003 -0.00005 0.00004 239 2S -0.00060 -0.00004 -0.00008 0.00012 -0.00011 240 2PX -0.00434 -0.00016 0.00008 -0.00007 0.00012 241 2PY 0.00043 0.00013 -0.00007 -0.00000 0.00011 242 2PZ 0.00333 -0.00019 -0.00004 0.00018 -0.00028 243 3S 0.00008 -0.00030 -0.00005 0.00044 -0.00035 244 3PX -0.00270 0.00005 -0.00039 0.00028 -0.00000 245 3PY -0.00001 0.00016 0.00009 -0.00030 0.00020 246 3PZ 0.00198 -0.00012 0.00009 -0.00002 -0.00014 247 4XX 0.00024 0.00001 0.00000 -0.00001 0.00001 248 4YY -0.00007 -0.00001 -0.00000 0.00001 -0.00000 249 4ZZ -0.00006 0.00000 -0.00000 -0.00000 0.00000 250 4XY 0.00001 -0.00000 -0.00002 0.00001 -0.00001 251 4XZ 0.00003 -0.00000 0.00003 0.00002 0.00001 252 4YZ -0.00012 0.00000 -0.00000 0.00000 0.00001 253 22 H 1S 0.00011 0.00001 -0.00007 0.00008 0.00000 254 2S -0.00013 -0.00002 -0.00005 0.00011 0.00003 255 23 H 1S 0.00119 0.00004 -0.00000 -0.00001 -0.00001 256 2S 0.00093 0.00004 -0.00001 -0.00000 -0.00002 257 24 H 1S 0.00072 0.00004 -0.00002 0.00002 0.00008 258 2S 0.00012 0.00004 -0.00007 0.00005 0.00011 259 25 H 1S 0.00058 0.00009 -0.00004 0.00001 0.00011 260 2S 0.00018 0.00021 -0.00015 -0.00003 0.00025 261 26 H 1S 0.00019 -0.00005 0.00014 -0.00022 -0.00041 262 2S 0.00138 0.00038 -0.00037 0.00018 -0.00038 263 27 H 1S -0.00145 0.00038 0.00052 -0.00074 0.00067 264 2S 0.00076 0.00126 0.00059 -0.00144 0.00120 151 152 153 154 155 151 4XZ 0.00060 152 4YZ 0.00047 0.00104 153 11 H 1S 0.00516 0.00701 0.21498 154 2S 0.00411 0.00594 0.15357 0.12994 155 12 H 1S -0.00413 -0.00672 -0.02236 -0.02044 0.21525 156 2S -0.00446 -0.00731 -0.02150 -0.01973 0.15590 157 13 H 1S -0.00088 -0.00131 -0.01001 -0.02009 -0.02181 158 2S -0.00090 -0.00125 -0.02023 -0.03014 -0.02093 159 14 H 1S 0.00032 0.00053 0.00285 0.00931 -0.01047 160 2S 0.00078 0.00125 0.00579 0.01729 -0.02146 161 15 H 1S -0.00025 -0.00018 -0.01175 -0.02040 0.00288 162 2S -0.00121 -0.00135 -0.02156 -0.02849 0.00892 163 16 C 1S -0.00002 -0.00001 -0.00002 0.00000 -0.00017 164 2S 0.00003 0.00003 -0.00042 -0.00012 0.00039 165 2PX -0.00017 0.00003 0.00044 -0.00048 -0.00037 166 2PY -0.00021 0.00035 0.00024 -0.00252 0.00027 167 2PZ 0.00021 -0.00006 -0.00050 0.00162 0.00030 168 3S 0.00103 -0.00053 0.00480 0.00476 0.00027 169 3PX -0.00026 -0.00004 -0.00479 -0.00456 0.00006 170 3PY -0.00008 0.00047 0.00213 0.00374 -0.00021 171 3PZ 0.00019 -0.00008 0.00154 0.00310 0.00048 172 4XX 0.00004 -0.00002 0.00014 0.00019 0.00009 173 4YY -0.00001 -0.00001 -0.00016 -0.00030 -0.00006 174 4ZZ -0.00001 0.00001 -0.00011 0.00001 -0.00007 175 4XY 0.00000 -0.00001 -0.00012 -0.00004 0.00001 176 4XZ 0.00001 -0.00001 0.00004 -0.00016 0.00005 177 4YZ -0.00001 0.00001 -0.00009 -0.00004 -0.00012 178 17 C 1S -0.00019 0.00013 0.00021 -0.00010 0.00014 179 2S 0.00046 -0.00028 -0.00049 0.00018 -0.00029 180 2PX -0.00088 0.00047 0.00067 0.00153 0.00005 181 2PY -0.00026 0.00004 -0.00021 0.00028 -0.00057 182 2PZ 0.00005 -0.00022 -0.00081 0.00035 0.00021 183 3S 0.00084 -0.00063 -0.00157 -0.00134 -0.00036 184 3PX -0.00044 0.00015 0.00175 0.00221 0.00132 185 3PY -0.00075 0.00068 0.00070 0.00270 -0.00031 186 3PZ -0.00039 0.00032 0.00040 0.00228 -0.00003 187 4XX 0.00002 -0.00002 -0.00004 -0.00006 0.00003 188 4YY 0.00001 0.00000 -0.00001 -0.00005 0.00002 189 4ZZ 0.00001 -0.00000 -0.00003 0.00004 0.00005 190 4XY 0.00005 -0.00002 0.00003 0.00002 -0.00003 191 4XZ 0.00003 -0.00000 0.00004 0.00002 -0.00004 192 4YZ 0.00001 -0.00001 -0.00001 0.00010 0.00002 193 18 C 1S 0.00008 -0.00006 -0.00011 -0.00023 -0.00003 194 2S -0.00015 0.00007 0.00015 0.00042 0.00019 195 2PX 0.00021 -0.00018 -0.00039 -0.00022 -0.00013 196 2PY -0.00010 0.00007 0.00033 0.00133 0.00018 197 2PZ -0.00012 0.00009 -0.00022 -0.00015 -0.00011 198 3S -0.00060 0.00062 0.00012 0.00122 -0.00102 199 3PX 0.00026 -0.00037 -0.00060 -0.00175 -0.00006 200 3PY -0.00006 0.00014 0.00016 0.00065 -0.00074 201 3PZ -0.00003 0.00008 -0.00036 -0.00052 -0.00051 202 4XX 0.00003 -0.00001 0.00001 0.00000 -0.00000 203 4YY -0.00002 0.00001 0.00001 0.00001 -0.00002 204 4ZZ -0.00000 -0.00001 -0.00003 -0.00006 0.00002 205 4XY 0.00001 -0.00002 -0.00003 -0.00003 0.00003 206 4XZ -0.00001 0.00001 0.00000 -0.00006 -0.00002 207 4YZ -0.00001 0.00001 -0.00000 0.00001 -0.00002 208 19 C 1S -0.00004 0.00002 0.00002 -0.00001 -0.00002 209 2S 0.00008 -0.00004 -0.00007 0.00006 0.00002 210 2PX -0.00012 0.00010 0.00018 -0.00055 0.00000 211 2PY 0.00003 -0.00003 0.00007 0.00082 0.00027 212 2PZ -0.00021 0.00019 0.00004 -0.00098 -0.00035 213 3S 0.00017 -0.00007 0.00040 0.00061 0.00068 214 3PX -0.00010 0.00006 -0.00035 -0.00091 -0.00038 215 3PY 0.00004 -0.00013 0.00006 0.00007 0.00044 216 3PZ -0.00016 0.00010 0.00010 -0.00068 -0.00019 217 4XX -0.00001 0.00001 0.00001 0.00003 0.00002 218 4YY 0.00000 -0.00000 -0.00002 0.00000 -0.00001 219 4ZZ -0.00000 0.00000 0.00000 -0.00004 0.00000 220 4XY 0.00001 -0.00000 -0.00000 -0.00003 0.00000 221 4XZ 0.00001 -0.00000 0.00001 0.00000 0.00001 222 4YZ 0.00000 -0.00000 0.00001 -0.00002 0.00000 223 20 C 1S 0.00000 0.00000 0.00009 -0.00010 0.00007 224 2S -0.00002 -0.00000 -0.00016 0.00026 -0.00007 225 2PX -0.00000 0.00005 0.00036 -0.00103 0.00017 226 2PY 0.00004 -0.00006 -0.00037 0.00075 -0.00017 227 2PZ -0.00009 0.00004 0.00015 -0.00082 -0.00002 228 3S 0.00004 -0.00002 -0.00228 -0.00268 -0.00113 229 3PX -0.00004 0.00006 0.00110 0.00091 0.00054 230 3PY 0.00003 -0.00006 -0.00063 -0.00053 -0.00023 231 3PZ -0.00007 0.00002 -0.00014 -0.00127 -0.00006 232 4XX 0.00000 -0.00000 -0.00001 -0.00004 -0.00000 233 4YY -0.00001 0.00001 -0.00000 -0.00002 -0.00002 234 4ZZ 0.00001 -0.00001 0.00001 0.00002 0.00004 235 4XY 0.00000 -0.00000 0.00002 -0.00002 0.00001 236 4XZ -0.00000 0.00001 -0.00000 0.00001 -0.00002 237 4YZ 0.00001 -0.00001 0.00000 0.00004 0.00001 238 21 C 1S -0.00003 0.00000 -0.00018 -0.00025 -0.00010 239 2S 0.00008 -0.00004 0.00035 0.00062 0.00029 240 2PX -0.00003 -0.00006 -0.00062 0.00089 -0.00026 241 2PY -0.00006 0.00013 0.00011 -0.00024 -0.00001 242 2PZ 0.00013 -0.00012 0.00041 -0.00013 0.00066 243 3S 0.00014 0.00000 0.00322 0.00302 0.00096 244 3PX -0.00010 0.00004 0.00038 0.00211 0.00060 245 3PY -0.00002 -0.00007 -0.00202 -0.00252 -0.00017 246 3PZ 0.00011 -0.00015 -0.00096 -0.00140 0.00032 247 4XX -0.00001 0.00001 -0.00001 -0.00010 -0.00001 248 4YY 0.00000 -0.00000 0.00004 0.00005 0.00002 249 4ZZ 0.00000 -0.00000 0.00000 0.00002 -0.00000 250 4XY 0.00001 -0.00001 0.00005 0.00010 0.00002 251 4XZ -0.00001 0.00000 0.00006 -0.00009 0.00002 252 4YZ -0.00000 0.00000 0.00003 0.00006 -0.00001 253 22 H 1S 0.00001 0.00001 0.00026 0.00025 0.00017 254 2S 0.00000 0.00006 0.00101 0.00103 -0.00021 255 23 H 1S 0.00001 0.00000 0.00008 -0.00045 0.00001 256 2S 0.00005 -0.00003 0.00005 -0.00039 -0.00004 257 24 H 1S -0.00003 0.00002 0.00004 -0.00016 -0.00000 258 2S -0.00009 0.00003 0.00014 0.00010 0.00007 259 25 H 1S -0.00006 0.00002 -0.00002 -0.00037 -0.00006 260 2S -0.00003 0.00001 -0.00017 -0.00053 -0.00049 261 26 H 1S 0.00022 -0.00016 -0.00037 -0.00044 0.00001 262 2S -0.00059 0.00053 0.00200 0.00278 0.00101 263 27 H 1S -0.00039 -0.00002 -0.00195 -0.00229 -0.00169 264 2S -0.00067 0.00037 -0.00578 -0.00624 -0.00325 156 157 158 159 160 156 2S 0.12993 157 13 H 1S -0.02146 0.21544 158 2S -0.02048 0.15669 0.13125 159 14 H 1S -0.02147 -0.02179 -0.02085 0.21526 160 2S -0.03197 -0.02146 -0.02032 0.15576 0.12943 161 15 H 1S 0.00603 -0.00994 -0.01986 -0.02239 -0.02145 162 2S 0.01707 -0.01969 -0.02931 -0.01985 -0.01880 163 16 C 1S -0.00034 0.00005 0.00017 -0.00030 -0.00050 164 2S 0.00078 0.00032 0.00015 0.00068 0.00117 165 2PX -0.00041 -0.00008 0.00006 -0.00099 -0.00112 166 2PY 0.00069 -0.00010 -0.00050 0.00055 0.00095 167 2PZ 0.00155 -0.00021 -0.00093 0.00016 0.00093 168 3S 0.00228 -0.00451 -0.00533 0.00152 0.00341 169 3PX 0.00000 0.00132 0.00104 0.00014 -0.00128 170 3PY -0.00049 -0.00068 -0.00061 0.00123 0.00309 171 3PZ 0.00147 -0.00065 -0.00115 0.00014 0.00118 172 4XX 0.00017 -0.00004 -0.00005 0.00009 0.00017 173 4YY -0.00013 0.00003 0.00005 -0.00013 -0.00021 174 4ZZ -0.00012 0.00006 0.00010 0.00001 -0.00004 175 4XY -0.00003 0.00004 0.00005 0.00007 0.00005 176 4XZ 0.00010 -0.00001 -0.00003 -0.00002 -0.00009 177 4YZ -0.00018 0.00001 0.00005 -0.00004 -0.00011 178 17 C 1S 0.00045 -0.00007 -0.00015 0.00019 0.00062 179 2S -0.00091 0.00028 0.00052 -0.00010 -0.00092 180 2PX 0.00024 -0.00011 -0.00019 0.00057 0.00172 181 2PY -0.00119 0.00026 0.00093 -0.00005 -0.00088 182 2PZ 0.00007 -0.00006 -0.00029 -0.00040 0.00034 183 3S -0.00090 0.00057 0.00125 -0.00250 -0.00299 184 3PX 0.00121 0.00126 0.00160 0.00124 0.00254 185 3PY -0.00115 0.00062 0.00071 0.00103 0.00142 186 3PZ -0.00048 0.00041 0.00025 0.00034 0.00140 187 4XX 0.00002 0.00003 0.00003 0.00002 -0.00001 188 4YY -0.00002 0.00005 0.00006 0.00010 0.00015 189 4ZZ 0.00009 0.00003 0.00001 0.00005 0.00007 190 4XY -0.00005 0.00002 0.00005 -0.00008 -0.00014 191 4XZ -0.00006 -0.00003 -0.00005 -0.00008 -0.00005 192 4YZ 0.00004 0.00003 0.00003 0.00001 0.00003 193 18 C 1S -0.00005 0.00004 0.00010 -0.00010 -0.00028 194 2S 0.00030 0.00004 -0.00005 0.00028 0.00065 195 2PX -0.00026 0.00005 0.00026 -0.00044 -0.00078 196 2PY 0.00054 0.00007 0.00016 0.00023 -0.00010 197 2PZ -0.00066 -0.00017 -0.00038 0.00023 0.00127 198 3S -0.00105 -0.00112 -0.00173 0.00060 0.00087 199 3PX 0.00020 -0.00031 -0.00010 -0.00091 -0.00148 200 3PY -0.00043 -0.00089 -0.00100 -0.00002 -0.00063 201 3PZ -0.00086 -0.00072 -0.00102 0.00006 0.00053 202 4XX -0.00000 -0.00001 -0.00001 -0.00000 -0.00003 203 4YY -0.00003 0.00001 0.00003 -0.00001 -0.00004 204 4ZZ 0.00002 0.00001 -0.00000 -0.00001 -0.00000 205 4XY 0.00006 -0.00000 -0.00001 -0.00001 -0.00000 206 4XZ -0.00004 0.00001 0.00004 0.00002 0.00000 207 4YZ -0.00003 -0.00002 -0.00003 -0.00002 0.00001 208 19 C 1S -0.00005 0.00000 -0.00002 0.00001 0.00002 209 2S 0.00010 -0.00004 -0.00002 0.00002 -0.00002 210 2PX 0.00002 0.00000 -0.00011 0.00015 0.00019 211 2PY 0.00070 -0.00003 -0.00010 -0.00008 -0.00005 212 2PZ -0.00099 0.00007 0.00021 0.00039 0.00063 213 3S 0.00054 0.00096 0.00123 0.00007 0.00041 214 3PX -0.00030 -0.00037 -0.00048 -0.00009 -0.00036 215 3PY 0.00080 0.00011 0.00018 -0.00044 -0.00041 216 3PZ -0.00062 0.00018 0.00040 0.00014 0.00032 217 4XX 0.00002 0.00001 0.00000 0.00002 0.00004 218 4YY -0.00003 0.00000 0.00000 -0.00000 0.00002 219 4ZZ 0.00001 0.00000 0.00001 0.00000 -0.00003 220 4XY -0.00000 -0.00001 -0.00001 -0.00001 0.00001 221 4XZ 0.00003 0.00001 0.00001 -0.00000 -0.00004 222 4YZ 0.00000 0.00001 0.00002 -0.00001 -0.00004 223 20 C 1S 0.00015 -0.00002 -0.00004 0.00003 0.00007 224 2S -0.00023 0.00009 0.00015 -0.00003 -0.00007 225 2PX 0.00051 -0.00010 -0.00030 0.00001 -0.00002 226 2PY -0.00044 -0.00001 -0.00005 -0.00002 0.00022 227 2PZ -0.00008 0.00010 0.00025 -0.00005 -0.00075 228 3S -0.00139 0.00008 0.00004 -0.00051 -0.00150 229 3PX 0.00061 0.00022 0.00023 0.00018 0.00057 230 3PY -0.00039 0.00034 0.00047 -0.00052 -0.00053 231 3PZ -0.00014 0.00026 0.00047 -0.00033 -0.00094 232 4XX 0.00001 -0.00000 -0.00001 -0.00002 -0.00002 233 4YY -0.00005 0.00001 0.00001 0.00004 0.00006 234 4ZZ 0.00008 0.00000 -0.00001 -0.00001 -0.00003 235 4XY 0.00004 -0.00001 -0.00001 -0.00001 -0.00002 236 4XZ -0.00003 0.00000 0.00001 0.00002 0.00004 237 4YZ 0.00004 -0.00001 -0.00001 -0.00001 -0.00002 238 21 C 1S -0.00022 0.00007 0.00007 -0.00005 -0.00020 239 2S 0.00058 -0.00015 -0.00022 0.00022 0.00051 240 2PX -0.00095 0.00019 0.00045 0.00008 -0.00028 241 2PY -0.00028 0.00003 0.00005 0.00056 0.00099 242 2PZ 0.00169 -0.00015 -0.00038 -0.00029 -0.00093 243 3S 0.00113 -0.00014 0.00012 -0.00001 0.00095 244 3PX 0.00067 -0.00045 -0.00077 0.00133 0.00181 245 3PY -0.00030 0.00017 0.00006 0.00037 -0.00009 246 3PZ 0.00101 -0.00001 -0.00019 -0.00019 -0.00105 247 4XX -0.00000 0.00001 -0.00000 -0.00001 -0.00001 248 4YY 0.00002 -0.00000 0.00000 -0.00000 -0.00001 249 4ZZ -0.00001 0.00000 0.00000 0.00002 0.00002 250 4XY 0.00006 -0.00002 -0.00002 -0.00001 0.00003 251 4XZ 0.00000 -0.00000 0.00002 0.00000 -0.00002 252 4YZ -0.00003 0.00000 0.00002 -0.00000 0.00001 253 22 H 1S 0.00026 -0.00001 0.00002 0.00015 0.00022 254 2S -0.00031 0.00005 0.00023 -0.00033 -0.00012 255 23 H 1S 0.00011 -0.00004 -0.00013 -0.00006 -0.00012 256 2S 0.00012 -0.00024 -0.00035 -0.00004 -0.00011 257 24 H 1S -0.00001 0.00001 -0.00002 0.00005 0.00005 258 2S 0.00003 0.00009 0.00010 -0.00002 0.00009 259 25 H 1S -0.00008 0.00000 -0.00002 -0.00008 -0.00002 260 2S -0.00050 -0.00041 -0.00040 -0.00025 -0.00052 261 26 H 1S -0.00014 0.00014 0.00016 -0.00057 -0.00129 262 2S 0.00058 0.00108 0.00097 0.00226 0.00258 263 27 H 1S -0.00341 0.00048 0.00102 -0.00158 -0.00323 264 2S -0.00556 0.00145 0.00234 -0.00275 -0.00480 161 162 163 164 165 161 15 H 1S 0.21453 162 2S 0.15063 0.12817 163 16 C 1S -0.00035 -0.00011 2.05171 164 2S -0.00018 -0.00047 -0.06402 0.33704 165 2PX -0.00039 -0.00135 -0.00212 0.00645 0.42206 166 2PY -0.00104 0.00056 0.00235 -0.00390 0.00601 167 2PZ 0.00249 -0.00469 0.00097 -0.00241 0.00047 168 3S 0.00712 0.00546 -0.16583 0.25630 0.01396 169 3PX -0.00202 -0.00169 -0.00717 0.00925 0.05593 170 3PY -0.00277 0.00121 0.00638 -0.00717 0.01086 171 3PZ 0.00108 -0.00238 0.00322 -0.00438 0.00860 172 4XX -0.00001 0.00001 -0.01709 -0.00328 0.00749 173 4YY -0.00009 -0.00030 -0.01585 -0.00568 -0.00468 174 4ZZ -0.00022 -0.00003 -0.01286 -0.01246 -0.00151 175 4XY -0.00018 -0.00020 0.00010 -0.00037 0.01257 176 4XZ -0.00009 0.00010 0.00020 -0.00054 0.00681 177 4YZ -0.00012 0.00002 -0.00267 0.00606 -0.00323 178 17 C 1S 0.00111 0.00028 0.01556 -0.03104 0.01282 179 2S -0.00370 -0.00140 -0.03172 0.05583 -0.02983 180 2PX 0.00588 0.00185 -0.01300 0.02446 0.00389 181 2PY -0.00095 0.00421 -0.06812 0.14062 -0.05276 182 2PZ 0.00309 -0.00429 -0.03649 0.07520 -0.02525 183 3S -0.00057 0.00136 0.00787 0.00971 -0.00516 184 3PX -0.00017 -0.00067 0.00216 0.00542 0.04562 185 3PY -0.00390 0.00125 -0.00723 0.02617 -0.03558 186 3PZ -0.00227 -0.00563 -0.00397 0.01402 -0.01864 187 4XX -0.00027 -0.00016 0.00278 -0.00677 0.00547 188 4YY -0.00022 -0.00010 -0.00502 0.00872 -0.00357 189 4ZZ -0.00001 -0.00017 -0.00014 -0.00049 -0.00066 190 4XY -0.00049 -0.00015 -0.00171 0.00335 0.00975 191 4XZ 0.00023 0.00005 -0.00097 0.00194 0.00514 192 4YZ -0.00009 -0.00010 -0.00422 0.00792 -0.00254 193 18 C 1S -0.00039 -0.00008 -0.00327 0.00836 0.00232 194 2S 0.00097 0.00034 0.00832 -0.01875 -0.00611 195 2PX -0.00159 0.00036 -0.00728 0.01898 0.00803 196 2PY -0.00069 0.00164 0.01227 -0.02926 -0.00330 197 2PZ 0.00279 -0.00189 0.00684 -0.01590 -0.00227 198 3S -0.00000 -0.00041 -0.00448 -0.00566 -0.05324 199 3PX 0.00215 0.00165 -0.00724 0.01350 0.02572 200 3PY -0.00037 0.00093 -0.00119 -0.00674 -0.01211 201 3PZ 0.00276 -0.00038 -0.00046 -0.00369 -0.00782 202 4XX -0.00023 -0.00008 0.00137 -0.00273 0.00097 203 4YY 0.00002 0.00013 -0.00160 0.00366 -0.00100 204 4ZZ 0.00015 -0.00004 -0.00046 0.00126 -0.00049 205 4XY 0.00003 -0.00008 0.00050 -0.00090 -0.00013 206 4XZ -0.00014 0.00017 0.00025 -0.00040 -0.00023 207 4YZ 0.00015 -0.00001 -0.00103 0.00215 -0.00034 208 19 C 1S 0.00017 0.00003 -0.00367 0.00635 0.00682 209 2S -0.00045 0.00004 0.00675 -0.01384 -0.01680 210 2PX 0.00099 -0.00060 -0.00718 0.01495 0.00239 211 2PY 0.00045 -0.00070 0.00487 -0.00970 -0.02746 212 2PZ -0.00020 0.00161 0.00303 -0.00551 -0.01636 213 3S -0.00175 -0.00099 0.02322 -0.03268 -0.02442 214 3PX 0.00082 -0.00005 -0.00896 0.01207 -0.00709 215 3PY 0.00154 0.00016 0.00588 -0.00783 -0.00675 216 3PZ 0.00018 0.00132 0.00360 -0.00452 -0.00442 217 4XX 0.00005 0.00001 -0.00003 -0.00008 0.00156 218 4YY 0.00006 -0.00013 -0.00021 0.00033 -0.00115 219 4ZZ -0.00008 0.00010 -0.00034 0.00043 -0.00041 220 4XY 0.00001 -0.00007 -0.00020 0.00072 0.00062 221 4XZ -0.00012 0.00010 -0.00012 0.00040 0.00030 222 4YZ -0.00005 0.00010 0.00013 -0.00014 -0.00069 223 20 C 1S 0.00010 -0.00019 -0.00316 0.00835 0.01493 224 2S -0.00014 0.00040 0.00806 -0.01843 -0.03659 225 2PX 0.00021 -0.00098 -0.01486 0.03644 0.05691 226 2PY 0.00082 -0.00134 0.00360 -0.01115 -0.01495 227 2PZ -0.00185 0.00345 0.00236 -0.00707 -0.00984 228 3S -0.00226 -0.00172 -0.00478 -0.00609 -0.06500 229 3PX 0.00048 0.00015 -0.00005 0.01051 0.03572 230 3PY 0.00049 -0.00159 0.00566 -0.00981 -0.02034 231 3PZ -0.00139 0.00205 0.00309 -0.00563 -0.01242 232 4XX -0.00002 -0.00003 -0.00200 0.00443 0.01125 233 4YY 0.00001 0.00002 0.00108 -0.00199 -0.00464 234 4ZZ 0.00001 -0.00002 0.00034 -0.00043 -0.00131 235 4XY -0.00003 0.00001 -0.00025 0.00072 0.00084 236 4XZ -0.00000 -0.00006 -0.00008 0.00030 0.00012 237 4YZ -0.00001 -0.00001 0.00066 -0.00145 -0.00288 238 21 C 1S -0.00010 0.00004 0.01526 -0.03098 -0.07145 239 2S 0.00022 0.00024 -0.03109 0.05562 0.14407 240 2PX 0.00003 0.00167 0.07114 -0.15014 -0.29086 241 2PY 0.00073 -0.00096 0.02448 -0.04802 -0.09817 242 2PZ -0.00017 0.00116 0.01174 -0.02348 -0.04495 243 3S 0.00155 0.00074 0.00784 0.01061 0.18159 244 3PX 0.00109 0.00211 0.00895 -0.02784 -0.09781 245 3PY -0.00000 -0.00136 0.00001 -0.01038 -0.05752 246 3PZ -0.00051 0.00085 -0.00025 -0.00530 -0.02792 247 4XX -0.00001 -0.00007 -0.00608 0.01061 0.00362 248 4YY 0.00004 0.00010 0.00169 -0.00442 -0.00673 249 4ZZ 0.00002 -0.00001 0.00179 -0.00427 -0.00685 250 4XY 0.00013 -0.00010 -0.00341 0.00683 0.00965 251 4XZ -0.00010 0.00023 -0.00171 0.00346 0.00486 252 4YZ 0.00002 0.00000 0.00001 -0.00036 -0.00025 253 22 H 1S 0.00042 0.00016 0.01218 -0.02672 -0.03858 254 2S -0.00001 0.00018 0.01379 -0.02653 -0.04704 255 23 H 1S -0.00005 -0.00038 -0.00812 0.01810 0.03592 256 2S -0.00004 -0.00027 -0.01084 0.02207 0.05313 257 24 H 1S 0.00036 -0.00019 -0.00111 0.00186 0.00423 258 2S 0.00077 0.00019 0.00084 -0.00111 0.00640 259 25 H 1S 0.00034 -0.00003 -0.00847 0.01868 -0.00401 260 2S 0.00086 0.00049 -0.01152 0.02320 -0.00412 261 26 H 1S -0.00353 -0.00113 0.01229 -0.02727 0.02451 262 2S -0.00680 -0.00251 0.01477 -0.02756 0.06039 263 27 H 1S -0.00262 -0.00173 0.01263 -0.02842 0.01655 264 2S -0.00270 -0.00434 0.01242 -0.02604 0.00724 166 167 168 169 170 166 2PY 0.40701 167 2PZ 0.03458 0.36647 168 3S -0.03569 -0.01501 0.25976 169 3PX 0.02757 0.01944 0.00106 0.02586 170 3PY 0.08138 -0.06861 -0.00137 0.00066 0.04771 171 3PZ -0.06822 0.16799 0.00344 0.00389 -0.04211 172 4XX 0.00924 0.00491 -0.00192 0.00207 0.00134 173 4YY -0.00589 -0.00689 -0.00488 -0.00121 -0.00051 174 4ZZ -0.00368 0.00158 -0.00865 -0.00073 -0.00109 175 4XY -0.00621 -0.00207 -0.00101 -0.00020 0.00040 176 4XZ -0.00204 -0.00384 -0.00034 -0.00010 0.00105 177 4YZ -0.00529 -0.00102 0.00310 -0.00030 -0.00185 178 17 C 1S 0.06497 0.03547 0.00494 0.00229 0.00412 179 2S -0.13051 -0.07111 0.01798 0.00382 -0.02679 180 2PX -0.04302 -0.01957 0.04210 0.02963 -0.04357 181 2PY -0.21063 -0.20011 0.13622 -0.03598 0.00136 182 2PZ -0.19593 0.04945 0.07409 -0.01919 -0.04441 183 3S -0.15893 -0.09054 -0.00802 -0.00376 -0.00955 184 3PX -0.03188 -0.01476 0.02130 0.00630 -0.00909 185 3PY -0.06980 -0.08826 0.01859 -0.01412 0.00886 186 3PZ -0.08434 0.04374 0.01014 -0.00699 -0.02153 187 4XX 0.00981 0.00531 -0.00917 0.00243 0.00276 188 4YY -0.00009 -0.01018 0.00925 -0.00208 0.00174 189 4ZZ -0.00104 0.00979 0.00145 -0.00067 -0.00218 190 4XY -0.00418 -0.00302 0.00222 0.00015 0.00130 191 4XZ -0.00311 -0.00045 0.00150 -0.00012 0.00049 192 4YZ -0.00963 0.00264 0.00716 -0.00078 -0.00337 193 18 C 1S -0.01256 -0.00704 -0.00079 -0.00988 0.00746 194 2S 0.03146 0.01783 -0.01705 0.01619 -0.00628 195 2PX -0.02379 -0.01397 0.00154 -0.00310 0.04769 196 2PY 0.03718 0.02738 -0.07049 0.04838 0.00011 197 2PZ 0.02591 0.00269 -0.04096 0.02271 0.01027 198 3S 0.04754 0.02625 -0.00645 0.00861 -0.00630 199 3PX -0.02241 -0.01359 0.01423 0.00143 0.01360 200 3PY 0.01442 0.01910 -0.02324 0.01554 -0.00414 201 3PZ 0.01896 -0.01139 -0.01465 0.00577 0.00900 202 4XX 0.00517 0.00254 -0.00466 0.00117 0.00228 203 4YY -0.00651 -0.00603 0.00499 -0.00223 -0.00192 204 4ZZ -0.00333 0.00095 0.00191 -0.00107 -0.00081 205 4XY 0.00092 0.00445 -0.00157 -0.00114 0.00014 206 4XZ 0.00411 -0.00482 -0.00091 -0.00083 0.00248 207 4YZ -0.00553 -0.00132 0.00277 -0.00100 -0.00220 208 19 C 1S -0.00478 -0.00285 0.02753 0.00929 -0.00584 209 2S 0.01189 0.00710 -0.04423 -0.01026 0.00520 210 2PX -0.02644 -0.01671 0.04917 -0.02649 -0.02688 211 2PY -0.02766 0.03502 -0.04127 -0.02066 -0.05371 212 2PZ 0.03333 -0.07264 -0.02761 -0.01494 0.00898 213 3S 0.01799 0.01074 -0.06344 -0.01239 0.00725 214 3PX -0.00599 -0.00522 0.01913 -0.00968 -0.00893 215 3PY -0.02201 0.02391 -0.01672 -0.00489 -0.02544 216 3PZ 0.02293 -0.05378 -0.01285 -0.00526 0.01281 217 4XX 0.00176 0.00097 0.00062 0.00232 0.00128 218 4YY -0.00132 -0.00078 0.00126 -0.00124 -0.00133 219 4ZZ -0.00033 -0.00011 0.00148 -0.00032 -0.00031 220 4XY -0.00008 0.00016 0.00066 -0.00071 0.00101 221 4XZ 0.00017 -0.00032 0.00049 -0.00034 0.00038 222 4YZ -0.00090 -0.00044 -0.00009 -0.00078 -0.00085 223 20 C 1S 0.00054 0.00012 -0.00446 -0.00675 0.00454 224 2S -0.00104 0.00010 -0.01036 0.00291 -0.00914 225 2PX 0.00441 0.00119 0.06730 -0.00015 0.03550 226 2PY -0.00101 0.00960 0.02700 0.03315 0.02223 227 2PZ 0.00932 -0.01295 0.01452 0.01692 0.02189 228 3S 0.03729 0.01954 0.00121 0.00099 -0.00027 229 3PX -0.01174 -0.00692 0.02569 0.00043 0.00945 230 3PY 0.00762 0.01842 -0.00439 0.01032 0.00380 231 3PZ 0.01985 -0.01766 -0.00217 0.00477 0.01369 232 4XX 0.00273 0.00111 0.00633 0.00364 0.00258 233 4YY 0.00087 -0.00460 -0.00411 -0.00216 0.00056 234 4ZZ -0.00236 0.00413 -0.00070 -0.00080 -0.00162 235 4XY -0.00024 0.00228 0.00054 0.00006 0.00071 236 4XZ 0.00203 -0.00297 -0.00005 -0.00013 0.00156 237 4YZ -0.00252 0.00246 -0.00258 -0.00087 -0.00186 238 21 C 1S -0.02259 -0.01116 0.01142 -0.00489 -0.00154 239 2S 0.05028 0.02537 0.00744 0.03198 -0.00305 240 2PX -0.09786 -0.04481 -0.11414 -0.03043 -0.02214 241 2PY 0.01400 -0.07483 -0.08220 -0.04174 0.01848 242 2PZ -0.07337 0.11634 -0.03587 -0.01915 -0.03917 243 3S 0.02538 0.01118 -0.02338 0.01626 -0.00291 244 3PX -0.05663 -0.02336 -0.00596 -0.00822 -0.00759 245 3PY 0.04354 -0.02491 -0.03105 -0.00964 0.01144 246 3PZ -0.02429 0.08036 -0.01232 -0.00323 -0.02361 247 4XX 0.00821 0.00396 0.01048 0.00231 0.00208 248 4YY -0.00807 -0.00169 -0.00607 -0.00295 -0.00250 249 4ZZ -0.00206 -0.00313 -0.00285 -0.00190 0.00017 250 4XY -0.00756 0.00249 0.00581 0.00026 -0.00153 251 4XZ 0.00248 -0.01132 0.00282 -0.00017 0.00336 252 4YZ -0.00265 -0.00356 -0.00331 -0.00096 -0.00109 253 22 H 1S -0.02848 -0.01467 -0.06491 -0.02278 -0.01054 254 2S -0.06096 -0.03406 -0.04604 -0.02687 -0.01220 255 23 H 1S 0.00910 0.00435 0.04573 0.01445 0.02611 256 2S 0.01207 0.00566 0.03804 0.01564 0.02433 257 24 H 1S -0.00275 -0.00165 0.01932 -0.00199 0.00266 258 2S -0.00443 -0.00268 0.01742 0.00516 -0.00228 259 25 H 1S -0.03199 -0.01783 0.04734 -0.02835 -0.01516 260 2S -0.04859 -0.02756 0.04082 -0.02665 -0.01584 261 26 H 1S 0.03829 0.02038 -0.05531 -0.00005 0.02220 262 2S 0.05014 0.02758 -0.04480 0.00300 0.02642 263 27 H 1S -0.03590 -0.02274 -0.05614 -0.00623 -0.00998 264 2S -0.06639 -0.03892 -0.04177 -0.00500 -0.01105 171 172 173 174 175 171 3PZ 0.10054 172 4XX 0.00072 0.00130 173 4YY -0.00227 -0.00052 0.00126 174 4ZZ 0.00135 0.00001 0.00018 0.00097 175 4XY 0.00120 0.00009 0.00004 -0.00005 0.00122 176 4XZ -0.00096 0.00004 -0.00013 0.00015 0.00042 177 4YZ -0.00010 -0.00047 0.00011 0.00014 -0.00013 178 17 C 1S 0.00246 0.00244 -0.00506 -0.00022 -0.00174 179 2S -0.01511 -0.00623 0.00859 -0.00043 0.00305 180 2PX -0.02280 -0.00554 0.00400 0.00027 -0.01120 181 2PY -0.04999 -0.00896 -0.00123 0.00020 0.00193 182 2PZ 0.07109 -0.00489 0.00700 -0.00755 0.00471 183 3S -0.00727 -0.00635 0.00888 0.00111 0.00585 184 3PX -0.00329 -0.00161 0.00094 -0.00002 -0.00211 185 3PY -0.02617 -0.00367 -0.00063 0.00192 0.00038 186 3PZ 0.04269 -0.00211 0.00483 -0.00407 0.00269 187 4XX 0.00148 0.00052 -0.00006 0.00011 0.00030 188 4YY -0.00509 -0.00018 0.00004 -0.00048 -0.00011 189 4ZZ 0.00502 0.00013 -0.00052 0.00023 -0.00016 190 4XY 0.00047 0.00014 -0.00027 0.00000 0.00074 191 4XZ 0.00102 0.00006 0.00018 -0.00033 0.00040 192 4YZ 0.00286 -0.00026 -0.00009 -0.00006 0.00004 193 18 C 1S 0.00438 0.00044 -0.00080 -0.00022 0.00151 194 2S -0.00377 -0.00058 0.00172 0.00068 -0.00328 195 2PX 0.02645 0.00120 -0.00381 -0.00151 0.00562 196 2PY 0.00385 -0.00097 -0.00049 0.00546 -0.00521 197 2PZ -0.00436 -0.00079 0.01047 -0.00742 -0.00172 198 3S -0.00466 -0.00169 0.00096 0.00057 -0.00414 199 3PX 0.00745 -0.00054 -0.00037 -0.00054 0.00231 200 3PY 0.00431 -0.00041 -0.00190 0.00327 -0.00215 201 3PZ -0.00938 -0.00038 0.00612 -0.00518 -0.00031 202 4XX 0.00105 0.00025 -0.00001 0.00004 0.00018 203 4YY -0.00241 -0.00027 -0.00015 0.00011 0.00005 204 4ZZ 0.00118 -0.00005 0.00012 -0.00021 0.00010 205 4XY 0.00264 0.00017 -0.00026 -0.00006 0.00030 206 4XZ -0.00314 0.00010 -0.00022 0.00003 -0.00005 207 4YZ -0.00024 -0.00021 0.00023 -0.00016 -0.00002 208 19 C 1S -0.00340 0.00006 -0.00007 -0.00031 -0.00027 209 2S 0.00314 -0.00029 0.00006 0.00037 0.00095 210 2PX -0.01581 -0.00158 0.00153 0.00027 -0.00101 211 2PY 0.00407 -0.00219 -0.00056 0.00253 0.00154 212 2PZ -0.05701 -0.00105 0.00428 -0.00326 -0.00248 213 3S 0.00415 0.00040 0.00059 0.00086 0.00142 214 3PX -0.00607 -0.00174 0.00113 0.00012 -0.00058 215 3PY 0.00990 -0.00141 0.00006 0.00169 0.00069 216 3PZ -0.03751 -0.00067 0.00287 -0.00195 -0.00167 217 4XX 0.00067 -0.00006 0.00011 0.00004 -0.00022 218 4YY -0.00050 0.00009 0.00010 -0.00021 0.00013 219 4ZZ -0.00037 0.00004 -0.00021 0.00016 -0.00017 220 4XY 0.00067 -0.00019 0.00013 -0.00016 0.00031 221 4XZ 0.00003 -0.00009 -0.00034 0.00031 0.00010 222 4YZ -0.00061 0.00009 -0.00020 0.00012 -0.00015 223 20 C 1S 0.00263 -0.00140 0.00060 0.00021 0.00117 224 2S -0.00507 0.00290 -0.00102 -0.00013 -0.00259 225 2PX 0.01922 -0.00814 0.00232 0.00076 0.00434 226 2PY 0.02246 0.00412 0.00057 -0.00208 -0.00050 227 2PZ -0.00716 0.00284 -0.00408 0.00280 -0.00646 228 3S -0.00108 0.00120 -0.00096 -0.00018 -0.00359 229 3PX 0.00500 -0.00185 0.00034 0.00015 0.00198 230 3PY 0.01294 0.00040 0.00165 -0.00091 -0.00011 231 3PZ -0.01480 0.00053 -0.00202 0.00217 -0.00410 232 4XX 0.00130 0.00031 -0.00032 -0.00023 0.00014 233 4YY -0.00291 -0.00024 0.00045 -0.00009 0.00011 234 4ZZ 0.00248 -0.00017 -0.00012 0.00027 0.00008 235 4XY 0.00170 -0.00036 -0.00003 0.00012 0.00001 236 4XZ -0.00136 -0.00022 0.00018 -0.00010 0.00018 237 4YZ 0.00136 -0.00004 -0.00005 0.00021 0.00005 238 21 C 1S -0.00097 -0.00617 0.00165 0.00171 -0.00373 239 2S -0.00170 0.01103 -0.00477 -0.00432 0.00703 240 2PX -0.00973 -0.00161 0.00595 0.00579 -0.00937 241 2PY -0.03734 -0.00778 0.01029 0.00039 0.00765 242 2PZ 0.06684 -0.00387 -0.00247 0.00761 0.00004 243 3S -0.00203 0.01036 -0.00426 -0.00243 0.01009 244 3PX -0.00035 -0.00089 0.00143 0.00130 -0.00346 245 3PY -0.02148 -0.00207 0.00450 -0.00139 0.00183 246 3PZ 0.03992 -0.00088 -0.00319 0.00453 -0.00178 247 4XX 0.00080 0.00008 -0.00037 -0.00039 -0.00030 248 4YY 0.00002 -0.00036 0.00037 0.00032 0.00012 249 4ZZ -0.00095 -0.00039 0.00032 0.00018 -0.00007 250 4XY 0.00334 -0.00023 0.00001 -0.00017 0.00066 251 4XZ -0.00586 -0.00012 0.00003 -0.00010 0.00013 252 4YZ -0.00172 0.00001 0.00022 -0.00003 0.00041 253 22 H 1S -0.00550 -0.00196 0.00411 0.00154 0.00611 254 2S -0.00747 -0.00424 0.00445 0.00194 0.00378 255 23 H 1S 0.01425 -0.00194 -0.00001 -0.00017 0.00114 256 2S 0.01329 -0.00133 -0.00043 -0.00045 0.00176 257 24 H 1S 0.00157 0.00058 0.00025 0.00008 -0.00118 258 2S -0.00141 0.00097 0.00027 0.00003 -0.00210 259 25 H 1S -0.00775 -0.00050 -0.00130 -0.00049 0.00145 260 2S -0.00850 -0.00114 -0.00078 -0.00047 0.00175 261 26 H 1S 0.01234 0.00341 0.00028 0.00022 0.00717 262 2S 0.01508 0.00399 -0.00175 -0.00002 0.00563 263 27 H 1S -0.00741 -0.00587 0.00720 0.00301 -0.00172 264 2S -0.00746 -0.00533 0.00534 0.00254 0.00081 176 177 178 179 180 176 4XZ 0.00072 177 4YZ 0.00007 0.00063 178 17 C 1S -0.00097 -0.00417 2.05361 179 2S 0.00173 0.00776 -0.06688 0.34030 180 2PX -0.00621 0.00352 0.00445 -0.00101 0.45773 181 2PY 0.00453 0.00712 0.00459 -0.01042 0.00414 182 2PZ -0.00399 -0.00263 0.00226 -0.00540 -0.00410 183 3S 0.00335 0.00621 -0.17711 0.27594 -0.06009 184 3PX -0.00146 0.00039 0.00698 -0.03158 0.14700 185 3PY 0.00259 0.00321 -0.00054 -0.00752 -0.01018 186 3PZ -0.00330 -0.00253 -0.00062 -0.00298 -0.00500 187 4XX 0.00016 -0.00021 -0.02061 0.00332 -0.01221 188 4YY -0.00006 -0.00007 -0.01577 -0.00615 0.00260 189 4ZZ -0.00010 -0.00008 -0.01249 -0.01341 0.00178 190 4XY 0.00044 0.00009 -0.00162 0.00273 -0.01540 191 4XZ 0.00015 -0.00021 -0.00052 0.00072 -0.00730 192 4YZ -0.00000 0.00037 -0.00275 0.00613 0.00158 193 18 C 1S 0.00080 -0.00058 0.01735 -0.03600 -0.06484 194 2S -0.00176 0.00106 -0.03522 0.06300 0.13111 195 2PX 0.00294 -0.00281 0.06251 -0.13569 -0.19339 196 2PY -0.00111 0.00586 -0.04545 0.09323 0.14270 197 2PZ -0.00393 -0.00458 -0.02603 0.05346 0.09013 198 3S -0.00216 0.00085 0.00637 0.02078 0.11641 199 3PX 0.00127 -0.00031 0.00969 -0.02577 -0.03947 200 3PY 0.00013 0.00302 -0.00439 0.02599 0.03792 201 3PZ -0.00232 -0.00356 -0.00251 0.01443 0.02686 202 4XX 0.00012 -0.00006 -0.00296 0.00435 -0.01009 203 4YY 0.00007 0.00023 0.00020 -0.00139 0.00268 204 4ZZ -0.00001 -0.00017 0.00128 -0.00329 -0.00267 205 4XY -0.00004 -0.00029 0.00485 -0.00989 -0.00980 206 4XZ 0.00034 -0.00007 0.00277 -0.00561 -0.00521 207 4YZ -0.00004 0.00002 -0.00119 0.00217 0.00558 208 19 C 1S -0.00016 0.00023 -0.00300 0.00818 0.01497 209 2S 0.00055 -0.00034 0.00838 -0.01977 -0.03941 210 2PX -0.00043 0.00103 -0.01498 0.04073 0.05764 211 2PY -0.00216 0.00190 0.00088 0.00078 0.00287 212 2PZ 0.00434 -0.00190 0.00077 -0.00065 0.00332 213 3S 0.00070 -0.00049 -0.00595 -0.00653 -0.05660 214 3PX -0.00018 0.00088 -0.00098 0.01281 0.03682 215 3PY -0.00148 0.00136 -0.00589 0.00801 0.03053 216 3PZ 0.00257 -0.00105 -0.00321 0.00397 0.01782 217 4XX -0.00011 0.00010 -0.00169 0.00371 0.00939 218 4YY -0.00033 -0.00020 0.00076 -0.00128 -0.00241 219 4ZZ 0.00030 0.00013 0.00028 -0.00028 -0.00105 220 4XY 0.00010 -0.00017 0.00124 -0.00295 -0.00471 221 4XZ 0.00022 0.00021 0.00072 -0.00168 -0.00316 222 4YZ 0.00021 0.00008 0.00035 -0.00074 -0.00136 223 20 C 1S 0.00068 0.00029 -0.00303 0.00533 0.00753 224 2S -0.00150 -0.00066 0.00520 -0.01108 -0.01535 225 2PX 0.00286 0.00139 -0.00674 0.01444 0.01718 226 2PY -0.00658 -0.00210 -0.00370 0.00658 0.01946 227 2PZ 0.00770 0.00239 -0.00206 0.00342 0.00675 228 3S -0.00191 -0.00049 0.02154 -0.02874 -0.04701 229 3PX 0.00125 0.00022 -0.00997 0.01206 0.00914 230 3PY -0.00415 -0.00082 -0.00396 0.00538 0.01440 231 3PZ 0.00517 0.00197 -0.00208 0.00281 0.00484 232 4XX 0.00006 -0.00010 0.00023 -0.00086 -0.00011 233 4YY 0.00008 -0.00006 -0.00029 0.00067 0.00015 234 4ZZ 0.00005 0.00019 -0.00036 0.00054 0.00012 235 4XY 0.00020 0.00007 0.00030 -0.00083 -0.00145 236 4XZ -0.00023 -0.00009 0.00015 -0.00042 -0.00070 237 4YZ 0.00002 0.00015 0.00004 0.00016 -0.00026 238 21 C 1S -0.00188 0.00008 -0.00315 0.00801 0.00815 239 2S 0.00357 -0.00067 0.00808 -0.01836 -0.01941 240 2PX -0.00492 0.00087 -0.01154 0.02834 0.02930 241 2PY -0.00020 0.00034 -0.00830 0.02073 0.01360 242 2PZ 0.00861 0.00582 -0.00434 0.01075 0.00316 243 3S 0.00514 -0.00183 -0.00120 -0.01324 -0.04621 244 3PX -0.00174 0.00050 -0.00698 0.01636 0.03444 245 3PY -0.00191 -0.00057 0.00347 0.00290 0.01058 246 3PZ 0.00469 0.00369 0.00200 0.00128 0.00223 247 4XX -0.00016 0.00003 0.00066 -0.00128 0.00026 248 4YY 0.00032 0.00021 -0.00090 0.00217 0.00138 249 4ZZ -0.00029 -0.00004 -0.00022 0.00072 0.00037 250 4XY 0.00013 0.00013 -0.00109 0.00209 0.00194 251 4XZ 0.00048 0.00010 -0.00062 0.00119 0.00079 252 4YZ 0.00005 0.00009 -0.00056 0.00122 0.00086 253 22 H 1S 0.00339 0.00202 -0.00676 0.01564 0.00832 254 2S 0.00214 0.00197 -0.00978 0.01941 0.01313 255 23 H 1S 0.00068 0.00010 -0.00067 0.00086 0.00231 256 2S 0.00102 -0.00004 0.00168 -0.00276 -0.00150 257 24 H 1S -0.00068 0.00021 -0.00822 0.01936 0.03029 258 2S -0.00121 0.00030 -0.01141 0.02447 0.05307 259 25 H 1S 0.00074 -0.00072 0.01347 -0.02948 -0.01925 260 2S 0.00096 -0.00021 0.01498 -0.02778 -0.02719 261 26 H 1S 0.00386 -0.00045 -0.06300 0.12136 -0.25679 262 2S 0.00278 -0.00209 -0.00778 0.01626 -0.18404 263 27 H 1S -0.00120 0.00482 -0.00821 0.01733 -0.00171 264 2S 0.00031 0.00318 -0.00974 0.02044 -0.00551 181 182 183 184 185 181 2PY 0.39444 182 2PZ 0.05163 0.32263 183 3S 0.03156 0.02149 0.27885 184 3PX 0.02242 0.01892 -0.03172 0.06578 185 3PY 0.15882 -0.01425 0.01110 0.00215 0.07860 186 3PZ -0.01796 0.17877 0.00932 0.00593 -0.02251 187 4XX -0.01393 -0.00654 0.00473 -0.00490 -0.00368 188 4YY 0.01068 0.00553 -0.00479 0.00190 0.00288 189 4ZZ 0.00257 0.00121 -0.01036 0.00178 0.00073 190 4XY 0.00700 -0.00058 0.00600 -0.00371 0.00264 191 4XZ -0.00050 0.00885 0.00267 -0.00123 -0.00127 192 4YZ 0.00652 0.00381 0.00408 0.00013 0.00169 193 18 C 1S 0.04292 0.02510 0.01426 -0.00386 0.00986 194 2S -0.08944 -0.05173 0.00659 0.02778 -0.01965 195 2PX 0.14140 0.08849 -0.04786 -0.03700 0.07787 196 2PY -0.03065 -0.15270 0.07388 0.02303 0.01277 197 2PZ -0.15191 0.16302 0.04571 0.02550 -0.07483 198 3S -0.06339 -0.04242 -0.03738 0.01532 -0.00754 199 3PX 0.04868 0.03128 0.00322 -0.00140 0.02175 200 3PY 0.00954 -0.08264 0.01647 -0.00081 0.01578 201 3PZ -0.07867 0.11086 0.01153 0.00774 -0.04240 202 4XX -0.00650 -0.00347 0.00621 -0.00385 -0.00180 203 4YY 0.01154 -0.00123 -0.00301 0.00115 0.00415 204 4ZZ 0.00143 0.00849 -0.00173 -0.00009 -0.00082 205 4XY 0.00186 0.00508 -0.00799 -0.00236 0.00116 206 4XZ 0.00495 -0.00361 -0.00449 -0.00136 0.00322 207 4YZ 0.00096 0.00569 -0.00049 0.00180 -0.00034 208 19 C 1S -0.00334 -0.00235 -0.00563 -0.00086 -0.00649 209 2S 0.00927 0.00626 -0.00988 -0.01205 0.01139 210 2PX -0.01650 -0.01029 0.03274 0.02447 -0.04151 211 2PY 0.01484 -0.01889 -0.05945 -0.01958 0.00307 212 2PZ -0.01593 0.03996 -0.02875 -0.00718 -0.00549 213 3S -0.01166 -0.00188 0.01199 -0.01647 0.00289 214 3PX 0.00001 -0.00188 0.00868 0.01288 -0.01044 215 3PY 0.00299 -0.01166 -0.01412 0.00342 0.00017 216 3PZ -0.01007 0.01854 -0.00521 0.00401 -0.00260 217 4XX -0.00403 -0.00277 0.00392 0.00313 -0.00101 218 4YY -0.00119 0.00522 -0.00228 -0.00074 -0.00207 219 4ZZ 0.00250 -0.00407 -0.00051 -0.00055 0.00130 220 4XY 0.00062 0.00581 -0.00314 -0.00137 0.00086 221 4XZ 0.00588 -0.00696 -0.00196 -0.00131 0.00381 222 4YZ 0.00262 -0.00308 -0.00144 -0.00067 0.00121 223 20 C 1S 0.00185 0.00089 0.01963 0.01317 0.00142 224 2S -0.00539 -0.00266 -0.02833 -0.01840 -0.00257 225 2PX 0.01740 0.00664 0.04181 0.01845 0.00754 226 2PY -0.04268 0.03910 0.04394 0.01223 -0.02078 227 2PZ 0.03839 -0.09345 0.02466 0.00081 0.03622 228 3S -0.01315 -0.00773 -0.04474 -0.03170 -0.00212 229 3PX 0.00664 0.00211 0.01935 0.00897 0.00045 230 3PY -0.03675 0.02829 0.01445 0.00459 -0.01744 231 3PZ 0.02753 -0.07302 0.00853 -0.00187 0.02578 232 4XX -0.00157 -0.00074 0.00062 0.00110 -0.00095 233 4YY -0.00005 0.00317 0.00084 -0.00013 0.00013 234 4ZZ 0.00147 -0.00247 0.00074 0.00006 0.00089 235 4XY 0.00167 0.00002 -0.00103 -0.00061 0.00165 236 4XZ 0.00012 0.00164 -0.00055 -0.00020 0.00010 237 4YZ 0.00182 -0.00137 -0.00018 -0.00064 0.00110 238 21 C 1S 0.01226 0.00631 -0.00203 -0.00610 0.00585 239 2S -0.03161 -0.01642 -0.01527 0.00000 -0.01779 240 2PX 0.03408 0.01528 0.04177 -0.01705 0.03366 241 2PY 0.00867 0.04890 0.03920 -0.00011 0.01379 242 2PZ 0.04674 -0.05621 0.01878 -0.00600 0.04046 243 3S -0.04079 -0.02126 -0.00035 0.00150 -0.02297 244 3PX 0.03502 0.01731 0.02174 0.00391 0.01715 245 3PY -0.02510 0.02336 0.00257 -0.00421 -0.00754 246 3PZ 0.02192 -0.05775 -0.00041 -0.00701 0.02242 247 4XX -0.00225 -0.00155 -0.00270 0.00011 -0.00185 248 4YY 0.00521 0.00239 0.00235 -0.00005 0.00305 249 4ZZ 0.00109 0.00124 0.00092 -0.00015 0.00063 250 4XY 0.00407 0.00684 0.00306 0.00236 0.00029 251 4XZ 0.00692 -0.00469 0.00192 0.00100 0.00326 252 4YZ 0.00311 0.00178 0.00111 0.00014 0.00138 253 22 H 1S 0.02864 0.01518 0.02880 -0.00081 0.02235 254 2S 0.05443 0.02933 0.02938 0.00378 0.02912 255 23 H 1S 0.00161 0.00102 0.01884 0.00552 0.00253 256 2S 0.00198 0.00118 0.01577 0.00721 0.00310 257 24 H 1S -0.01682 -0.00995 0.03987 0.01897 -0.01938 258 2S -0.02354 -0.01396 0.03200 0.02207 -0.02026 259 25 H 1S 0.03500 0.01883 -0.04973 -0.00060 0.00793 260 2S 0.06143 0.03190 -0.03649 -0.00248 0.01633 261 26 H 1S -0.08922 -0.03910 0.12480 -0.09679 -0.02397 262 2S -0.06028 -0.02135 0.03179 -0.05277 -0.01128 263 27 H 1S 0.03339 0.01450 0.04520 0.01330 0.02003 264 2S 0.05678 0.02707 0.04298 0.00563 0.02964 186 187 188 189 190 186 3PZ 0.10914 187 4XX -0.00147 0.00163 188 4YY 0.00166 -0.00071 0.00125 189 4ZZ 0.00002 -0.00027 0.00023 0.00103 190 4XY -0.00146 0.00034 -0.00016 -0.00010 0.00109 191 4XZ 0.00481 0.00014 0.00011 -0.00019 0.00034 192 4YZ 0.00093 -0.00042 0.00011 0.00011 0.00008 193 18 C 1S 0.00542 -0.00269 0.00000 0.00113 0.00483 194 2S -0.01111 0.00427 -0.00138 -0.00308 -0.00952 195 2PX 0.04660 0.00757 0.00049 0.00257 0.00794 196 2PY -0.07694 0.00893 -0.01329 -0.00300 -0.00013 197 2PZ 0.11545 0.00518 -0.00110 -0.00813 -0.00644 198 3S -0.00730 0.00133 0.00041 -0.00102 -0.00985 199 3PX 0.01398 0.00160 0.00030 0.00035 0.00270 200 3PY -0.04656 0.00259 -0.00539 0.00021 0.00100 201 3PZ 0.07493 0.00170 0.00141 -0.00445 -0.00346 202 4XX -0.00103 0.00092 -0.00061 -0.00032 0.00042 203 4YY -0.00232 -0.00086 0.00059 0.00030 0.00004 204 4ZZ 0.00424 -0.00036 0.00028 0.00014 0.00010 205 4XY 0.00325 0.00023 0.00008 0.00038 0.00020 206 4XZ -0.00265 0.00008 0.00026 0.00002 0.00011 207 4YZ 0.00300 -0.00041 0.00041 -0.00005 -0.00039 208 19 C 1S -0.00355 -0.00215 0.00111 0.00040 -0.00030 209 2S 0.00656 0.00487 -0.00214 -0.00054 0.00077 210 2PX -0.02282 -0.01247 0.00450 0.00151 -0.00060 211 2PY -0.00944 -0.00280 -0.00129 0.00319 0.00096 212 2PZ 0.01885 -0.00095 0.00520 -0.00466 -0.00345 213 3S 0.00390 0.00534 -0.00317 -0.00094 0.00137 214 3PX -0.00656 -0.00449 0.00167 0.00053 -0.00106 215 3PY -0.00485 -0.00127 -0.00148 0.00169 -0.00028 216 3PZ 0.00871 -0.00043 0.00311 -0.00327 -0.00252 217 4XX -0.00084 0.00027 -0.00029 -0.00019 -0.00034 218 4YY 0.00315 -0.00040 0.00035 0.00009 0.00001 219 4ZZ -0.00330 -0.00025 0.00010 0.00012 0.00006 220 4XY 0.00388 0.00020 0.00023 -0.00002 -0.00005 221 4XZ -0.00443 0.00007 -0.00007 0.00022 0.00022 222 4YZ -0.00263 -0.00015 0.00008 0.00010 0.00004 223 20 C 1S 0.00050 0.00025 -0.00033 -0.00034 0.00018 224 2S -0.00102 -0.00083 0.00069 0.00052 -0.00062 225 2PX 0.00184 0.00012 -0.00000 -0.00014 0.00122 226 2PY 0.03720 0.00157 -0.00124 -0.00049 -0.00110 227 2PZ -0.06990 0.00085 -0.00064 -0.00048 -0.00095 228 3S -0.00152 0.00008 0.00110 0.00109 -0.00089 229 3PX -0.00098 -0.00054 0.00025 -0.00017 0.00082 230 3PY 0.02686 0.00131 -0.00128 -0.00030 -0.00113 231 3PZ -0.05207 0.00071 -0.00038 -0.00059 -0.00061 232 4XX -0.00047 0.00032 -0.00008 -0.00005 0.00028 233 4YY 0.00213 -0.00007 0.00021 -0.00024 -0.00023 234 4ZZ -0.00162 -0.00005 -0.00023 0.00024 0.00007 235 4XY -0.00004 0.00032 -0.00018 0.00002 0.00008 236 4XZ 0.00172 0.00016 0.00005 -0.00012 0.00005 237 4YZ -0.00088 -0.00005 -0.00017 0.00017 0.00002 238 21 C 1S 0.00332 -0.00073 0.00011 0.00006 -0.00147 239 2S -0.00958 0.00190 -0.00020 0.00010 0.00294 240 2PX 0.01661 -0.00444 -0.00023 0.00002 -0.00806 241 2PY 0.04538 -0.00154 0.00218 -0.00282 -0.00412 242 2PZ -0.04651 -0.00086 -0.00542 0.00512 -0.00081 243 3S -0.01288 0.00187 -0.00067 0.00005 0.00459 244 3PX 0.00848 -0.00317 0.00082 0.00019 -0.00287 245 3PY 0.02560 0.00018 0.00126 -0.00177 -0.00300 246 3PZ -0.04234 0.00006 -0.00370 0.00345 -0.00040 247 4XX -0.00120 0.00011 0.00013 0.00003 0.00009 248 4YY 0.00091 -0.00028 0.00000 0.00002 -0.00020 249 4ZZ 0.00127 -0.00011 0.00003 -0.00003 -0.00013 250 4XY 0.00317 -0.00017 0.00001 0.00010 0.00032 251 4XZ -0.00377 -0.00010 0.00036 -0.00032 0.00017 252 4YZ 0.00118 -0.00016 0.00009 -0.00006 0.00000 253 22 H 1S 0.01220 -0.00170 -0.00004 -0.00009 -0.00181 254 2S 0.01585 -0.00279 0.00079 -0.00016 -0.00120 255 23 H 1S 0.00129 0.00133 -0.00041 -0.00016 0.00090 256 2S 0.00143 0.00235 -0.00090 -0.00035 0.00151 257 24 H 1S -0.01096 -0.00272 0.00012 -0.00004 -0.00030 258 2S -0.01136 -0.00283 0.00000 -0.00025 -0.00115 259 25 H 1S 0.00379 -0.00663 0.00758 0.00273 -0.00257 260 2S 0.00734 -0.00674 0.00638 0.00251 -0.00017 261 26 H 1S -0.00962 0.01297 -0.00677 -0.00645 0.00899 262 2S -0.00208 0.00961 -0.00438 -0.00246 0.00682 263 27 H 1S 0.00760 -0.00064 -0.00089 -0.00083 0.00162 264 2S 0.01325 -0.00152 -0.00005 -0.00074 0.00162 191 192 193 194 195 191 4XZ 0.00057 192 4YZ -0.00007 0.00059 193 18 C 1S 0.00273 -0.00126 2.05285 194 2S -0.00534 0.00203 -0.06392 0.33169 195 2PX 0.00440 -0.00261 0.00192 -0.00140 0.41799 196 2PY -0.00643 -0.00243 0.00425 -0.00323 0.00122 197 2PZ 0.00746 -0.00553 0.00223 -0.00141 -0.00174 198 3S -0.00553 0.00189 -0.17170 0.26445 -0.01013 199 3PX 0.00159 -0.00041 -0.00118 0.00006 0.11056 200 3PY -0.00348 -0.00025 0.00207 -0.02253 -0.00397 201 3PZ 0.00509 -0.00319 0.00121 -0.01213 0.00052 202 4XX 0.00017 -0.00028 -0.01643 -0.00432 0.00693 203 4YY -0.00025 0.00041 -0.01895 -0.00051 -0.00578 204 4ZZ 0.00038 -0.00003 -0.01359 -0.01146 -0.00159 205 4XY 0.00013 -0.00007 -0.00072 0.00125 0.01457 206 4XZ 0.00006 -0.00018 -0.00026 0.00034 0.00766 207 4YZ 0.00004 0.00029 -0.00464 0.00949 -0.00388 208 19 C 1S -0.00009 0.00064 0.01618 -0.03279 -0.07318 209 2S 0.00024 -0.00142 -0.03307 0.05800 0.15479 210 2PX 0.00027 0.00237 0.07392 -0.15159 -0.28339 211 2PY -0.00325 0.00251 0.02394 -0.05305 -0.10455 212 2PZ 0.00533 -0.00309 0.01135 -0.02552 -0.04531 213 3S 0.00062 -0.00211 0.00865 0.01493 0.11974 214 3PX -0.00034 0.00088 0.00808 -0.03501 -0.08618 215 3PY -0.00238 0.00144 0.00364 -0.00314 -0.04810 216 3PZ 0.00296 -0.00215 0.00184 -0.00107 -0.02135 217 4XX -0.00021 -0.00005 -0.00560 0.00981 0.00147 218 4YY 0.00010 0.00009 0.00159 -0.00451 -0.00692 219 4ZZ -0.00002 0.00009 0.00182 -0.00445 -0.00621 220 4XY 0.00019 -0.00000 -0.00373 0.00702 0.00850 221 4XZ -0.00031 0.00015 -0.00180 0.00338 0.00408 222 4YZ -0.00004 0.00009 -0.00003 -0.00040 -0.00117 223 20 C 1S 0.00009 0.00002 -0.00303 0.00796 0.01020 224 2S -0.00030 0.00016 0.00786 -0.01797 -0.02896 225 2PX 0.00066 0.00010 -0.00845 0.02034 0.02710 226 2PY -0.00103 -0.00049 -0.01061 0.02905 0.03271 227 2PZ 0.00012 -0.00038 -0.00558 0.01511 0.01716 228 3S -0.00054 -0.00005 -0.00701 -0.00480 -0.00358 229 3PX 0.00047 0.00035 0.00513 0.00001 -0.01149 230 3PY -0.00062 -0.00054 -0.00436 0.01402 0.01178 231 3PZ -0.00032 -0.00062 -0.00248 0.00743 0.00644 232 4XX 0.00014 -0.00005 -0.00080 0.00211 0.00447 233 4YY 0.00014 -0.00018 0.00011 -0.00017 0.00079 234 4ZZ -0.00022 0.00017 0.00010 0.00003 -0.00042 235 4XY 0.00004 -0.00001 -0.00159 0.00328 0.00774 236 4XZ -0.00002 -0.00011 -0.00084 0.00174 0.00410 237 4YZ -0.00018 0.00012 0.00008 -0.00030 0.00037 238 21 C 1S -0.00076 0.00006 -0.00324 0.00553 0.00243 239 2S 0.00150 -0.00027 0.00566 -0.01182 -0.00513 240 2PX -0.00423 0.00024 -0.00127 0.00401 -0.03019 241 2PY -0.00104 -0.00242 -0.00740 0.01609 0.00960 242 2PZ -0.00245 0.00357 -0.00410 0.00876 0.00324 243 3S 0.00238 -0.00074 0.02134 -0.03028 -0.03092 244 3PX -0.00150 0.00109 -0.00017 0.00110 -0.01159 245 3PY -0.00059 -0.00171 -0.01212 0.01766 0.00228 246 3PZ -0.00223 0.00226 -0.00670 0.00971 -0.00072 247 4XX 0.00004 0.00007 -0.00036 0.00091 0.00063 248 4YY -0.00002 0.00011 0.00006 -0.00049 -0.00068 249 4ZZ -0.00014 -0.00004 -0.00025 0.00019 -0.00023 250 4XY 0.00018 0.00029 0.00007 -0.00024 0.00243 251 4XZ 0.00008 -0.00012 0.00005 -0.00017 0.00136 252 4YZ -0.00005 0.00003 0.00029 -0.00062 -0.00053 253 22 H 1S -0.00091 0.00011 -0.00116 0.00262 -0.00041 254 2S -0.00049 0.00068 0.00218 -0.00337 0.00344 255 23 H 1S 0.00043 -0.00025 -0.00779 0.01820 0.03294 256 2S 0.00072 -0.00052 -0.01052 0.02193 0.05392 257 24 H 1S -0.00007 0.00015 0.01269 -0.02703 -0.04726 258 2S -0.00050 0.00026 0.01362 -0.02407 -0.07811 259 25 H 1S -0.00113 0.00433 -0.06266 0.12032 -0.04057 260 2S 0.00014 0.00336 -0.01412 0.02766 -0.03322 261 26 H 1S 0.00405 -0.00082 0.01259 -0.02742 0.04393 262 2S 0.00347 -0.00217 0.01457 -0.02628 0.08251 263 27 H 1S 0.00084 -0.00045 0.00322 -0.00747 0.00927 264 2S 0.00082 0.00031 0.00497 -0.01071 0.02005 196 197 198 199 200 196 2PY 0.41417 197 2PZ 0.04827 0.35040 198 3S -0.02487 -0.01751 0.24721 199 3PX 0.00311 0.00377 -0.00565 0.03535 200 3PY 0.16393 -0.02727 -0.01867 -0.00246 0.07525 201 3PZ -0.02435 0.19405 -0.01298 0.00105 -0.03447 202 4XX 0.00970 0.00487 -0.00531 0.00151 0.00347 203 4YY -0.00948 -0.01327 0.00259 -0.00152 -0.00191 204 4ZZ -0.00670 0.00491 -0.00757 -0.00030 -0.00257 205 4XY -0.00638 -0.00336 0.00197 0.00303 -0.00200 206 4XZ -0.00353 -0.00236 0.00100 0.00158 -0.00093 207 4YZ -0.01071 0.00067 0.00849 -0.00094 -0.00491 208 19 C 1S -0.02683 -0.01253 0.00837 -0.00881 -0.00180 209 2S 0.05344 0.02448 0.01737 0.02768 0.01933 210 2PX -0.10406 -0.04427 -0.13521 -0.07431 -0.02662 211 2PY 0.02051 -0.09269 -0.00856 -0.04253 0.03812 212 2PZ -0.09314 0.14740 -0.00299 -0.01851 -0.04601 213 3S 0.06411 0.03408 -0.02314 0.01856 0.02219 214 3PX -0.02614 -0.01004 -0.02882 -0.02162 -0.00605 215 3PY 0.03337 -0.04428 0.00874 -0.01539 0.02324 216 3PZ -0.04603 0.09576 0.00466 -0.00622 -0.02830 217 4XX 0.00908 0.00440 0.00645 0.00132 0.00189 218 4YY -0.01009 -0.00166 -0.00294 -0.00235 -0.00365 219 4ZZ -0.00291 -0.00451 -0.00228 -0.00149 -0.00019 220 4XY -0.00843 0.00181 0.00875 0.00281 -0.00381 221 4XZ 0.00178 -0.01154 0.00466 0.00127 0.00228 222 4YZ -0.00240 -0.00415 -0.00080 -0.00099 -0.00006 223 20 C 1S 0.00957 0.00489 -0.00710 0.00634 -0.00350 224 2S -0.02348 -0.01196 -0.00423 -0.01636 -0.00273 225 2PX 0.01299 0.00583 0.04812 0.03962 0.00384 226 2PY 0.02519 0.02139 0.01181 0.02013 -0.01126 227 2PZ 0.02199 -0.00451 0.00673 0.00997 0.00635 228 3S -0.04429 -0.02544 0.02188 -0.00863 -0.00847 229 3PX -0.00550 -0.00244 0.00719 0.00832 -0.00243 230 3PY 0.02711 0.02648 0.00816 0.00593 0.00144 231 3PZ 0.02563 -0.00544 0.00540 0.00286 0.01205 232 4XX 0.00183 0.00087 0.00125 0.00284 -0.00015 233 4YY -0.00243 0.00674 -0.00031 -0.00041 -0.00160 234 4ZZ 0.00354 -0.00618 0.00001 -0.00018 0.00238 235 4XY 0.00375 0.00115 0.00440 0.00268 0.00180 236 4XZ 0.00152 0.00146 0.00235 0.00140 0.00036 237 4YZ 0.00307 -0.00431 -0.00033 -0.00054 0.00213 238 21 C 1S 0.00676 0.00391 0.02377 0.00227 0.01030 239 2S -0.01399 -0.00847 -0.03164 -0.00358 -0.01216 240 2PX 0.00995 0.00479 0.01092 -0.02798 0.00191 241 2PY -0.00596 0.05752 0.04501 0.00701 -0.01042 242 2PZ 0.05696 -0.08015 0.02605 0.00288 0.04247 243 3S -0.04702 -0.02497 -0.05420 -0.00849 -0.02263 244 3PX 0.00710 0.00108 0.00244 -0.00695 0.00143 245 3PY -0.00086 0.04638 0.02938 -0.00062 -0.00751 246 3PZ 0.04819 -0.06451 0.01725 -0.00144 0.03312 247 4XX 0.00049 0.00019 0.00150 0.00095 0.00015 248 4YY -0.00063 0.00054 0.00042 -0.00068 0.00015 249 4ZZ 0.00040 -0.00058 0.00095 -0.00024 0.00034 250 4XY -0.00055 -0.00041 -0.00081 0.00211 -0.00047 251 4XZ -0.00046 -0.00002 -0.00039 0.00117 -0.00037 252 4YZ -0.00012 -0.00058 -0.00051 -0.00050 -0.00006 253 22 H 1S 0.00353 0.00230 0.01534 -0.00052 0.00102 254 2S -0.00522 -0.00041 0.00895 0.00172 -0.00049 255 23 H 1S 0.01348 0.00625 0.03226 0.02755 0.00183 256 2S 0.02533 0.01180 0.02605 0.03065 0.00487 257 24 H 1S 0.00351 0.00329 -0.05717 -0.01221 -0.00249 258 2S 0.01072 0.00843 -0.04331 -0.01890 -0.00017 259 25 H 1S -0.23635 -0.12564 0.11838 -0.01320 -0.08665 260 2S -0.17531 -0.09423 0.03884 -0.01096 -0.05917 261 26 H 1S -0.00757 -0.00519 -0.04351 0.00673 -0.00065 262 2S -0.01482 -0.00446 -0.03704 0.01805 -0.00635 263 27 H 1S -0.00901 -0.00434 -0.01865 0.00997 -0.00823 264 2S -0.01498 -0.00880 -0.01387 0.00990 -0.00720 201 202 203 204 205 201 3PZ 0.11587 202 4XX 0.00170 0.00129 203 4YY -0.00617 -0.00068 0.00126 204 4ZZ 0.00394 0.00002 0.00019 0.00078 205 4XY -0.00085 -0.00003 0.00009 -0.00001 0.00103 206 4XZ -0.00076 -0.00003 0.00010 -0.00003 0.00032 207 4YZ 0.00134 -0.00061 0.00045 -0.00003 0.00009 208 19 C 1S -0.00063 -0.00590 0.00185 0.00187 -0.00349 209 2S 0.00935 0.01015 -0.00473 -0.00452 0.00726 210 2PX -0.00960 -0.00046 0.00529 0.00616 -0.01117 211 2PY -0.04492 -0.00750 0.01006 0.00103 0.00654 212 2PZ 0.09828 -0.00387 0.00009 0.00546 -0.00025 213 3S 0.01307 0.01067 -0.00592 -0.00315 0.00486 214 3PX -0.00154 -0.00000 0.00163 0.00157 -0.00361 215 3PY -0.02691 -0.00318 0.00376 -0.00057 0.00175 216 3PZ 0.06025 -0.00161 -0.00108 0.00262 -0.00159 217 4XX 0.00070 0.00033 -0.00051 -0.00042 -0.00041 218 4YY 0.00077 -0.00039 0.00047 0.00032 0.00016 219 4ZZ -0.00243 -0.00037 0.00030 0.00023 -0.00032 220 4XY 0.00209 -0.00050 0.00018 0.00001 0.00065 221 4XZ -0.00680 -0.00028 0.00044 -0.00030 0.00031 222 4YZ -0.00214 0.00004 0.00022 -0.00003 0.00006 223 20 C 1S -0.00206 0.00073 -0.00109 -0.00024 -0.00124 224 2S -0.00109 -0.00153 0.00267 0.00083 0.00246 225 2PX 0.00046 -0.00020 -0.00165 -0.00037 -0.00210 226 2PY 0.00489 0.00139 -0.00482 -0.00136 -0.00386 227 2PZ -0.01742 0.00122 -0.00353 -0.00028 -0.00750 228 3S -0.00532 -0.00217 0.00250 0.00070 0.00351 229 3PX -0.00157 -0.00061 0.00017 0.00020 -0.00134 230 3PY 0.01186 0.00116 -0.00248 -0.00071 -0.00031 231 3PZ -0.01178 0.00096 -0.00158 -0.00051 -0.00380 232 4XX -0.00014 0.00005 -0.00028 -0.00010 -0.00014 233 4YY 0.00447 0.00018 -0.00014 0.00010 0.00006 234 4ZZ -0.00408 0.00005 0.00009 -0.00013 -0.00001 235 4XY 0.00017 -0.00000 -0.00011 -0.00012 0.00036 236 4XZ 0.00115 -0.00001 0.00001 -0.00011 0.00031 237 4YZ -0.00276 0.00012 0.00014 -0.00012 0.00020 238 21 C 1S 0.00575 -0.00038 0.00017 -0.00024 0.00013 239 2S -0.00725 0.00106 -0.00077 0.00011 -0.00040 240 2PX 0.00089 -0.00112 0.00069 0.00038 -0.00260 241 2PY 0.04133 -0.00055 0.00008 0.00028 0.00165 242 2PZ -0.06295 0.00000 0.00048 -0.00061 -0.00133 243 3S -0.01244 0.00130 0.00032 0.00078 -0.00048 244 3PX -0.00124 -0.00074 0.00039 0.00022 -0.00217 245 3PY 0.03100 0.00009 -0.00102 -0.00007 0.00089 246 3PZ -0.04925 0.00026 0.00026 -0.00108 -0.00101 247 4XX 0.00002 0.00006 -0.00017 -0.00005 -0.00011 248 4YY 0.00029 -0.00018 0.00022 0.00012 0.00007 249 4ZZ 0.00005 -0.00006 0.00013 -0.00004 0.00012 250 4XY -0.00043 -0.00009 0.00008 0.00006 0.00005 251 4XZ 0.00013 -0.00003 0.00010 -0.00004 -0.00026 252 4YZ -0.00008 -0.00012 0.00024 0.00001 0.00015 253 22 H 1S 0.00082 -0.00073 0.00104 0.00032 0.00047 254 2S 0.00143 -0.00171 0.00223 0.00067 0.00088 255 23 H 1S 0.00017 -0.00007 -0.00169 -0.00055 -0.00091 256 2S 0.00153 0.00080 -0.00247 -0.00096 -0.00036 257 24 H 1S -0.00089 0.00700 -0.00322 -0.00029 -0.00564 258 2S 0.00087 0.00322 -0.00186 0.00031 -0.00630 259 25 H 1S -0.04594 -0.00972 0.01066 -0.00124 0.00384 260 2S -0.03191 -0.00750 0.00887 0.00117 0.00289 261 26 H 1S -0.00055 0.00961 -0.00515 -0.00104 0.00142 262 2S 0.00016 0.00641 -0.00413 -0.00038 0.00363 263 27 H 1S -0.00393 -0.00061 0.00111 0.00029 -0.00029 264 2S -0.00423 -0.00096 0.00172 0.00051 0.00002 206 207 208 209 210 206 4XZ 0.00061 207 4YZ 0.00005 0.00077 208 19 C 1S -0.00167 0.00012 2.05387 209 2S 0.00351 -0.00047 -0.06907 0.34654 210 2PX -0.00563 -0.00010 -0.00285 0.00004 0.44605 211 2PY -0.00038 0.00217 0.00196 0.00030 -0.00640 212 2PZ 0.00770 0.00537 0.00121 -0.00018 -0.00674 213 3S 0.00223 -0.00246 -0.17511 0.27846 0.02323 214 3PX -0.00176 0.00027 -0.00177 0.01844 0.14397 215 3PY -0.00164 0.00057 0.00149 -0.01363 -0.00888 216 3PZ 0.00412 0.00279 0.00095 -0.00821 -0.00367 217 4XX -0.00024 -0.00008 -0.01898 0.00028 -0.00386 218 4YY -0.00022 0.00022 -0.01654 -0.00467 0.00758 219 4ZZ 0.00016 0.00000 -0.01286 -0.01277 0.00222 220 4XY 0.00033 0.00045 0.00215 -0.00372 -0.01572 221 4XZ 0.00024 0.00000 0.00136 -0.00242 -0.00851 222 4YZ 0.00027 0.00012 -0.00336 0.00735 0.00557 223 20 C 1S -0.00069 -0.00069 0.01626 -0.03317 -0.01242 224 2S 0.00138 0.00150 -0.03298 0.05820 0.03023 225 2PX -0.00091 -0.00102 0.01484 -0.02719 0.00420 226 2PY -0.00761 -0.00361 0.06843 -0.14427 -0.05305 227 2PZ 0.00592 -0.00113 0.03709 -0.07830 -0.02454 228 3S 0.00198 0.00131 0.00852 0.01664 -0.01460 229 3PX -0.00056 0.00006 -0.00027 -0.01465 0.02393 230 3PY -0.00386 -0.00156 0.00806 -0.02821 -0.02436 231 3PZ 0.00466 -0.00061 0.00448 -0.01519 -0.01111 232 4XX -0.00009 -0.00016 0.00289 -0.00707 -0.00629 233 4YY 0.00017 0.00012 -0.00486 0.00841 0.00355 234 4ZZ -0.00015 -0.00014 -0.00016 -0.00053 0.00089 235 4XY 0.00031 0.00004 -0.00170 0.00377 -0.01061 236 4XZ -0.00005 -0.00002 -0.00095 0.00213 -0.00572 237 4YZ -0.00001 -0.00004 -0.00415 0.00789 0.00244 238 21 C 1S 0.00008 0.00036 -0.00305 0.00858 -0.00361 239 2S -0.00026 -0.00078 0.00846 -0.02064 0.00766 240 2PX -0.00124 0.00038 0.00727 -0.01979 0.01147 241 2PY -0.00140 0.00040 -0.01166 0.03111 -0.00473 242 2PZ 0.00349 -0.00017 -0.00663 0.01776 -0.00218 243 3S -0.00022 -0.00043 -0.00646 -0.00754 0.06296 244 3PX -0.00117 0.00021 0.00746 -0.01621 0.01699 245 3PY -0.00113 0.00005 0.00228 0.00714 -0.01724 246 3PZ 0.00223 -0.00064 0.00103 0.00447 -0.00972 247 4XX -0.00004 -0.00011 0.00140 -0.00283 -0.00057 248 4YY 0.00022 0.00023 -0.00164 0.00387 0.00049 249 4ZZ -0.00013 -0.00000 -0.00041 0.00121 0.00010 250 4XY -0.00026 0.00008 0.00051 -0.00100 0.00010 251 4XZ 0.00039 0.00002 0.00025 -0.00048 0.00028 252 4YZ -0.00003 0.00009 -0.00113 0.00242 0.00016 253 22 H 1S 0.00028 0.00060 -0.00822 0.01968 0.00352 254 2S 0.00059 0.00140 -0.01122 0.02378 0.00339 255 23 H 1S -0.00051 -0.00096 0.01275 -0.02792 -0.02797 256 2S -0.00024 -0.00132 0.01398 -0.02514 -0.05382 257 24 H 1S -0.00321 -0.00231 -0.06164 0.11941 0.21264 258 2S -0.00345 -0.00159 -0.01115 0.02187 0.15575 259 25 H 1S 0.00222 0.01009 0.01285 -0.02821 0.03303 260 2S 0.00179 0.00644 0.01413 -0.02558 0.05229 261 26 H 1S 0.00042 -0.00360 -0.00816 0.01937 -0.03534 262 2S 0.00167 -0.00315 -0.01124 0.02355 -0.05861 263 27 H 1S 0.00007 0.00062 0.00081 -0.00207 0.00144 264 2S 0.00024 0.00094 -0.00002 0.00012 -0.00259 211 212 213 214 215 211 2PY 0.40430 212 2PZ 0.07173 0.31180 213 3S -0.01886 -0.00997 0.24819 214 3PX -0.00884 -0.00425 0.02082 0.05137 215 3PY 0.14547 -0.01168 -0.01656 -0.00364 0.06129 216 3PZ -0.01232 0.16248 -0.00910 -0.00070 -0.02304 217 4XX -0.01448 -0.00805 0.00145 -0.00034 -0.00354 218 4YY 0.00971 0.00047 -0.00341 0.00143 0.00309 219 4ZZ 0.00044 0.00511 -0.00932 -0.00011 -0.00022 220 4XY 0.00627 0.00738 -0.00594 -0.00489 0.00182 221 4XZ 0.00732 -0.00232 -0.00366 -0.00269 0.00318 222 4YZ 0.00307 0.00489 0.00537 0.00171 -0.00019 223 20 C 1S -0.06847 -0.03698 0.00807 -0.00246 -0.00782 224 2S 0.14166 0.07633 0.01606 -0.00304 0.03135 225 2PX -0.05137 -0.02357 -0.04876 0.02140 -0.00746 226 2PY -0.19875 -0.21717 -0.11317 -0.02878 -0.04599 227 2PZ -0.21741 0.08425 -0.06194 -0.01308 -0.09243 228 3S 0.11684 0.06306 -0.02110 -0.01436 0.02391 229 3PX -0.00702 -0.00113 -0.02201 0.01154 -0.00019 230 3PY -0.03877 -0.08866 -0.01995 -0.00944 -0.00178 231 3PZ -0.09006 0.07859 -0.01133 -0.00342 -0.04364 232 4XX -0.00923 -0.00511 -0.00787 -0.00256 -0.00300 233 4YY -0.00071 0.00684 0.00842 0.00223 -0.00102 234 4ZZ -0.00023 -0.00727 0.00097 0.00091 0.00127 235 4XY 0.00529 0.00567 0.00093 -0.00267 0.00150 236 4XZ 0.00573 -0.00190 0.00069 -0.00144 0.00247 237 4YZ 0.00705 -0.00172 0.00653 0.00110 0.00268 238 21 C 1S 0.01295 0.00730 -0.00721 0.00714 0.00170 239 2S -0.03539 -0.02016 -0.00543 -0.00736 -0.01211 240 2PX -0.02693 -0.01288 -0.00122 -0.00688 -0.00957 241 2PY 0.04974 -0.00120 0.04753 0.02304 0.03611 242 2PZ -0.00026 0.05152 0.02451 0.01350 0.00492 243 3S -0.01844 -0.01073 0.01515 0.01133 -0.00588 244 3PX -0.04050 -0.02376 -0.00974 0.00274 -0.01206 245 3PY 0.01379 -0.00654 0.01371 0.00309 0.01179 246 3PZ -0.00373 0.01959 0.00665 0.00198 0.00043 247 4XX -0.00468 -0.00223 -0.00439 -0.00020 -0.00206 248 4YY 0.00626 0.00826 0.00418 0.00082 0.00206 249 4ZZ 0.00443 -0.00278 0.00123 0.00038 0.00220 250 4XY -0.00114 -0.00564 -0.00086 0.00082 0.00099 251 4XZ -0.00544 0.00603 -0.00041 0.00063 -0.00262 252 4YZ 0.00696 0.00042 0.00269 0.00023 0.00295 253 22 H 1S 0.03223 0.01756 0.03577 0.01326 0.02202 254 2S 0.05149 0.03002 0.02933 0.01124 0.02472 255 23 H 1S -0.03421 -0.01806 -0.05187 -0.00576 -0.01034 256 2S -0.05606 -0.02954 -0.03806 -0.01302 -0.01530 257 24 H 1S -0.15306 -0.08750 0.11975 0.07656 -0.05485 258 2S -0.11234 -0.06396 0.03416 0.05145 -0.03684 259 25 H 1S 0.03050 0.01653 -0.05300 0.01082 0.00682 260 2S 0.05662 0.03001 -0.03964 0.01497 0.01377 261 26 H 1S -0.00979 -0.00502 0.03676 -0.02279 -0.01609 262 2S -0.01459 -0.00523 0.03158 -0.02748 -0.01508 263 27 H 1S -0.00232 0.00171 -0.00234 0.00310 0.00080 264 2S -0.00069 0.00222 -0.00137 0.00114 0.00028 216 217 218 219 220 216 3PZ 0.09253 217 4XX -0.00208 0.00122 218 4YY -0.00117 -0.00044 0.00106 219 4ZZ 0.00289 -0.00008 0.00015 0.00093 220 4XY 0.00327 -0.00024 0.00008 0.00007 0.00148 221 4XZ -0.00213 -0.00014 -0.00011 0.00021 0.00056 222 4YZ 0.00190 -0.00030 0.00005 0.00004 -0.00021 223 20 C 1S -0.00419 0.00270 -0.00472 -0.00009 -0.00201 224 2S 0.01707 -0.00678 0.00814 -0.00061 0.00359 225 2PX -0.00182 0.00613 -0.00425 0.00003 0.01128 226 2PY -0.09185 0.01030 0.00210 -0.00155 -0.00299 227 2PZ 0.07347 0.00552 -0.00964 0.00999 -0.00261 228 3S 0.01276 -0.00607 0.00669 0.00061 0.00623 229 3PX 0.00166 0.00139 -0.00028 0.00045 0.00341 230 3PY -0.04266 0.00359 0.00168 -0.00263 -0.00064 231 3PZ 0.05472 0.00196 -0.00612 0.00555 -0.00110 232 4XX -0.00171 0.00051 -0.00011 0.00012 0.00037 233 4YY 0.00401 -0.00008 -0.00011 -0.00026 -0.00013 234 4ZZ -0.00384 0.00016 -0.00027 0.00003 -0.00032 235 4XY 0.00234 -0.00002 -0.00035 -0.00001 0.00088 236 4XZ -0.00162 -0.00002 0.00015 -0.00036 0.00049 237 4YZ -0.00203 -0.00019 0.00009 -0.00021 -0.00017 238 21 C 1S 0.00089 0.00036 -0.00085 -0.00020 0.00170 239 2S -0.00691 -0.00032 0.00192 0.00069 -0.00390 240 2PX -0.00392 -0.00045 0.00348 0.00129 -0.00577 241 2PY 0.00462 0.00072 -0.00021 -0.00490 0.00615 242 2PZ 0.02878 0.00057 -0.00953 0.00644 0.00117 243 3S -0.00279 -0.00170 0.00198 0.00069 -0.00426 244 3PX -0.00770 0.00138 0.00054 0.00053 -0.00305 245 3PY -0.00095 0.00074 0.00101 -0.00286 0.00229 246 3PZ 0.01020 0.00051 -0.00559 0.00440 -0.00054 247 4XX -0.00092 0.00028 -0.00003 0.00006 0.00021 248 4YY 0.00398 -0.00034 -0.00016 0.00012 0.00012 249 4ZZ -0.00190 -0.00006 0.00014 -0.00023 0.00009 250 4XY -0.00274 0.00021 -0.00015 -0.00016 0.00017 251 4XZ 0.00443 0.00011 -0.00039 0.00021 0.00007 252 4YZ -0.00037 -0.00026 0.00024 -0.00018 -0.00000 253 22 H 1S 0.01180 -0.00074 -0.00133 -0.00047 0.00159 254 2S 0.01459 -0.00173 -0.00069 -0.00050 0.00227 255 23 H 1S -0.00559 0.00367 -0.00037 0.00023 0.00794 256 2S -0.00824 0.00435 -0.00245 -0.00013 0.00588 257 24 H 1S -0.03123 0.00546 -0.00126 -0.00435 -0.01363 258 2S -0.02074 0.00426 -0.00022 -0.00109 -0.01041 259 25 H 1S 0.00389 -0.00353 0.00524 0.00186 0.00647 260 2S 0.00744 -0.00539 0.00508 0.00212 0.00385 261 26 H 1S -0.00871 -0.00220 -0.00019 -0.00013 0.00120 262 2S -0.00681 -0.00166 -0.00060 -0.00062 0.00227 263 27 H 1S 0.00271 -0.00050 0.00042 0.00007 -0.00013 264 2S 0.00209 -0.00081 0.00039 0.00008 0.00015 221 222 223 224 225 221 4XZ 0.00079 222 4YZ 0.00003 0.00058 223 20 C 1S -0.00112 -0.00409 2.05282 224 2S 0.00202 0.00772 -0.06368 0.33116 225 2PX 0.00608 -0.00382 -0.00459 0.00368 0.43813 226 2PY -0.00275 -0.00821 -0.00231 0.00091 0.00567 227 2PZ 0.00033 0.00371 -0.00120 0.00045 0.00053 228 3S 0.00356 0.00527 -0.17090 0.26212 0.03199 229 3PX 0.00186 -0.00051 -0.00303 0.02646 0.14472 230 3PY -0.00132 -0.00365 0.00019 0.00532 0.00896 231 3PZ 0.00091 0.00327 0.00015 0.00230 0.00639 232 4XX 0.00019 -0.00025 -0.02069 0.00319 0.01188 233 4YY -0.00036 0.00009 -0.01566 -0.00635 -0.00321 234 4ZZ 0.00012 -0.00019 -0.01266 -0.01307 -0.00156 235 4XY 0.00052 0.00004 -0.00165 0.00290 0.01456 236 4XZ 0.00021 -0.00024 -0.00066 0.00108 0.00742 237 4YZ 0.00012 0.00030 -0.00263 0.00594 -0.00215 238 21 C 1S 0.00091 -0.00068 0.01728 -0.03525 0.06371 239 2S -0.00207 0.00130 -0.03571 0.06281 -0.13165 240 2PX -0.00307 0.00256 -0.06234 0.12799 -0.18473 241 2PY 0.00073 -0.00595 0.04562 -0.09156 0.14374 242 2PZ 0.00536 0.00369 0.02639 -0.05296 0.08847 243 3S -0.00224 0.00137 0.01328 0.00973 -0.09976 244 3PX -0.00158 0.00039 -0.01151 0.02687 -0.05004 245 3PY -0.00075 -0.00308 0.00207 -0.02108 0.02822 246 3PZ 0.00347 0.00291 0.00141 -0.01214 0.02022 247 4XX 0.00012 -0.00006 -0.00270 0.00379 0.01079 248 4YY 0.00006 0.00023 -0.00003 -0.00090 -0.00284 249 4ZZ 0.00006 -0.00018 0.00116 -0.00301 0.00240 250 4XY 0.00006 -0.00034 0.00478 -0.00947 0.00880 251 4XZ 0.00009 0.00004 0.00274 -0.00541 0.00491 252 4YZ 0.00001 0.00002 -0.00129 0.00234 -0.00549 253 22 H 1S 0.00087 -0.00086 0.01256 -0.02709 0.01809 254 2S 0.00118 -0.00032 0.01398 -0.02525 0.02836 255 23 H 1S 0.00425 -0.00085 -0.06283 0.12047 0.25426 256 2S 0.00312 -0.00230 -0.01410 0.02740 0.18851 257 24 H 1S -0.00765 0.00324 0.01264 -0.02696 -0.01367 258 2S -0.00580 0.00114 0.01353 -0.02396 -0.02871 259 25 H 1S 0.00359 0.00267 -0.00792 0.01853 -0.00853 260 2S 0.00228 0.00250 -0.01079 0.02253 -0.01761 261 26 H 1S 0.00071 -0.00010 -0.00082 0.00161 -0.00319 262 2S 0.00104 -0.00038 0.00248 -0.00392 0.00437 263 27 H 1S -0.00007 0.00029 -0.00294 0.00483 -0.00888 264 2S 0.00013 0.00032 -0.00231 0.00375 -0.01141 226 227 228 229 230 226 2PY 0.39801 227 2PZ 0.03878 0.34775 228 3S 0.01497 0.00775 0.24216 229 3PX 0.00175 0.00223 0.02374 0.05359 230 3PY 0.13705 -0.03987 0.01022 0.00039 0.05960 231 3PZ -0.03961 0.18754 0.00540 0.00189 -0.04146 232 4XX 0.01360 0.00676 0.00509 0.00445 0.00360 233 4YY -0.00959 -0.00346 -0.00561 -0.00181 -0.00257 234 4ZZ -0.00224 -0.00251 -0.00967 -0.00161 -0.00060 235 4XY -0.00924 0.00015 0.00434 0.00439 -0.00267 236 4XZ 0.00014 -0.01027 0.00194 0.00212 0.00191 237 4YZ -0.00456 -0.00387 0.00356 -0.00045 -0.00072 238 21 C 1S -0.04423 -0.02579 0.00802 0.00497 -0.00821 239 2S 0.09690 0.05627 0.01749 -0.03074 0.01762 240 2PX 0.14714 0.08971 0.10241 -0.05894 0.04874 241 2PY -0.03552 -0.15593 -0.07859 0.03308 0.02045 242 2PZ -0.15598 0.15600 -0.04516 0.02263 -0.07371 243 3S 0.02693 0.01769 -0.03913 -0.01672 -0.00609 244 3PX 0.07238 0.04370 0.01673 -0.01473 0.02017 245 3PY 0.02501 -0.07224 -0.01217 0.00142 0.02602 246 3PZ -0.07295 0.11470 -0.00685 0.00313 -0.04018 247 4XX 0.00533 0.00308 0.00568 0.00368 0.00161 248 4YY -0.01209 0.00108 -0.00245 -0.00102 -0.00424 249 4ZZ -0.00110 -0.00874 -0.00190 0.00034 0.00117 250 4XY -0.00053 -0.00612 -0.00886 0.00274 0.00023 251 4XZ -0.00592 0.00640 -0.00498 0.00157 -0.00366 252 4YZ -0.00147 -0.00617 -0.00006 -0.00156 0.00031 253 22 H 1S -0.03672 -0.02072 -0.04216 0.00251 -0.00669 254 2S -0.06628 -0.03696 -0.03359 0.00632 -0.01586 255 23 H 1S 0.08291 0.03960 0.11962 0.09259 0.02921 256 2S 0.06418 0.03094 0.03901 0.06329 0.02153 257 24 H 1S 0.03978 0.02206 -0.05622 -0.00031 0.01171 258 2S 0.06519 0.03606 -0.04276 -0.00440 0.01701 259 25 H 1S -0.03053 -0.01662 0.03318 0.00351 -0.02352 260 2S -0.05045 -0.02667 0.02724 0.00080 -0.02684 261 26 H 1S -0.00042 -0.00020 0.01395 -0.00096 -0.00004 262 2S 0.00006 -0.00345 0.00696 0.00054 -0.00013 263 27 H 1S 0.00530 0.00323 0.02022 -0.01043 0.00961 264 2S 0.00379 0.00347 0.01020 -0.00799 0.00388 231 232 233 234 235 231 3PZ 0.11262 232 4XX 0.00162 0.00156 233 4YY -0.00029 -0.00065 0.00107 234 4ZZ -0.00113 -0.00025 0.00033 0.00091 235 4XY 0.00188 0.00029 -0.00011 -0.00013 0.00116 236 4XZ -0.00532 0.00013 -0.00001 -0.00008 0.00041 237 4YZ -0.00129 -0.00037 0.00012 0.00004 0.00002 238 21 C 1S -0.00472 -0.00248 -0.00017 0.00114 0.00498 239 2S 0.01055 0.00399 -0.00112 -0.00313 -0.01001 240 2PX 0.03101 -0.00674 0.00038 -0.00312 -0.00880 241 2PY -0.07234 -0.00860 0.01164 0.00409 0.00130 242 2PZ 0.11016 -0.00494 0.00278 0.00631 0.00650 243 3S -0.00257 0.00075 0.00133 -0.00065 -0.00914 244 3PX 0.01308 -0.00115 -0.00051 -0.00061 -0.00349 245 3PY -0.03918 -0.00269 0.00433 0.00047 -0.00105 246 3PZ 0.07510 -0.00169 -0.00027 0.00319 0.00304 247 4XX 0.00110 0.00095 -0.00060 -0.00031 0.00039 248 4YY 0.00240 -0.00087 0.00065 0.00021 0.00011 249 4ZZ -0.00439 -0.00036 0.00018 0.00022 0.00013 250 4XY -0.00385 0.00018 0.00005 0.00039 0.00016 251 4XZ 0.00477 0.00007 0.00027 -0.00000 0.00016 252 4YZ -0.00318 -0.00044 0.00035 0.00001 -0.00032 253 22 H 1S -0.00392 -0.00657 0.00729 0.00269 -0.00201 254 2S -0.00893 -0.00646 0.00594 0.00235 0.00065 255 23 H 1S 0.01394 0.01270 -0.00671 -0.00627 0.00862 256 2S 0.01048 0.00975 -0.00451 -0.00267 0.00662 257 24 H 1S 0.00634 -0.00175 0.00354 0.00168 -0.00751 258 2S 0.00920 -0.00000 0.00068 0.00099 -0.00704 259 25 H 1S -0.01306 -0.00169 -0.00044 -0.00021 -0.00129 260 2S -0.01434 -0.00273 0.00021 -0.00018 -0.00115 261 26 H 1S 0.00008 0.00123 -0.00044 -0.00012 0.00090 262 2S -0.00249 0.00245 -0.00085 -0.00042 0.00173 263 27 H 1S 0.00557 -0.00045 -0.00002 -0.00049 -0.00034 264 2S 0.00318 -0.00101 0.00052 -0.00020 -0.00047 236 237 238 239 240 236 4XZ 0.00060 237 4YZ 0.00000 0.00049 238 21 C 1S 0.00285 -0.00142 2.05385 239 2S -0.00572 0.00233 -0.06797 0.34315 240 2PX -0.00498 0.00361 -0.00278 0.00718 0.42862 241 2PY 0.00651 0.00271 -0.00344 0.00039 -0.00658 242 2PZ -0.00626 0.00390 -0.00203 0.00074 -0.00752 243 3S -0.00506 0.00212 -0.17868 0.28194 -0.05130 244 3PX -0.00210 0.00054 0.00444 -0.00342 0.14241 245 3PY 0.00294 0.00073 -0.00257 0.02282 0.02141 246 3PZ -0.00459 0.00226 -0.00167 0.01322 0.01204 247 4XX 0.00018 -0.00029 -0.01666 -0.00388 -0.00938 248 4YY -0.00019 0.00034 -0.01877 -0.00079 0.00586 249 4ZZ 0.00037 0.00002 -0.01346 -0.01169 0.00218 250 4XY 0.00018 -0.00008 -0.00066 0.00083 -0.01358 251 4XZ -0.00005 -0.00022 -0.00022 0.00013 -0.00725 252 4YZ 0.00004 0.00034 -0.00474 0.00974 0.00357 253 22 H 1S -0.00090 0.00420 -0.06235 0.12034 0.04049 254 2S 0.00059 0.00300 -0.01089 0.02067 0.02653 255 23 H 1S 0.00423 -0.00073 0.01325 -0.02887 -0.04333 256 2S 0.00332 -0.00190 0.01527 -0.02780 -0.07281 257 24 H 1S -0.00402 0.00193 -0.00825 0.01973 0.02596 258 2S -0.00380 -0.00005 -0.01166 0.02527 0.03887 259 25 H 1S -0.00065 -0.00020 -0.00060 0.00075 -0.00158 260 2S -0.00056 0.00038 0.00203 -0.00326 -0.00226 261 26 H 1S 0.00045 -0.00028 -0.00734 0.01679 -0.03247 262 2S 0.00098 -0.00069 -0.01073 0.02043 -0.05777 263 27 H 1S -0.00007 0.00011 0.00869 -0.02089 0.02940 264 2S -0.00018 0.00045 0.00436 -0.01137 0.03959 241 242 243 244 245 241 2PY 0.41229 242 2PZ 0.06589 0.32857 243 3S 0.03679 0.02109 0.28467 244 3PX -0.01461 -0.00495 -0.02434 0.05785 245 3PY 0.15989 -0.01507 0.01670 0.00016 0.07667 246 3PZ -0.01533 0.18076 0.00970 0.00276 -0.02453 247 4XX -0.00988 -0.00507 -0.00540 -0.00226 -0.00300 248 4YY 0.01058 0.01244 0.00239 0.00108 0.00240 249 4ZZ 0.00624 -0.00357 -0.00795 0.00064 0.00210 250 4XY 0.00673 0.00297 0.00356 -0.00340 0.00104 251 4XZ 0.00309 0.00314 0.00178 -0.00194 -0.00004 252 4YZ 0.01077 0.00074 0.00912 0.00029 0.00470 253 22 H 1S 0.23751 0.12862 0.12482 0.00315 0.08803 254 2S 0.17221 0.09179 0.03898 0.00199 0.05553 255 23 H 1S 0.01035 0.00676 -0.04978 -0.00847 0.00048 256 2S 0.01228 0.00868 -0.03660 -0.01716 -0.00001 257 24 H 1S -0.02155 -0.01266 0.03774 0.02607 -0.01135 258 2S -0.03957 -0.02316 0.03042 0.02818 -0.01379 259 25 H 1S -0.00321 -0.00228 0.01826 -0.00262 -0.00606 260 2S -0.00160 -0.00086 0.01485 -0.00280 -0.00838 261 26 H 1S -0.01350 -0.00649 0.03460 -0.02775 -0.00543 262 2S -0.02160 -0.01438 0.03482 -0.03307 -0.00996 263 27 H 1S -0.00544 -0.00717 -0.02912 -0.00968 -0.00270 264 2S 0.00966 0.00254 -0.01641 0.00357 0.00174 246 247 248 249 250 246 3PZ 0.11020 247 4XX -0.00150 0.00139 248 4YY 0.00548 -0.00072 0.00127 249 4ZZ -0.00317 -0.00002 0.00024 0.00077 250 4XY -0.00011 0.00003 0.00002 0.00003 0.00100 251 4XZ 0.00104 0.00002 0.00016 -0.00012 0.00015 252 4YZ -0.00057 -0.00064 0.00051 -0.00005 0.00011 253 22 H 1S 0.04792 -0.00998 0.01097 -0.00107 0.00363 254 2S 0.02913 -0.00779 0.00902 0.00148 0.00296 255 23 H 1S 0.00055 0.00978 -0.00509 -0.00104 0.00119 256 2S 0.00062 0.00718 -0.00437 -0.00065 0.00299 257 24 H 1S -0.00705 0.00031 -0.00222 -0.00071 0.00039 258 2S -0.00866 0.00057 -0.00265 -0.00101 -0.00035 259 25 H 1S -0.00372 -0.00069 0.00110 0.00033 0.00035 260 2S -0.00458 -0.00146 0.00198 0.00053 0.00053 261 26 H 1S -0.00227 0.00045 -0.00183 -0.00065 -0.00119 262 2S -0.00741 0.00115 -0.00246 -0.00100 -0.00013 263 27 H 1S -0.00383 -0.00072 0.00072 0.00040 -0.00093 264 2S -0.00078 -0.00214 0.00191 0.00055 -0.00019 251 252 253 254 255 251 4XZ 0.00080 252 4YZ -0.00002 0.00080 253 22 H 1S 0.00204 0.01056 0.21370 254 2S 0.00181 0.00660 0.13513 0.10234 255 23 H 1S 0.00043 -0.00370 -0.02244 -0.01897 0.21301 256 2S 0.00149 -0.00348 -0.02001 -0.01647 0.13946 257 24 H 1S 0.00020 -0.00136 -0.01045 -0.01840 -0.02190 258 2S -0.00022 -0.00143 -0.01928 -0.02505 -0.01954 259 25 H 1S 0.00022 0.00072 0.00310 0.00940 -0.01003 260 2S 0.00037 0.00132 0.00568 0.01529 -0.01847 261 26 H 1S -0.00065 -0.00101 -0.01136 -0.01830 0.00371 262 2S -0.00024 -0.00118 -0.01821 -0.02134 0.00901 263 27 H 1S -0.00040 0.00058 -0.00426 0.01013 -0.00272 264 2S 0.00005 0.00137 0.01196 0.01920 -0.00587 256 257 258 259 260 256 2S 0.10478 257 24 H 1S -0.01985 0.21388 258 2S -0.01726 0.13735 0.10288 259 25 H 1S -0.01862 -0.02180 -0.01927 0.21325 260 2S -0.02486 -0.01959 -0.01679 0.13993 0.10542 261 26 H 1S 0.00695 -0.01014 -0.01891 -0.02311 -0.02095 262 2S 0.01518 -0.01828 -0.02458 -0.01813 -0.01630 263 27 H 1S -0.00348 0.00044 0.00123 0.00554 0.00898 264 2S -0.00618 -0.00213 -0.00210 0.00917 0.01358 261 262 263 264 261 26 H 1S 0.21306 262 2S 0.13280 0.11020 263 27 H 1S 0.00227 0.00483 0.21351 264 2S -0.00064 -0.00121 0.12247 0.09032 Full Mulliken population analysis: 1 2 3 4 5 1 1 C 1S 2.05620 2 2S -0.01663 0.36561 3 2PX 0.00000 0.00000 0.44543 4 2PY 0.00000 0.00000 0.00000 0.40131 5 2PZ 0.00000 0.00000 -0.00000 -0.00000 0.29132 6 3S -0.03577 0.27138 0.00000 0.00000 0.00000 7 3PX 0.00000 0.00000 0.08441 0.00000 0.00000 8 3PY 0.00000 0.00000 -0.00000 0.10245 -0.00000 9 3PZ 0.00000 0.00000 -0.00000 -0.00000 0.08896 10 4XX -0.00133 -0.00155 0.00000 0.00000 0.00000 11 4YY -0.00134 -0.00267 0.00000 0.00000 0.00000 12 4ZZ -0.00103 -0.00848 0.00000 0.00000 0.00000 13 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 14 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 15 4YZ 0.00000 -0.00000 0.00000 0.00000 0.00000 16 2 C 1S 0.00000 -0.00027 -0.00163 -0.00001 -0.00000 17 2S -0.00024 0.00677 0.03084 0.00016 0.00007 18 2PX -0.00176 0.03411 0.09059 0.00055 0.00011 19 2PY 0.00000 -0.00007 -0.00007 0.00248 0.00001 20 2PZ 0.00000 -0.00003 -0.00009 0.00001 0.00512 21 3S 0.00049 -0.00236 0.02535 0.00037 0.00018 22 3PX -0.00151 0.01964 0.02764 0.00015 -0.00009 23 3PY -0.00001 -0.00007 -0.00018 0.00349 0.00000 24 3PZ 0.00001 -0.00011 -0.00004 0.00001 0.00643 25 4XX -0.00020 0.00381 0.00418 0.00002 -0.00000 26 4YY 0.00000 -0.00045 -0.00114 0.00000 0.00000 27 4ZZ 0.00000 -0.00042 -0.00095 0.00000 0.00000 28 4XY -0.00000 0.00001 0.00001 0.00144 -0.00000 29 4XZ -0.00000 0.00002 0.00001 -0.00000 0.00119 30 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00001 31 3 H 1S 0.00000 -0.00025 -0.00061 -0.00007 0.00009 32 2S 0.00019 -0.00306 -0.00559 -0.00038 -0.00046 33 4 Br 1S 0.00000 0.00000 0.00000 0.00000 0.00000 34 2S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 35 3S -0.00000 0.00000 0.00000 0.00000 0.00000 36 4S -0.00000 0.00000 0.00000 0.00000 0.00000 37 5S 0.00000 -0.00006 -0.00010 -0.00009 -0.00004 38 6S 0.00007 -0.00079 -0.00056 -0.00038 -0.00054 39 7PX 0.00000 -0.00000 -0.00000 0.00000 0.00000 40 7PY 0.00000 0.00000 -0.00000 0.00000 0.00000 41 7PZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 42 8PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 43 8PY -0.00000 0.00000 0.00000 -0.00000 -0.00000 44 8PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 45 9PX 0.00000 -0.00027 -0.00020 0.00023 0.00048 46 9PY 0.00000 -0.00011 -0.00032 0.00014 0.00010 47 9PZ 0.00000 -0.00006 -0.00011 0.00003 0.00013 48 10PX 0.00024 -0.00492 -0.00171 0.00145 0.00334 49 10PY 0.00013 -0.00180 -0.00248 0.00043 -0.00006 50 10PZ 0.00008 -0.00087 -0.00091 -0.00008 0.00025 51 11XX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 52 11YY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 53 11ZZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 54 11XY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 55 11XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 56 11YZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 57 12XX -0.00000 0.00004 0.00002 0.00002 -0.00001 58 12YY -0.00000 -0.00006 0.00003 -0.00003 0.00005 59 12ZZ -0.00000 -0.00005 -0.00007 -0.00007 -0.00001 60 12XY -0.00000 0.00008 0.00036 0.00009 0.00027 61 12XZ -0.00000 0.00008 0.00022 0.00019 0.00003 62 12YZ 0.00000 -0.00006 0.00006 0.00006 0.00007 63 5 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 64 2S 0.00000 -0.00002 -0.00008 -0.00003 -0.00000 65 2PX 0.00000 -0.00011 -0.00028 -0.00003 -0.00003 66 2PY 0.00000 -0.00002 -0.00011 -0.00003 -0.00000 67 2PZ 0.00000 -0.00000 -0.00001 -0.00001 -0.00000 68 3S 0.00002 -0.00030 -0.00076 -0.00078 -0.00021 69 3PX 0.00007 -0.00169 -0.00247 -0.00098 -0.00055 70 3PY -0.00003 0.00061 0.00059 -0.00027 -0.00027 71 3PZ -0.00001 0.00014 0.00007 -0.00012 -0.00012 72 4XX -0.00000 0.00001 0.00003 0.00001 0.00000 73 4YY 0.00000 -0.00000 -0.00001 -0.00000 0.00000 74 4ZZ -0.00000 0.00000 -0.00000 0.00000 0.00000 75 4XY -0.00000 0.00000 0.00002 0.00000 0.00000 76 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 77 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 78 6 C 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 79 2S 0.00000 0.00000 0.00000 0.00000 -0.00000 80 2PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 81 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 82 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 83 3S -0.00000 0.00004 0.00006 0.00002 0.00000 84 3PX 0.00000 -0.00015 -0.00030 -0.00003 0.00003 85 3PY -0.00000 0.00001 0.00003 0.00001 0.00003 86 3PZ -0.00000 0.00004 0.00002 -0.00001 -0.00000 87 4XX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 88 4YY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 89 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 90 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 91 4XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 92 4YZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 93 7 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 94 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 95 2PX -0.00000 0.00000 0.00000 -0.00000 0.00000 96 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 97 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 98 3S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 99 3PX -0.00000 0.00000 -0.00000 -0.00000 0.00000 100 3PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 101 3PZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 102 4XX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 103 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 104 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 105 4XY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 106 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 107 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 108 8 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 109 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 110 2PX -0.00000 0.00000 0.00000 0.00000 0.00000 111 2PY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 112 2PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 113 3S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 114 3PX -0.00000 0.00000 0.00000 0.00000 0.00000 115 3PY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 116 3PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 117 4XX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 118 4YY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 119 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 120 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 121 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 122 4YZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 123 9 C 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 124 2S 0.00000 -0.00000 -0.00000 0.00000 0.00000 125 2PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 126 2PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 127 2PZ -0.00000 0.00000 0.00000 -0.00000 0.00000 128 3S 0.00000 -0.00000 -0.00000 0.00000 0.00000 129 3PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 130 3PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 131 3PZ -0.00000 0.00000 0.00000 0.00000 0.00000 132 4XX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 133 4YY -0.00000 0.00000 0.00000 0.00000 -0.00000 134 4ZZ -0.00000 0.00000 0.00000 -0.00000 0.00000 135 4XY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 136 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 137 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 138 10 C 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 139 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 140 2PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 141 2PY -0.00000 0.00000 0.00000 -0.00000 -0.00000 142 2PZ -0.00000 0.00000 0.00000 0.00000 0.00000 143 3S -0.00000 0.00003 0.00009 -0.00002 0.00000 144 3PX 0.00000 -0.00016 -0.00034 -0.00004 0.00001 145 3PY -0.00000 0.00003 0.00007 0.00001 -0.00001 146 3PZ -0.00000 0.00001 0.00002 -0.00000 -0.00001 147 4XX 0.00000 -0.00000 -0.00000 0.00000 0.00000 148 4YY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 149 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 150 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 151 4XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 152 4YZ -0.00000 0.00000 0.00000 -0.00000 0.00000 153 11 H 1S -0.00000 0.00000 0.00000 -0.00000 -0.00000 154 2S -0.00000 0.00001 0.00003 0.00001 0.00001 155 12 H 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 156 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 157 13 H 1S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 158 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 159 14 H 1S -0.00000 0.00000 0.00000 0.00000 -0.00000 160 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 161 15 H 1S -0.00000 0.00000 0.00000 0.00000 -0.00000 162 2S -0.00000 0.00002 0.00003 -0.00000 0.00000 163 16 C 1S 0.00000 -0.00054 -0.00131 -0.00108 -0.00040 164 2S -0.00054 0.01137 0.01935 0.01604 0.00606 165 2PX -0.00157 0.02329 0.01684 0.02888 0.01128 166 2PY -0.00101 0.01546 0.02337 0.00259 0.01497 167 2PZ -0.00032 0.00489 0.00904 0.01535 0.00591 168 3S 0.00042 0.00253 0.00966 0.01401 0.00577 169 3PX 0.00006 0.00517 0.00007 0.00023 0.00005 170 3PY -0.00001 0.00038 -0.00082 0.00194 0.00526 171 3PZ 0.00003 -0.00061 0.00029 0.00581 0.01602 172 4XX -0.00004 0.00050 -0.00116 0.00129 0.00044 173 4YY -0.00001 -0.00000 0.00066 -0.00068 -0.00018 174 4ZZ 0.00000 -0.00025 -0.00026 -0.00042 0.00000 175 4XY -0.00016 0.00179 0.00114 0.00036 0.00063 176 4XZ -0.00006 0.00067 0.00035 0.00059 0.00006 177 4YZ -0.00003 0.00030 0.00062 -0.00008 0.00014 178 17 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 179 2S 0.00000 -0.00005 -0.00002 -0.00015 -0.00005 180 2PX 0.00000 -0.00002 -0.00000 -0.00005 -0.00001 181 2PY 0.00000 -0.00017 -0.00010 -0.00055 -0.00000 182 2PZ 0.00000 -0.00007 -0.00002 0.00007 -0.00014 183 3S 0.00005 -0.00159 -0.00077 -0.00420 -0.00132 184 3PX -0.00000 0.00011 -0.00031 0.00128 0.00057 185 3PY 0.00006 -0.00146 -0.00029 -0.00301 -0.00003 186 3PZ 0.00003 -0.00070 0.00002 0.00063 -0.00032 187 4XX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 188 4YY -0.00000 0.00001 0.00000 -0.00000 0.00004 189 4ZZ -0.00000 0.00000 0.00000 0.00002 -0.00001 190 4XY -0.00000 0.00001 0.00000 0.00003 0.00001 191 4XZ -0.00000 0.00000 0.00000 0.00001 0.00000 192 4YZ -0.00000 0.00000 0.00000 0.00003 -0.00001 193 18 C 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 194 2S -0.00000 0.00000 0.00000 0.00000 0.00000 195 2PX -0.00000 0.00000 0.00000 0.00000 0.00000 196 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 197 2PZ -0.00000 0.00000 0.00000 -0.00000 0.00000 198 3S -0.00000 0.00002 0.00005 0.00009 0.00003 199 3PX -0.00000 0.00003 0.00002 0.00010 0.00003 200 3PY 0.00000 0.00002 0.00005 0.00014 -0.00002 201 3PZ -0.00000 0.00001 0.00001 -0.00004 0.00004 202 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 203 4YY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 204 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 205 4XY 0.00000 0.00000 -0.00000 -0.00000 0.00000 206 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 207 4YZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 208 19 C 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 209 2S -0.00000 0.00000 0.00000 0.00000 0.00000 210 2PX -0.00000 0.00000 0.00000 0.00000 0.00000 211 2PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 212 2PZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 213 3S -0.00000 0.00000 -0.00000 0.00000 0.00000 214 3PX 0.00000 -0.00000 -0.00001 0.00000 -0.00000 215 3PY 0.00000 -0.00000 -0.00000 0.00001 -0.00001 216 3PZ -0.00000 0.00000 -0.00000 -0.00002 0.00001 217 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY -0.00000 0.00000 0.00000 0.00000 -0.00000 219 4ZZ -0.00000 0.00000 0.00000 -0.00000 0.00000 220 4XY -0.00000 0.00000 0.00000 0.00000 -0.00000 221 4XZ -0.00000 0.00000 0.00000 -0.00000 0.00000 222 4YZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 223 20 C 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 224 2S -0.00000 0.00000 0.00000 0.00000 0.00000 225 2PX -0.00000 0.00000 0.00000 0.00000 0.00000 226 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 227 2PZ -0.00000 0.00000 0.00000 -0.00000 0.00000 228 3S -0.00000 0.00005 0.00021 0.00001 0.00001 229 3PX -0.00000 0.00010 0.00036 0.00002 0.00001 230 3PY -0.00000 0.00003 0.00009 0.00000 -0.00001 231 3PZ -0.00000 0.00001 0.00003 -0.00001 -0.00002 232 4XX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 233 4YY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 234 4ZZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 235 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 236 4XZ -0.00000 0.00000 0.00000 0.00000 -0.00000 237 4YZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 238 21 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 239 2S 0.00000 -0.00012 -0.00036 0.00000 -0.00000 240 2PX 0.00000 -0.00041 -0.00102 -0.00009 -0.00004 241 2PY 0.00000 -0.00002 -0.00005 0.00001 0.00002 242 2PZ 0.00000 -0.00002 -0.00001 0.00002 0.00010 243 3S 0.00015 -0.00267 -0.00794 -0.00022 -0.00018 244 3PX 0.00004 -0.00006 -0.00043 -0.00093 -0.00035 245 3PY -0.00001 0.00018 0.00119 -0.00029 0.00015 246 3PZ -0.00000 0.00000 0.00055 0.00015 0.00095 247 4XX -0.00000 0.00003 0.00016 0.00001 0.00001 248 4YY 0.00000 -0.00000 -0.00001 0.00000 -0.00000 249 4ZZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 250 4XY -0.00000 0.00001 0.00003 0.00000 0.00000 251 4XZ -0.00000 0.00000 0.00002 0.00000 0.00001 252 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 253 22 H 1S 0.00000 -0.00002 -0.00005 -0.00000 0.00000 254 2S 0.00002 -0.00055 -0.00151 0.00019 0.00005 255 23 H 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 256 2S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 257 24 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 258 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 259 25 H 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 260 2S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 261 26 H 1S 0.00000 -0.00000 0.00000 -0.00001 -0.00000 262 2S 0.00001 -0.00032 0.00005 -0.00078 -0.00031 263 27 H 1S -0.00201 0.03324 0.01111 0.06737 0.02613 264 2S -0.00044 0.00617 0.00564 0.03080 0.01218 6 7 8 9 10 6 3S 0.37722 7 3PX 0.00000 0.07744 8 3PY 0.00000 -0.00000 0.09372 9 3PZ 0.00000 0.00000 0.00000 0.09315 10 4XX -0.00360 0.00000 0.00000 0.00000 0.00140 11 4YY -0.00072 0.00000 0.00000 0.00000 -0.00022 12 4ZZ -0.00547 0.00000 0.00000 0.00000 -0.00003 13 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 14 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00000 15 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 16 2 C 1S 0.00151 -0.00004 0.00002 0.00001 -0.00016 17 2S -0.00774 0.01137 0.00002 -0.00001 0.00298 18 2PX 0.02777 0.02429 0.00022 -0.00004 0.00242 19 2PY -0.00033 0.00011 0.00353 0.00000 0.00002 20 2PZ -0.00025 0.00009 0.00000 0.00580 0.00002 21 3S -0.04612 -0.01068 0.00022 0.00000 0.00468 22 3PX 0.00410 0.00480 0.00017 -0.00012 0.00163 23 3PY -0.00045 -0.00006 0.00105 0.00000 0.00001 24 3PZ -0.00034 0.00009 0.00000 0.00442 0.00001 25 4XX 0.00497 0.00267 -0.00001 -0.00001 0.00003 26 4YY -0.00130 -0.00211 0.00001 0.00002 -0.00004 27 4ZZ -0.00164 -0.00130 -0.00001 -0.00001 -0.00001 28 4XY 0.00001 0.00001 0.00097 0.00000 -0.00001 29 4XZ 0.00001 0.00000 0.00000 0.00086 -0.00000 30 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 31 3 H 1S -0.00552 -0.00292 -0.00006 0.00040 0.00006 32 2S -0.01138 -0.00637 -0.00010 -0.00101 0.00002 33 4 Br 1S -0.00000 -0.00000 0.00000 -0.00000 0.00000 34 2S 0.00004 0.00006 -0.00009 0.00006 -0.00000 35 3S -0.00006 -0.00009 0.00019 -0.00010 0.00000 36 4S -0.00017 -0.00022 0.00062 -0.00027 0.00000 37 5S -0.00065 -0.00100 -0.00123 -0.00079 -0.00000 38 6S -0.00102 -0.00001 -0.00083 -0.00151 -0.00009 39 7PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 40 7PY -0.00001 -0.00001 0.00000 -0.00001 -0.00000 41 7PZ -0.00000 -0.00001 -0.00000 0.00000 -0.00000 42 8PX 0.00013 0.00002 -0.00023 -0.00023 0.00000 43 8PY 0.00012 0.00024 -0.00007 0.00010 -0.00000 44 8PZ 0.00007 0.00010 0.00010 -0.00004 -0.00000 45 9PX -0.00279 -0.00022 0.00425 0.00422 -0.00002 46 9PY -0.00133 -0.00343 0.00066 -0.00116 0.00001 47 9PZ -0.00123 -0.00091 -0.00187 0.00052 0.00001 48 10PX -0.01191 -0.00084 0.00884 0.00899 -0.00022 49 10PY -0.00458 -0.00705 0.00054 -0.00373 -0.00000 50 10PZ -0.00350 -0.00185 -0.00479 -0.00048 0.00005 51 11XX 0.00002 0.00006 -0.00029 0.00013 -0.00000 52 11YY 0.00011 0.00010 -0.00021 0.00016 -0.00000 53 11ZZ 0.00014 0.00020 -0.00013 0.00011 -0.00000 54 11XY -0.00002 -0.00000 -0.00001 -0.00002 0.00000 55 11XZ 0.00000 -0.00002 -0.00003 -0.00000 -0.00000 56 11YZ -0.00001 -0.00001 0.00000 -0.00001 -0.00000 57 12XX 0.00079 0.00025 -0.00033 0.00049 -0.00000 58 12YY 0.00011 -0.00002 -0.00033 0.00025 0.00001 59 12ZZ -0.00012 -0.00005 -0.00079 0.00007 0.00000 60 12XY 0.00003 0.00029 0.00020 0.00058 0.00001 61 12XZ 0.00011 0.00021 0.00038 0.00003 0.00000 62 12YZ -0.00039 -0.00011 0.00004 0.00003 0.00002 63 5 C 1S 0.00003 0.00014 0.00005 0.00001 -0.00000 64 2S -0.00041 -0.00155 -0.00072 -0.00004 -0.00000 65 2PX -0.00258 -0.00557 0.00120 0.00003 0.00000 66 2PY 0.00025 -0.00011 -0.00020 -0.00006 0.00000 67 2PZ 0.00020 -0.00004 -0.00005 -0.00033 0.00000 68 3S -0.00086 -0.00255 -0.00118 -0.00023 -0.00006 69 3PX -0.00873 -0.00908 0.00249 -0.00026 -0.00013 70 3PY 0.00289 0.00394 0.00009 -0.00043 -0.00005 71 3PZ 0.00046 0.00004 -0.00023 -0.00080 -0.00000 72 4XX 0.00014 0.00026 0.00006 0.00001 0.00000 73 4YY -0.00007 -0.00021 -0.00000 0.00001 0.00000 74 4ZZ -0.00001 0.00004 -0.00001 -0.00000 -0.00000 75 4XY 0.00002 0.00003 -0.00000 0.00000 0.00000 76 4XZ -0.00000 -0.00000 0.00001 0.00001 0.00000 77 4YZ -0.00001 -0.00001 0.00000 0.00000 0.00000 78 6 C 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 79 2S -0.00003 0.00001 -0.00001 -0.00003 -0.00000 80 2PX -0.00016 -0.00026 0.00004 -0.00002 -0.00000 81 2PY 0.00001 0.00012 -0.00001 -0.00004 -0.00000 82 2PZ -0.00004 0.00004 -0.00002 -0.00006 -0.00000 83 3S -0.00010 0.00037 0.00004 -0.00007 -0.00000 84 3PX -0.00143 -0.00167 0.00005 0.00029 -0.00001 85 3PY 0.00015 0.00043 -0.00004 -0.00011 0.00000 86 3PZ -0.00009 0.00014 -0.00022 -0.00014 -0.00000 87 4XX -0.00000 -0.00001 0.00001 0.00000 0.00000 88 4YY 0.00000 0.00000 -0.00000 -0.00000 0.00000 89 4ZZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 90 4XY -0.00000 -0.00001 0.00000 0.00000 -0.00000 91 4XZ -0.00001 -0.00002 0.00000 -0.00000 -0.00000 92 4YZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 93 7 C 1S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 94 2S 0.00000 -0.00000 -0.00000 0.00000 0.00000 95 2PX 0.00000 0.00000 -0.00000 0.00000 0.00000 96 2PY 0.00000 -0.00000 0.00000 0.00000 0.00000 97 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 98 3S 0.00000 -0.00003 -0.00001 0.00000 -0.00000 99 3PX 0.00004 0.00008 -0.00005 -0.00001 0.00000 100 3PY -0.00001 -0.00008 0.00001 0.00002 -0.00000 101 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 102 4XX -0.00000 -0.00000 0.00000 0.00000 -0.00000 103 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 104 4ZZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 105 4XY -0.00000 -0.00000 0.00000 0.00000 -0.00000 106 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 107 4YZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 108 8 C 1S -0.00000 0.00000 0.00000 -0.00000 0.00000 109 2S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 110 2PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 111 2PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 112 2PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 113 3S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 114 3PX 0.00002 0.00005 -0.00002 -0.00000 0.00000 115 3PY -0.00001 -0.00003 0.00001 0.00000 -0.00000 116 3PZ 0.00000 0.00000 0.00000 0.00000 0.00000 117 4XX 0.00000 0.00000 -0.00000 -0.00000 0.00000 118 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 119 4ZZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 120 4XY 0.00000 0.00000 -0.00000 -0.00000 0.00000 121 4XZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 122 4YZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 123 9 C 1S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 124 2S -0.00000 -0.00000 0.00000 0.00000 0.00000 125 2PX -0.00000 0.00000 -0.00000 0.00000 0.00000 126 2PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 127 2PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 128 3S -0.00001 -0.00003 -0.00000 -0.00000 -0.00000 129 3PX -0.00000 0.00005 -0.00004 0.00000 0.00000 130 3PY -0.00003 -0.00009 0.00002 0.00000 -0.00000 131 3PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 132 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 133 4YY 0.00000 0.00000 -0.00000 -0.00000 0.00000 134 4ZZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 135 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 136 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 137 4YZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 138 10 C 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 139 2S 0.00002 0.00004 -0.00006 -0.00000 -0.00000 140 2PX -0.00012 -0.00031 0.00007 -0.00002 -0.00000 141 2PY 0.00013 0.00032 -0.00008 -0.00002 0.00000 142 2PZ 0.00001 0.00000 0.00001 0.00001 0.00000 143 3S 0.00040 0.00076 -0.00016 0.00003 -0.00000 144 3PX -0.00140 -0.00228 0.00061 -0.00001 -0.00001 145 3PY 0.00076 0.00128 -0.00031 -0.00007 0.00000 146 3PZ 0.00005 0.00010 0.00004 -0.00005 -0.00000 147 4XX -0.00001 -0.00002 0.00001 -0.00000 0.00000 148 4YY 0.00000 0.00001 -0.00000 -0.00000 0.00000 149 4ZZ 0.00000 0.00001 -0.00000 0.00000 -0.00000 150 4XY -0.00000 -0.00001 0.00000 -0.00000 -0.00000 151 4XZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 152 4YZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 153 11 H 1S -0.00000 0.00002 -0.00002 0.00001 -0.00000 154 2S -0.00006 0.00023 -0.00007 0.00020 -0.00000 155 12 H 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 156 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 157 13 H 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 158 2S 0.00000 -0.00000 0.00000 0.00000 0.00000 159 14 H 1S -0.00000 0.00000 0.00000 -0.00000 0.00000 160 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 161 15 H 1S -0.00000 0.00000 0.00000 0.00001 -0.00000 162 2S 0.00006 0.00014 -0.00002 0.00010 -0.00000 163 16 C 1S -0.00023 -0.00064 -0.00073 -0.00033 -0.00004 164 2S 0.00656 0.00760 0.00879 0.00368 0.00051 165 2PX 0.03053 -0.00022 0.01321 0.00565 -0.00148 166 2PY 0.01793 0.01362 -0.00047 0.00803 0.00137 167 2PZ 0.00472 0.00555 0.00825 0.01575 0.00044 168 3S -0.01992 -0.00518 0.00495 0.00348 0.00070 169 3PX 0.00159 0.00244 -0.00133 -0.00035 -0.00042 170 3PY -0.00221 -0.00187 0.00649 0.00493 0.00050 171 3PZ -0.00292 0.00014 0.00530 0.02815 0.00015 172 4XX 0.00069 -0.00061 0.00081 0.00024 0.00008 173 4YY 0.00042 0.00034 -0.00090 0.00012 -0.00014 174 4ZZ -0.00031 0.00004 -0.00009 -0.00035 -0.00003 175 4XY 0.00100 -0.00000 -0.00005 0.00013 -0.00007 176 4XZ 0.00036 -0.00000 0.00012 0.00010 -0.00002 177 4YZ 0.00012 0.00008 0.00001 0.00016 -0.00005 178 17 C 1S 0.00003 0.00002 0.00007 0.00002 0.00000 179 2S -0.00019 -0.00018 -0.00096 -0.00024 -0.00000 180 2PX -0.00072 0.00043 -0.00057 -0.00012 0.00000 181 2PY -0.00349 -0.00234 -0.00271 -0.00007 -0.00001 182 2PZ -0.00118 -0.00083 0.00020 -0.00028 -0.00000 183 3S -0.00457 -0.00267 -0.00860 -0.00238 -0.00011 184 3PX 0.00042 -0.00042 0.00204 0.00095 -0.00001 185 3PY -0.00680 -0.00212 -0.00259 0.00051 -0.00024 186 3PZ -0.00242 -0.00078 0.00149 0.00045 -0.00007 187 4XX 0.00004 0.00002 0.00002 0.00001 0.00000 188 4YY -0.00002 -0.00008 -0.00019 0.00032 -0.00000 189 4ZZ -0.00001 0.00001 0.00026 -0.00013 0.00000 190 4XY 0.00010 -0.00003 0.00009 0.00006 -0.00000 191 4XZ 0.00003 -0.00001 0.00005 0.00000 -0.00000 192 4YZ -0.00003 -0.00001 0.00010 -0.00003 -0.00000 193 18 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 194 2S 0.00004 0.00005 0.00005 0.00002 0.00000 195 2PX 0.00005 0.00008 0.00003 0.00001 0.00000 196 2PY 0.00010 0.00013 0.00019 -0.00001 0.00000 197 2PZ 0.00004 0.00002 -0.00004 0.00005 0.00000 198 3S 0.00038 0.00066 0.00087 0.00028 -0.00000 199 3PX 0.00047 0.00027 0.00060 0.00015 -0.00000 200 3PY 0.00054 0.00082 0.00128 -0.00025 0.00000 201 3PZ 0.00030 0.00006 -0.00041 0.00026 0.00000 202 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 203 4YY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 204 4ZZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 205 4XY 0.00000 0.00000 -0.00000 0.00000 -0.00000 206 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 207 4YZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 208 19 C 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 209 2S 0.00000 0.00001 0.00000 0.00000 0.00000 210 2PX 0.00001 -0.00001 0.00002 0.00001 0.00000 211 2PY 0.00000 0.00004 0.00002 -0.00001 -0.00000 212 2PZ 0.00000 0.00001 -0.00002 0.00001 0.00000 213 3S 0.00005 0.00004 0.00006 0.00002 0.00000 214 3PX 0.00007 -0.00026 0.00011 0.00002 0.00000 215 3PY 0.00001 0.00029 0.00016 -0.00021 -0.00000 216 3PZ 0.00004 0.00001 -0.00024 0.00003 0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 219 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 220 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 221 4XZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 222 4YZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 223 20 C 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 224 2S 0.00006 0.00000 0.00002 0.00001 -0.00000 225 2PX 0.00023 0.00003 0.00009 0.00004 -0.00000 226 2PY 0.00003 -0.00010 0.00000 -0.00001 -0.00000 227 2PZ 0.00001 -0.00004 -0.00001 -0.00002 -0.00000 228 3S 0.00090 0.00078 0.00008 0.00007 -0.00001 229 3PX 0.00174 0.00099 0.00035 0.00018 -0.00002 230 3PY 0.00043 0.00002 -0.00003 -0.00008 -0.00001 231 3PZ 0.00015 0.00000 -0.00010 -0.00027 -0.00000 232 4XX -0.00001 -0.00001 -0.00000 -0.00000 0.00000 233 4YY 0.00000 0.00000 -0.00000 0.00000 -0.00000 234 4ZZ -0.00000 0.00000 0.00000 -0.00000 0.00000 235 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 236 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 237 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 238 21 C 1S 0.00011 -0.00000 -0.00001 -0.00000 -0.00000 239 2S -0.00165 0.00027 0.00026 0.00009 0.00006 240 2PX -0.00815 0.00337 -0.00110 -0.00052 0.00029 241 2PY -0.00040 0.00046 0.00010 0.00010 -0.00000 242 2PZ -0.00031 0.00037 0.00011 0.00121 0.00000 243 3S -0.01195 -0.00573 -0.00017 -0.00038 0.00063 244 3PX -0.00641 0.00674 -0.00182 -0.00075 0.00077 245 3PY 0.00068 0.00174 -0.00082 0.00028 -0.00004 246 3PZ -0.00013 0.00110 0.00026 0.00307 -0.00001 247 4XX 0.00018 0.00040 0.00001 0.00002 0.00000 248 4YY -0.00006 -0.00004 0.00000 -0.00000 -0.00000 249 4ZZ 0.00003 -0.00005 0.00000 -0.00000 -0.00000 250 4XY 0.00009 0.00004 -0.00001 0.00002 -0.00000 251 4XZ 0.00003 0.00002 0.00002 0.00014 -0.00000 252 4YZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 253 22 H 1S -0.00085 0.00055 -0.00015 -0.00003 0.00000 254 2S -0.00362 -0.00065 0.00022 0.00007 -0.00008 255 23 H 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 256 2S -0.00008 -0.00006 -0.00002 -0.00001 0.00000 257 24 H 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 258 2S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 259 25 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 260 2S -0.00006 -0.00002 -0.00007 -0.00002 -0.00000 261 26 H 1S -0.00025 0.00002 -0.00035 -0.00008 0.00000 262 2S -0.00246 0.00010 -0.00205 -0.00094 0.00004 263 27 H 1S 0.04542 0.00512 0.03880 0.01491 -0.00132 264 2S 0.01300 0.00367 0.02468 0.00968 -0.00243 11 12 13 14 15 11 4YY 0.00121 12 4ZZ 0.00010 0.00079 13 4XY 0.00000 0.00000 0.00126 14 4XZ 0.00000 -0.00000 -0.00000 0.00101 15 4YZ -0.00000 0.00000 0.00000 -0.00000 0.00088 16 2 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 17 2S -0.00036 -0.00022 0.00002 -0.00000 -0.00000 18 2PX -0.00097 -0.00074 0.00004 0.00004 -0.00000 19 2PY 0.00000 0.00000 0.00146 -0.00000 0.00001 20 2PZ -0.00001 -0.00000 -0.00000 0.00165 -0.00000 21 3S -0.00168 -0.00055 0.00000 -0.00000 -0.00000 22 3PX -0.00147 -0.00109 0.00000 0.00001 -0.00000 23 3PY 0.00001 -0.00000 0.00085 -0.00000 0.00000 24 3PZ -0.00001 0.00000 0.00000 0.00100 -0.00000 25 4XX -0.00004 -0.00005 0.00001 0.00000 0.00000 26 4YY 0.00003 0.00000 0.00000 0.00000 0.00000 27 4ZZ 0.00000 0.00002 -0.00000 0.00000 0.00000 28 4XY -0.00000 0.00000 -0.00012 0.00000 -0.00000 29 4XZ 0.00000 0.00000 0.00000 -0.00012 -0.00000 30 4YZ 0.00000 -0.00000 -0.00000 0.00001 0.00001 31 3 H 1S -0.00000 0.00001 0.00001 0.00010 -0.00000 32 2S -0.00008 0.00018 0.00004 0.00029 0.00000 33 4 Br 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 34 2S 0.00000 -0.00000 0.00000 0.00000 0.00000 35 3S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 36 4S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 37 5S 0.00001 0.00000 0.00001 0.00001 0.00001 38 6S 0.00005 0.00004 -0.00004 -0.00003 0.00001 39 7PX 0.00000 -0.00000 0.00000 0.00000 0.00000 40 7PY 0.00000 0.00000 0.00000 0.00000 0.00000 41 7PZ 0.00000 -0.00000 0.00000 0.00000 0.00000 42 8PX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 43 8PY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 44 8PZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 45 9PX 0.00002 -0.00000 0.00005 0.00002 0.00004 46 9PY -0.00000 0.00000 0.00004 0.00004 0.00001 47 9PZ 0.00002 -0.00001 0.00004 0.00001 0.00000 48 10PX 0.00025 -0.00001 0.00017 0.00007 0.00022 49 10PY -0.00001 0.00010 0.00010 0.00014 0.00002 50 10PZ 0.00024 -0.00011 0.00014 0.00003 0.00001 51 11XX 0.00000 -0.00000 0.00000 0.00000 0.00000 52 11YY 0.00000 -0.00000 0.00000 -0.00000 0.00000 53 11ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 54 11XY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 55 11XZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 56 11YZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 57 12XX 0.00000 -0.00000 0.00000 0.00000 0.00000 58 12YY 0.00000 -0.00000 0.00001 0.00002 0.00001 59 12ZZ 0.00000 -0.00000 0.00002 0.00000 0.00000 60 12XY -0.00001 -0.00000 0.00001 0.00001 0.00001 61 12XZ -0.00000 -0.00000 0.00000 0.00001 0.00000 62 12YZ -0.00000 -0.00000 0.00002 0.00001 0.00000 63 5 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 64 2S 0.00000 0.00000 0.00001 0.00000 0.00000 65 2PX 0.00000 0.00000 0.00003 0.00000 0.00000 66 2PY 0.00000 0.00000 0.00001 0.00000 0.00000 67 2PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 68 3S 0.00011 -0.00000 0.00008 0.00002 0.00001 69 3PX 0.00019 0.00001 0.00012 0.00000 0.00002 70 3PY 0.00003 -0.00000 0.00002 0.00001 0.00000 71 3PZ 0.00001 -0.00000 -0.00001 -0.00002 0.00000 72 4XX -0.00000 -0.00000 0.00000 0.00000 -0.00000 73 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 74 4ZZ -0.00000 0.00000 -0.00000 0.00000 0.00000 75 4XY -0.00000 -0.00000 0.00000 0.00000 -0.00000 76 4XZ -0.00000 0.00000 0.00000 0.00000 -0.00000 77 4YZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 78 6 C 1S 0.00000 -0.00000 0.00000 0.00000 -0.00000 79 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 80 2PX 0.00000 0.00000 0.00000 -0.00000 0.00000 81 2PY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 82 2PZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 83 3S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 84 3PX 0.00000 0.00001 -0.00000 -0.00000 0.00000 85 3PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 86 3PZ -0.00000 0.00000 -0.00001 -0.00000 -0.00000 87 4XX 0.00000 -0.00000 0.00000 0.00000 -0.00000 88 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 89 4ZZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 90 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 91 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 92 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 93 7 C 1S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 94 2S 0.00000 -0.00000 0.00000 0.00000 0.00000 95 2PX -0.00000 -0.00000 0.00000 0.00000 0.00000 96 2PY 0.00000 -0.00000 0.00000 0.00000 0.00000 97 2PZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 98 3S 0.00000 0.00000 0.00000 0.00000 0.00000 99 3PX -0.00000 -0.00000 0.00000 0.00000 0.00000 100 3PY 0.00000 0.00000 0.00000 0.00000 0.00000 101 3PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 102 4XX 0.00000 0.00000 0.00000 -0.00000 0.00000 103 4YY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 104 4ZZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 105 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 106 4XZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 107 4YZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 108 8 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 109 2S 0.00000 0.00000 0.00000 0.00000 0.00000 110 2PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 111 2PY 0.00000 0.00000 0.00000 -0.00000 0.00000 112 2PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 113 3S 0.00000 0.00000 0.00000 0.00000 0.00000 114 3PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 115 3PY 0.00000 0.00000 0.00000 -0.00000 0.00000 116 3PZ 0.00000 0.00000 0.00000 0.00000 0.00000 117 4XX -0.00000 -0.00000 0.00000 0.00000 0.00000 118 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 119 4ZZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 120 4XY -0.00000 -0.00000 0.00000 0.00000 0.00000 121 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 122 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 123 9 C 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 124 2S 0.00000 0.00000 0.00000 0.00000 -0.00000 125 2PX -0.00000 -0.00000 0.00000 0.00000 0.00000 126 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 127 2PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 128 3S 0.00000 0.00000 0.00000 0.00000 -0.00000 129 3PX -0.00000 0.00000 0.00000 0.00000 0.00000 130 3PY 0.00000 0.00000 0.00000 -0.00000 -0.00000 131 3PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 132 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 133 4YY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 134 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 135 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 136 4XZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 137 4YZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 138 10 C 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 139 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 140 2PX 0.00000 0.00000 -0.00000 0.00000 0.00000 141 2PY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 142 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 143 3S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 144 3PX 0.00001 0.00000 -0.00000 0.00000 -0.00000 145 3PY -0.00000 0.00000 -0.00001 -0.00000 0.00000 146 3PZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 147 4XX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 148 4YY 0.00000 0.00000 0.00000 0.00000 -0.00000 149 4ZZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 150 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 151 4XZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 152 4YZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 153 11 H 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 154 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 155 12 H 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 156 2S -0.00000 -0.00000 -0.00000 0.00000 0.00000 157 13 H 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 158 2S -0.00000 -0.00000 0.00000 0.00000 0.00000 159 14 H 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 160 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 161 15 H 1S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 162 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 163 16 C 1S -0.00001 0.00001 -0.00015 -0.00006 -0.00003 164 2S -0.00005 -0.00030 0.00158 0.00060 0.00025 165 2PX 0.00057 -0.00027 0.00092 0.00037 0.00071 166 2PY -0.00073 -0.00013 0.00021 0.00106 -0.00000 167 2PZ 0.00022 0.00000 0.00104 0.00028 0.00022 168 3S -0.00024 -0.00019 0.00071 0.00025 -0.00001 169 3PX 0.00026 0.00004 0.00000 -0.00000 0.00006 170 3PY -0.00067 0.00050 0.00004 0.00019 -0.00001 171 3PZ 0.00059 -0.00042 0.00019 0.00043 0.00026 172 4XX -0.00016 -0.00003 0.00002 0.00000 -0.00007 173 4YY 0.00003 0.00002 -0.00004 -0.00003 0.00002 174 4ZZ 0.00002 0.00000 -0.00005 0.00000 -0.00000 175 4XY -0.00001 -0.00003 0.00003 0.00002 0.00003 176 4XZ 0.00001 0.00000 0.00001 -0.00000 -0.00001 177 4YZ 0.00002 0.00000 -0.00000 0.00000 -0.00001 178 17 C 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 179 2S 0.00001 0.00000 -0.00000 -0.00000 0.00001 180 2PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 181 2PY 0.00004 0.00002 -0.00001 0.00000 0.00005 182 2PZ 0.00004 -0.00000 0.00001 -0.00000 -0.00000 183 3S 0.00027 0.00008 -0.00005 -0.00002 0.00007 184 3PX -0.00001 -0.00001 -0.00001 -0.00000 0.00000 185 3PY 0.00023 0.00020 -0.00005 0.00001 0.00016 186 3PZ 0.00030 -0.00006 0.00002 -0.00001 -0.00001 187 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 188 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 189 4ZZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 190 4XY -0.00000 -0.00000 0.00000 0.00000 -0.00000 191 4XZ -0.00000 -0.00000 0.00000 0.00000 0.00000 192 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 193 18 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 194 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 195 2PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 196 2PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 197 2PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 198 3S -0.00000 -0.00000 0.00000 0.00000 -0.00000 199 3PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 200 3PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 201 3PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 202 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 203 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 204 4ZZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 205 4XY -0.00000 0.00000 -0.00000 0.00000 0.00000 206 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 207 4YZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 208 19 C 1S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 209 2S -0.00000 -0.00000 0.00000 0.00000 0.00000 210 2PX -0.00000 -0.00000 0.00000 0.00000 0.00000 211 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 212 2PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 213 3S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 214 3PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 215 3PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 216 3PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 217 4XX -0.00000 -0.00000 0.00000 0.00000 -0.00000 218 4YY 0.00000 -0.00000 -0.00000 0.00000 0.00000 219 4ZZ -0.00000 0.00000 0.00000 -0.00000 0.00000 220 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 221 4XZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 222 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 223 20 C 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 224 2S 0.00000 0.00000 0.00000 0.00000 0.00000 225 2PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 226 2PY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 227 2PZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 228 3S 0.00000 -0.00000 0.00000 0.00000 0.00000 229 3PX 0.00000 0.00000 0.00000 0.00000 0.00000 230 3PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 231 3PZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 232 4XX -0.00000 -0.00000 0.00000 0.00000 -0.00000 233 4YY -0.00000 0.00000 -0.00000 0.00000 0.00000 234 4ZZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 235 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 236 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 237 4YZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 238 21 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 239 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 240 2PX -0.00002 -0.00000 0.00001 0.00001 -0.00000 241 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 242 2PZ 0.00000 0.00000 0.00000 0.00001 0.00000 243 3S -0.00015 -0.00002 -0.00002 -0.00001 -0.00001 244 3PX -0.00019 -0.00007 -0.00003 -0.00000 -0.00000 245 3PY -0.00000 0.00001 0.00001 0.00001 -0.00000 246 3PZ 0.00002 -0.00001 0.00001 0.00010 0.00001 247 4XX -0.00000 -0.00000 0.00000 0.00000 0.00000 248 4YY 0.00000 0.00000 0.00000 -0.00000 -0.00000 249 4ZZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 250 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 251 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 252 4YZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 254 2S 0.00004 0.00001 0.00002 0.00000 0.00000 255 23 H 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 256 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 257 24 H 1S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 258 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 259 25 H 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 260 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 261 26 H 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 262 2S -0.00004 -0.00001 0.00000 0.00000 -0.00001 263 27 H 1S 0.00309 -0.00021 0.00149 0.00054 0.00256 264 2S 0.00313 0.00051 0.00025 0.00008 0.00035 16 17 18 19 20 16 2 C 1S 2.05385 17 2S -0.01311 0.32601 18 2PX 0.00000 0.00000 0.40745 19 2PY 0.00000 0.00000 0.00000 0.35819 20 2PZ 0.00000 0.00000 -0.00000 -0.00000 0.39643 21 3S -0.04141 0.27882 0.00000 0.00000 0.00000 22 3PX 0.00000 0.00000 0.09003 0.00000 0.00000 23 3PY 0.00000 0.00000 0.00000 0.09828 -0.00000 24 3PZ 0.00000 0.00000 -0.00000 -0.00000 0.11161 25 4XX -0.00122 -0.00260 0.00000 0.00000 0.00000 26 4YY -0.00116 -0.00487 0.00000 0.00000 0.00000 27 4ZZ -0.00130 -0.00192 0.00000 0.00000 0.00000 28 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 29 4XZ 0.00000 -0.00000 0.00000 0.00000 0.00000 30 4YZ 0.00000 -0.00000 0.00000 0.00000 0.00000 31 3 H 1S -0.00188 0.03063 0.01260 0.01283 0.07712 32 2S -0.00050 0.00771 0.00573 0.00622 0.03690 33 4 Br 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 34 2S 0.00000 0.00000 0.00000 0.00000 0.00000 35 3S -0.00000 0.00000 -0.00000 -0.00001 -0.00001 36 4S -0.00000 0.00002 -0.00000 -0.00006 -0.00005 37 5S 0.00000 -0.00056 0.00006 0.00155 0.00120 38 6S 0.00067 -0.00823 -0.00001 -0.00576 -0.00373 39 7PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 40 7PY -0.00000 0.00000 0.00000 0.00000 0.00000 41 7PZ -0.00000 0.00000 0.00000 0.00000 0.00000 42 8PX 0.00000 -0.00000 0.00001 -0.00001 0.00000 43 8PY 0.00000 -0.00004 -0.00002 -0.00038 -0.00025 44 8PZ 0.00000 -0.00003 -0.00001 -0.00023 -0.00013 45 9PX -0.00000 0.00007 -0.00057 0.00024 -0.00004 46 9PY -0.00008 0.00284 0.00071 0.01471 0.01050 47 9PZ -0.00004 0.00171 0.00030 0.00964 0.00464 48 10PX -0.00001 0.00012 -0.00403 0.00021 -0.00025 49 10PY -0.00031 0.00231 0.00101 0.01432 0.01242 50 10PZ -0.00005 0.00180 0.00037 0.01123 0.00220 51 11XX -0.00000 0.00000 0.00000 0.00002 0.00001 52 11YY 0.00000 -0.00002 -0.00000 0.00002 -0.00003 53 11ZZ 0.00000 -0.00000 -0.00000 -0.00001 0.00004 54 11XY 0.00000 -0.00000 -0.00001 -0.00000 -0.00000 55 11XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 56 11YZ 0.00000 -0.00003 -0.00000 -0.00006 -0.00002 57 12XX 0.00000 -0.00006 0.00005 -0.00004 0.00011 58 12YY -0.00010 0.00199 0.00008 0.00144 0.00481 59 12ZZ -0.00004 0.00060 0.00007 0.00264 -0.00009 60 12XY -0.00000 0.00008 0.00094 0.00022 0.00025 61 12XZ -0.00000 0.00003 0.00051 0.00016 0.00009 62 12YZ -0.00015 0.00242 0.00016 0.00400 0.00140 63 5 C 1S 0.00000 -0.00023 -0.00037 -0.00097 -0.00017 64 2S -0.00024 0.00635 0.00722 0.01804 0.00315 65 2PX -0.00042 0.00743 0.00114 0.02278 0.00283 66 2PY -0.00108 0.02142 0.02091 0.02639 0.00920 67 2PZ -0.00010 0.00211 0.00211 0.00651 -0.00059 68 3S 0.00032 0.00236 0.00483 0.01942 0.00457 69 3PX 0.00046 -0.00140 -0.00050 0.00621 -0.00064 70 3PY 0.00080 0.00204 0.00203 0.00229 0.00072 71 3PZ -0.00016 0.00059 -0.00029 -0.00030 -0.00241 72 4XX -0.00000 0.00013 -0.00022 0.00031 0.00009 73 4YY -0.00006 0.00115 0.00131 -0.00016 0.00027 74 4ZZ 0.00001 -0.00039 -0.00022 -0.00076 0.00002 75 4XY -0.00006 0.00107 0.00004 0.00125 0.00043 76 4XZ -0.00001 0.00018 0.00002 0.00036 0.00008 77 4YZ -0.00003 0.00047 0.00048 0.00037 0.00029 78 6 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 79 2S 0.00000 -0.00004 -0.00003 -0.00007 -0.00008 80 2PX 0.00000 -0.00005 -0.00000 -0.00005 -0.00008 81 2PY 0.00000 -0.00006 -0.00006 -0.00007 -0.00009 82 2PZ 0.00000 -0.00008 -0.00007 -0.00025 -0.00010 83 3S 0.00004 -0.00115 -0.00086 -0.00199 -0.00200 84 3PX 0.00001 -0.00037 0.00000 -0.00021 -0.00016 85 3PY 0.00001 -0.00009 0.00014 0.00003 0.00089 86 3PZ 0.00005 -0.00106 -0.00065 -0.00246 -0.00127 87 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 88 4YY -0.00000 0.00000 0.00000 0.00001 0.00001 89 4ZZ 0.00000 -0.00000 -0.00001 -0.00001 -0.00000 90 4XY -0.00000 0.00000 0.00000 0.00001 0.00001 91 4XZ -0.00000 0.00000 0.00000 0.00001 0.00001 92 4YZ -0.00000 0.00001 0.00001 0.00002 0.00002 93 7 C 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 94 2S -0.00000 0.00000 0.00000 0.00000 0.00000 95 2PX -0.00000 0.00000 0.00000 0.00000 0.00000 96 2PY -0.00000 0.00000 0.00000 0.00000 0.00000 97 2PZ -0.00000 0.00000 0.00000 0.00000 0.00000 98 3S -0.00000 0.00002 0.00003 0.00004 0.00004 99 3PX -0.00000 0.00002 0.00001 0.00002 0.00004 100 3PY -0.00000 0.00003 0.00004 0.00007 0.00005 101 3PZ 0.00000 -0.00001 0.00001 0.00001 0.00001 102 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 103 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 104 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 105 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 106 4XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 107 4YZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 108 8 C 1S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 109 2S 0.00000 -0.00000 0.00000 0.00000 0.00000 110 2PX -0.00000 0.00000 -0.00000 -0.00000 0.00000 111 2PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 112 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 113 3S -0.00000 0.00000 0.00000 0.00000 0.00000 114 3PX -0.00000 0.00000 -0.00000 -0.00000 0.00000 115 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 116 3PZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 117 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 118 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 119 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 120 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 121 4XZ -0.00000 0.00000 0.00000 0.00000 -0.00000 122 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 123 9 C 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 124 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 125 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 126 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 127 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 128 3S -0.00000 0.00003 0.00005 0.00006 -0.00000 129 3PX -0.00000 0.00004 0.00003 0.00003 -0.00000 130 3PY -0.00000 0.00006 0.00008 0.00012 -0.00000 131 3PZ 0.00000 -0.00000 -0.00000 -0.00001 0.00000 132 4XX 0.00000 -0.00000 0.00000 -0.00000 0.00000 133 4YY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 134 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 135 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 136 4XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 137 4YZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 138 10 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 139 2S 0.00000 -0.00008 -0.00008 -0.00013 -0.00001 140 2PX 0.00000 -0.00011 -0.00003 -0.00010 0.00004 141 2PY 0.00000 -0.00023 -0.00028 -0.00030 0.00000 142 2PZ 0.00000 -0.00001 -0.00002 -0.00005 -0.00001 143 3S 0.00015 -0.00259 -0.00165 -0.00249 0.00014 144 3PX 0.00005 -0.00083 0.00018 -0.00030 0.00030 145 3PY 0.00009 -0.00084 0.00002 -0.00050 0.00016 146 3PZ 0.00004 -0.00041 -0.00037 -0.00073 -0.00067 147 4XX -0.00000 0.00000 0.00000 0.00002 -0.00000 148 4YY -0.00000 0.00002 0.00004 0.00005 -0.00000 149 4ZZ 0.00000 -0.00000 -0.00001 -0.00001 0.00000 150 4XY -0.00000 0.00001 0.00001 0.00004 -0.00000 151 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 152 4YZ 0.00000 -0.00000 0.00000 0.00000 0.00000 153 11 H 1S 0.00000 -0.00001 -0.00001 -0.00002 -0.00000 154 2S 0.00002 -0.00056 -0.00038 -0.00086 0.00033 155 12 H 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 156 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 157 13 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 158 2S -0.00000 0.00000 0.00000 0.00000 0.00000 159 14 H 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 160 2S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 161 15 H 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00001 162 2S 0.00002 -0.00041 -0.00016 -0.00019 -0.00102 163 16 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 164 2S 0.00000 -0.00002 -0.00011 -0.00001 -0.00001 165 2PX 0.00000 -0.00011 -0.00043 -0.00003 -0.00002 166 2PY 0.00000 -0.00001 -0.00006 -0.00000 -0.00001 167 2PZ 0.00000 -0.00001 -0.00002 -0.00000 -0.00000 168 3S -0.00001 -0.00016 -0.00129 -0.00063 -0.00031 169 3PX -0.00007 0.00038 -0.00005 -0.00052 -0.00048 170 3PY -0.00002 0.00028 0.00017 0.00014 -0.00024 171 3PZ -0.00000 -0.00001 0.00009 -0.00011 -0.00015 172 4XX -0.00000 0.00001 0.00006 0.00000 0.00000 173 4YY 0.00000 -0.00000 -0.00001 -0.00000 0.00000 174 4ZZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 175 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 176 4XZ 0.00000 -0.00000 0.00000 0.00000 0.00000 177 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 178 17 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 179 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 180 2PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 181 2PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 182 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 183 3S 0.00000 0.00001 -0.00006 -0.00006 -0.00001 184 3PX 0.00001 -0.00012 -0.00020 0.00007 0.00006 185 3PY 0.00000 -0.00006 -0.00011 0.00004 -0.00006 186 3PZ 0.00000 -0.00002 -0.00006 -0.00003 0.00001 187 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 188 4YY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 189 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 190 4XY 0.00000 -0.00000 -0.00000 0.00000 0.00000 191 4XZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 192 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 193 18 C 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 194 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 195 2PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 196 2PY -0.00000 0.00000 0.00000 0.00000 0.00000 197 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 198 3S 0.00000 -0.00000 -0.00000 0.00000 0.00000 199 3PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 200 3PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 201 3PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 202 4XX -0.00000 0.00000 0.00000 -0.00000 -0.00000 203 4YY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 204 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 205 4XY -0.00000 0.00000 -0.00000 0.00000 -0.00000 206 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 207 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 210 2PX 0.00000 0.00000 -0.00000 -0.00000 -0.00000 211 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 212 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 213 3S -0.00000 0.00000 0.00000 -0.00000 -0.00000 214 3PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 215 3PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 216 3PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY 0.00000 -0.00000 -0.00000 0.00000 0.00000 219 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 220 4XY 0.00000 -0.00000 -0.00000 0.00000 0.00000 221 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 222 4YZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 224 2S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 225 2PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 226 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 227 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 228 3S 0.00000 -0.00000 -0.00000 0.00000 0.00000 229 3PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 230 3PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 231 3PZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 232 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 233 4YY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 234 4ZZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 235 4XY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 236 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 237 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 238 21 C 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 239 2S -0.00000 0.00000 0.00000 0.00000 0.00000 240 2PX -0.00000 0.00000 0.00000 0.00000 0.00000 241 2PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 242 2PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 243 3S -0.00000 0.00003 0.00012 0.00000 0.00000 244 3PX 0.00000 0.00001 0.00006 0.00001 0.00000 245 3PY 0.00000 -0.00000 -0.00002 -0.00000 -0.00000 246 3PZ 0.00000 -0.00000 -0.00001 -0.00000 -0.00001 247 4XX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 248 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 249 4ZZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 250 4XY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 251 4XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 252 4YZ -0.00000 0.00000 0.00000 -0.00000 0.00000 253 22 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 254 2S -0.00000 0.00000 0.00001 -0.00000 0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 256 2S -0.00000 0.00000 0.00000 0.00000 0.00000 257 24 H 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 258 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 259 25 H 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 260 2S 0.00000 -0.00000 -0.00000 0.00000 0.00000 261 26 H 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 262 2S -0.00000 0.00006 0.00013 -0.00014 -0.00005 263 27 H 1S 0.00000 -0.00021 -0.00057 -0.00012 -0.00006 264 2S 0.00021 -0.00291 -0.00612 -0.00170 -0.00050 21 22 23 24 25 21 3S 0.45413 22 3PX 0.00000 0.08075 23 3PY 0.00000 0.00000 0.09844 24 3PZ 0.00000 0.00000 -0.00000 0.10611 25 4XX -0.00468 0.00000 0.00000 0.00000 0.00184 26 4YY -0.00316 0.00000 0.00000 0.00000 -0.00024 27 4ZZ 0.00074 0.00000 0.00000 0.00000 -0.00024 28 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 29 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 30 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 31 3 H 1S 0.04649 0.00560 0.00784 0.04873 -0.00132 32 2S 0.01514 0.00355 0.00509 0.03582 -0.00206 33 4 Br 1S 0.00002 -0.00000 -0.00002 0.00001 0.00000 34 2S -0.00063 0.00002 0.00051 -0.00018 -0.00000 35 3S 0.00138 -0.00002 -0.00074 0.00039 0.00000 36 4S 0.00438 -0.00005 -0.00186 0.00119 0.00000 37 5S -0.00430 -0.00016 -0.00162 0.00067 -0.00005 38 6S -0.02668 -0.00049 -0.01688 -0.01152 -0.00002 39 7PX -0.00000 0.00000 0.00000 0.00000 0.00000 40 7PY 0.00006 -0.00000 0.00000 0.00006 -0.00000 41 7PZ 0.00002 -0.00000 0.00004 0.00001 -0.00000 42 8PX 0.00001 -0.00009 -0.00001 -0.00002 -0.00000 43 8PY -0.00170 -0.00007 -0.00085 -0.00209 0.00000 44 8PZ -0.00025 0.00003 -0.00235 -0.00027 0.00000 45 9PX -0.00019 0.00103 -0.00002 0.00007 0.00000 46 9PY 0.02018 0.00123 0.01033 0.02297 -0.00020 47 9PZ 0.00039 -0.00016 0.02908 0.00183 -0.00007 48 10PX -0.00043 0.00059 -0.00028 -0.00011 -0.00013 49 10PY 0.03000 0.00125 0.00508 0.02304 -0.00111 50 10PZ -0.00707 -0.00045 0.03327 -0.00174 -0.00034 51 11XX -0.00076 0.00001 0.00153 -0.00007 -0.00000 52 11YY -0.00225 -0.00001 0.00109 -0.00127 -0.00000 53 11ZZ -0.00141 0.00008 -0.00004 0.00006 -0.00000 54 11XY -0.00001 -0.00006 -0.00000 -0.00002 0.00000 55 11XZ 0.00000 -0.00003 -0.00001 -0.00000 0.00000 56 11YZ -0.00017 -0.00002 -0.00016 -0.00003 0.00000 57 12XX -0.00193 -0.00000 0.00038 -0.00003 -0.00000 58 12YY 0.00238 0.00020 0.00179 0.00525 -0.00009 59 12ZZ -0.00087 0.00006 0.00518 -0.00036 -0.00007 60 12XY 0.00006 0.00102 0.00006 0.00017 0.00000 61 12XZ -0.00004 0.00056 0.00011 0.00001 0.00000 62 12YZ 0.00314 0.00009 0.00190 0.00031 -0.00008 63 5 C 1S -0.00018 0.00006 -0.00099 -0.00019 -0.00000 64 2S 0.00193 0.00232 0.01129 0.00207 -0.00011 65 2PX 0.01459 0.00128 0.01088 0.00095 -0.00041 66 2PY 0.03002 0.01467 0.00688 0.00681 0.00028 67 2PZ 0.00301 0.00224 0.00461 0.00169 0.00005 68 3S -0.02434 -0.00193 0.00400 0.00189 0.00005 69 3PX -0.00167 0.00901 -0.00027 -0.00197 -0.00112 70 3PY -0.01246 0.00354 -0.00077 0.00029 0.00145 71 3PZ -0.00064 -0.00023 -0.00077 -0.00243 0.00006 72 4XX 0.00050 -0.00020 0.00075 0.00017 0.00002 73 4YY 0.00318 0.00096 -0.00002 0.00031 -0.00011 74 4ZZ -0.00165 -0.00044 -0.00105 -0.00030 0.00000 75 4XY 0.00064 -0.00004 0.00012 0.00011 0.00001 76 4XZ 0.00011 -0.00000 0.00009 0.00013 -0.00000 77 4YZ 0.00033 0.00010 0.00004 0.00019 -0.00003 78 6 C 1S 0.00007 0.00004 0.00009 0.00007 -0.00000 79 2S -0.00088 -0.00051 -0.00079 -0.00111 0.00000 80 2PX -0.00076 -0.00000 -0.00110 -0.00019 -0.00000 81 2PY -0.00258 -0.00107 -0.00078 -0.00094 0.00001 82 2PZ -0.00199 -0.00111 -0.00245 -0.00005 0.00000 83 3S -0.00732 -0.00316 -0.00626 -0.00522 0.00002 84 3PX 0.00028 0.00037 -0.00114 0.00104 -0.00014 85 3PY -0.00219 0.00007 0.00009 0.00136 0.00012 86 3PZ -0.00493 -0.00197 -0.00409 -0.00067 -0.00002 87 4XX 0.00009 -0.00001 0.00008 -0.00000 -0.00000 88 4YY 0.00018 0.00014 0.00012 0.00019 0.00000 89 4ZZ -0.00027 -0.00012 -0.00023 -0.00008 0.00000 90 4XY 0.00004 0.00000 0.00002 0.00002 -0.00000 91 4XZ 0.00005 -0.00000 0.00003 0.00001 -0.00000 92 4YZ 0.00010 0.00009 0.00006 0.00011 0.00000 93 7 C 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 94 2S 0.00003 0.00003 0.00005 0.00002 -0.00000 95 2PX 0.00003 0.00005 0.00005 0.00005 0.00000 96 2PY 0.00008 0.00004 0.00010 -0.00002 -0.00000 97 2PZ 0.00003 0.00002 0.00006 0.00002 -0.00000 98 3S 0.00048 0.00036 0.00063 0.00043 -0.00000 99 3PX 0.00032 0.00027 0.00037 0.00056 0.00000 100 3PY 0.00081 0.00015 0.00069 0.00004 -0.00000 101 3PZ 0.00012 0.00008 0.00020 0.00008 -0.00000 102 4XX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 103 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 104 4ZZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 105 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 106 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 107 4YZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 108 8 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 109 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 110 2PX -0.00000 0.00001 0.00001 0.00000 0.00000 111 2PY 0.00000 -0.00001 0.00001 -0.00000 -0.00000 112 2PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 113 3S 0.00002 0.00001 0.00011 0.00000 -0.00000 114 3PX -0.00003 0.00016 0.00010 0.00006 0.00000 115 3PY 0.00008 -0.00025 0.00001 -0.00004 -0.00000 116 3PZ 0.00001 0.00002 0.00005 0.00000 -0.00000 117 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 118 4YY 0.00000 0.00000 0.00000 0.00000 -0.00000 119 4ZZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 120 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 121 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 122 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 123 9 C 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 124 2S 0.00004 0.00002 0.00005 -0.00000 -0.00000 125 2PX 0.00004 0.00004 0.00004 -0.00000 0.00000 126 2PY 0.00014 0.00004 0.00012 -0.00001 -0.00000 127 2PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 128 3S 0.00061 0.00036 0.00057 -0.00001 -0.00000 129 3PX 0.00038 0.00031 0.00031 0.00001 0.00000 130 3PY 0.00124 0.00027 0.00087 -0.00007 -0.00001 131 3PZ -0.00003 -0.00001 -0.00003 -0.00001 0.00000 132 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 133 4YY -0.00000 0.00000 -0.00000 -0.00000 0.00000 134 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 135 4XY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 136 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 137 4YZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 138 10 C 1S 0.00009 0.00004 0.00006 0.00000 -0.00000 139 2S -0.00119 -0.00043 -0.00057 -0.00019 0.00000 140 2PX -0.00153 -0.00049 -0.00150 0.00088 -0.00001 141 2PY -0.00525 -0.00037 -0.00124 0.00039 0.00003 142 2PZ -0.00024 -0.00006 -0.00081 -0.00046 0.00000 143 3S -0.01065 -0.00269 -0.00453 0.00054 0.00011 144 3PX -0.00095 0.00007 -0.00151 0.00160 -0.00023 145 3PY -0.00590 0.00279 0.00109 0.00009 0.00030 146 3PZ -0.00178 -0.00059 -0.00177 -0.00259 0.00002 147 4XX 0.00013 -0.00004 0.00014 -0.00001 -0.00000 148 4YY 0.00028 0.00032 0.00032 -0.00003 0.00000 149 4ZZ -0.00021 -0.00012 -0.00022 0.00001 0.00000 150 4XY 0.00009 0.00000 0.00012 -0.00000 -0.00000 151 4XZ -0.00001 -0.00001 -0.00001 -0.00001 -0.00000 152 4YZ -0.00004 -0.00000 -0.00002 -0.00001 0.00000 153 11 H 1S -0.00055 -0.00023 0.00011 -0.00023 -0.00000 154 2S -0.00326 -0.00122 -0.00101 0.00061 -0.00001 155 12 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 156 2S -0.00006 -0.00004 -0.00009 0.00001 0.00000 157 13 H 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 158 2S 0.00000 0.00000 0.00000 0.00000 0.00000 159 14 H 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 160 2S -0.00005 -0.00002 -0.00006 -0.00003 0.00000 161 15 H 1S -0.00045 -0.00016 -0.00012 -0.00068 0.00000 162 2S -0.00311 -0.00068 -0.00052 -0.00363 0.00001 163 16 C 1S 0.00000 0.00008 0.00001 0.00000 0.00000 164 2S -0.00019 -0.00145 -0.00033 -0.00009 -0.00000 165 2PX -0.00321 -0.00624 -0.00030 -0.00007 0.00001 166 2PY 0.00053 -0.00013 -0.00004 -0.00006 0.00000 167 2PZ 0.00013 0.00015 -0.00008 -0.00029 -0.00000 168 3S -0.00043 -0.00439 -0.00138 -0.00061 -0.00004 169 3PX -0.00118 -0.00222 -0.00049 -0.00059 0.00010 170 3PY 0.00064 0.00003 0.00020 -0.00045 -0.00001 171 3PZ -0.00001 0.00051 -0.00034 -0.00099 -0.00002 172 4XX 0.00017 0.00045 0.00003 0.00001 0.00000 173 4YY -0.00006 -0.00015 -0.00000 0.00001 -0.00000 174 4ZZ -0.00001 0.00001 0.00001 0.00000 -0.00000 175 4XY -0.00003 -0.00007 0.00000 0.00001 0.00000 176 4XZ -0.00001 -0.00002 0.00001 0.00002 0.00000 177 4YZ -0.00001 -0.00001 0.00000 0.00000 0.00000 178 17 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 179 2S -0.00014 -0.00012 -0.00012 -0.00003 0.00000 180 2PX -0.00017 -0.00011 -0.00010 -0.00002 0.00000 181 2PY -0.00029 -0.00032 -0.00002 -0.00003 -0.00000 182 2PZ -0.00012 -0.00015 -0.00005 0.00000 -0.00000 183 3S -0.00116 -0.00067 -0.00044 -0.00022 0.00001 184 3PX -0.00081 -0.00041 -0.00004 0.00008 -0.00001 185 3PY -0.00116 -0.00036 -0.00009 -0.00016 -0.00003 186 3PZ -0.00050 -0.00033 -0.00020 0.00002 -0.00001 187 4XX 0.00001 0.00002 -0.00000 -0.00000 0.00000 188 4YY -0.00001 -0.00003 0.00001 -0.00001 0.00000 189 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 190 4XY 0.00000 -0.00001 0.00000 0.00000 -0.00000 191 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 192 4YZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 193 18 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 194 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 195 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 196 2PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 197 2PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 198 3S 0.00002 0.00002 0.00001 0.00000 -0.00000 199 3PX 0.00003 0.00002 0.00001 -0.00000 -0.00000 200 3PY 0.00002 0.00006 -0.00002 0.00002 -0.00000 201 3PZ -0.00000 -0.00002 0.00001 -0.00001 -0.00000 202 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 203 4YY -0.00000 0.00000 0.00000 0.00000 -0.00000 204 4ZZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 205 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 206 4XZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 207 4YZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 208 19 C 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 209 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 210 2PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 211 2PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 212 2PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 213 3S 0.00000 0.00000 -0.00000 -0.00000 0.00000 214 3PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 215 3PY 0.00000 0.00001 -0.00000 0.00000 0.00000 216 3PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 218 4YY -0.00000 -0.00000 0.00000 -0.00000 0.00000 219 4ZZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 220 4XY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 221 4XZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 222 4YZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 224 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 225 2PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 226 2PY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 227 2PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 228 3S -0.00001 -0.00004 -0.00000 0.00000 -0.00000 229 3PX -0.00003 -0.00009 -0.00000 -0.00000 -0.00000 230 3PY -0.00001 -0.00002 -0.00000 0.00000 -0.00000 231 3PZ -0.00000 -0.00001 0.00000 -0.00000 0.00000 232 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 233 4YY 0.00000 -0.00000 0.00000 -0.00000 0.00000 234 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 235 4XY -0.00000 -0.00000 0.00000 -0.00000 0.00000 236 4XZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 237 4YZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 238 21 C 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 239 2S 0.00002 0.00008 -0.00000 -0.00000 -0.00000 240 2PX 0.00015 0.00038 0.00000 0.00000 -0.00000 241 2PY 0.00000 0.00001 -0.00000 -0.00000 0.00000 242 2PZ 0.00000 0.00001 -0.00000 -0.00001 -0.00000 243 3S 0.00056 0.00151 0.00001 -0.00001 0.00000 244 3PX 0.00094 0.00133 0.00005 0.00003 0.00000 245 3PY -0.00001 -0.00008 -0.00002 -0.00000 -0.00000 246 3PZ 0.00001 0.00000 -0.00000 -0.00015 -0.00000 247 4XX 0.00000 -0.00001 -0.00000 0.00000 -0.00000 248 4YY -0.00000 0.00000 -0.00000 0.00000 0.00000 249 4ZZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 250 4XY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 251 4XZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 252 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 253 22 H 1S 0.00000 0.00001 0.00000 0.00000 0.00000 254 2S 0.00007 0.00018 -0.00000 0.00000 0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 256 2S 0.00000 0.00000 0.00000 0.00000 0.00000 257 24 H 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 258 2S -0.00000 -0.00000 0.00000 0.00000 0.00000 259 25 H 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 260 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 261 26 H 1S -0.00005 0.00006 -0.00015 -0.00004 0.00000 262 2S 0.00035 0.00064 -0.00073 -0.00017 -0.00001 263 27 H 1S -0.00429 -0.00325 -0.00015 -0.00026 0.00003 264 2S -0.01143 -0.00845 -0.00147 -0.00029 -0.00019 26 27 28 29 30 26 4YY 0.00174 27 4ZZ -0.00004 0.00155 28 4XY 0.00000 -0.00000 0.00106 29 4XZ 0.00000 -0.00000 -0.00000 0.00084 30 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00128 31 3 H 1S -0.00089 0.00466 0.00034 0.00131 0.00159 32 2S -0.00139 0.00407 0.00006 0.00021 0.00025 33 4 Br 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 34 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 35 3S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 36 4S -0.00000 -0.00000 -0.00000 -0.00000 -0.00001 37 5S 0.00034 0.00005 0.00002 0.00001 0.00038 38 6S 0.00028 0.00008 0.00001 0.00001 0.00006 39 7PX 0.00000 0.00000 0.00000 0.00000 0.00000 40 7PY -0.00000 -0.00000 0.00000 0.00000 0.00000 41 7PZ 0.00000 -0.00000 0.00000 0.00000 0.00000 42 8PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 43 8PY -0.00000 -0.00001 -0.00000 -0.00000 -0.00003 44 8PZ -0.00002 0.00000 -0.00000 0.00000 -0.00001 45 9PX 0.00004 0.00004 0.00027 0.00020 0.00001 46 9PY 0.00008 0.00073 0.00004 -0.00000 0.00122 47 9PZ 0.00145 -0.00033 0.00004 -0.00000 0.00034 48 10PX 0.00011 0.00013 0.00060 0.00045 0.00000 49 10PY -0.00008 0.00224 0.00003 0.00000 0.00059 50 10PZ 0.00325 -0.00132 0.00003 0.00000 0.00007 51 11XX -0.00000 -0.00000 0.00000 0.00000 -0.00000 52 11YY -0.00000 0.00000 0.00000 -0.00000 0.00000 53 11ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 54 11XY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 55 11XZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 56 11YZ 0.00001 0.00000 0.00000 0.00000 0.00000 57 12XX -0.00000 -0.00001 -0.00000 0.00000 0.00001 58 12YY 0.00006 -0.00002 0.00001 0.00001 0.00022 59 12ZZ 0.00009 0.00002 0.00002 -0.00000 0.00002 60 12XY 0.00000 -0.00001 0.00002 0.00004 0.00003 61 12XZ 0.00001 -0.00001 0.00003 0.00001 0.00001 62 12YZ 0.00017 0.00002 0.00001 -0.00001 0.00015 63 5 C 1S -0.00005 0.00000 -0.00007 -0.00001 -0.00002 64 2S 0.00101 -0.00030 0.00114 0.00015 0.00032 65 2PX 0.00163 -0.00012 -0.00010 0.00001 0.00038 66 2PY -0.00086 -0.00053 0.00132 0.00041 0.00050 67 2PZ 0.00060 0.00002 0.00044 0.00013 0.00037 68 3S 0.00228 -0.00162 0.00050 0.00011 0.00014 69 3PX 0.00191 0.00008 0.00013 0.00001 0.00009 70 3PY -0.00082 -0.00074 0.00011 0.00009 0.00004 71 3PZ 0.00033 -0.00015 0.00008 0.00008 0.00027 72 4XX -0.00008 -0.00002 -0.00000 0.00000 -0.00001 73 4YY 0.00004 0.00002 -0.00002 -0.00002 -0.00001 74 4ZZ -0.00002 0.00001 -0.00002 0.00000 -0.00000 75 4XY -0.00000 -0.00005 0.00004 0.00001 0.00001 76 4XZ -0.00003 -0.00000 -0.00000 -0.00000 -0.00002 77 4YZ -0.00003 -0.00000 -0.00001 0.00000 -0.00004 78 6 C 1S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 79 2S -0.00000 0.00001 -0.00000 0.00000 0.00001 80 2PX 0.00001 0.00001 -0.00000 -0.00000 0.00001 81 2PY -0.00001 0.00000 0.00000 0.00001 0.00001 82 2PZ -0.00001 0.00002 -0.00000 0.00001 0.00003 83 3S -0.00005 0.00011 -0.00003 -0.00001 0.00006 84 3PX 0.00015 0.00013 -0.00000 -0.00000 0.00005 85 3PY -0.00013 0.00001 0.00002 0.00005 0.00001 86 3PZ -0.00018 0.00023 -0.00003 0.00001 0.00006 87 4XX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 88 4YY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 89 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 90 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 91 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 92 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 93 7 C 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 94 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 95 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 96 2PY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 97 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 98 3S 0.00000 -0.00000 0.00000 0.00000 -0.00000 99 3PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 100 3PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 101 3PZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 102 4XX 0.00000 0.00000 -0.00000 -0.00000 0.00000 103 4YY -0.00000 -0.00000 0.00000 0.00000 -0.00000 104 4ZZ -0.00000 0.00000 -0.00000 0.00000 0.00000 105 4XY 0.00000 0.00000 -0.00000 -0.00000 0.00000 106 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 107 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 108 8 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 109 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 110 2PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 111 2PY 0.00000 0.00000 -0.00000 -0.00000 0.00000 112 2PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 113 3S -0.00000 -0.00000 0.00000 0.00000 0.00000 114 3PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 115 3PY 0.00000 0.00000 -0.00000 -0.00000 0.00000 116 3PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 117 4XX -0.00000 0.00000 0.00000 -0.00000 0.00000 118 4YY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 119 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 120 4XY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 121 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 122 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 123 9 C 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 124 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 125 2PX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 126 2PY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 127 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 128 3S -0.00000 0.00000 0.00000 0.00000 -0.00000 129 3PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 130 3PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 131 3PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 132 4XX 0.00000 0.00000 -0.00000 0.00000 0.00000 133 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 134 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 135 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 136 4XZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 137 4YZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 138 10 C 1S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 139 2S 0.00001 -0.00000 0.00001 0.00000 0.00001 140 2PX 0.00006 0.00000 -0.00001 0.00000 0.00001 141 2PY 0.00001 -0.00001 0.00005 0.00000 0.00002 142 2PZ 0.00001 -0.00000 0.00000 -0.00000 -0.00000 143 3S 0.00007 -0.00002 -0.00001 0.00000 0.00005 144 3PX 0.00046 0.00008 -0.00003 0.00001 0.00003 145 3PY -0.00010 -0.00009 0.00014 0.00002 0.00005 146 3PZ 0.00002 0.00001 -0.00001 -0.00001 -0.00001 147 4XX 0.00000 -0.00000 -0.00000 0.00000 -0.00000 148 4YY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 149 4ZZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 150 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 151 4XZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 152 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 153 11 H 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 154 2S -0.00006 0.00007 -0.00002 -0.00001 -0.00001 155 12 H 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 156 2S 0.00000 -0.00000 0.00000 0.00000 0.00000 157 13 H 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 158 2S -0.00000 -0.00000 -0.00000 0.00000 0.00000 159 14 H 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 160 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 161 15 H 1S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 162 2S -0.00000 0.00002 -0.00000 -0.00001 -0.00002 163 16 C 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 164 2S 0.00000 0.00000 0.00000 0.00000 -0.00000 165 2PX 0.00000 0.00000 0.00001 0.00001 0.00000 166 2PY -0.00000 0.00000 0.00000 0.00000 0.00000 167 2PZ 0.00000 -0.00000 0.00000 0.00000 0.00000 168 3S -0.00003 0.00007 0.00002 0.00003 0.00000 169 3PX -0.00010 0.00006 0.00001 0.00001 0.00001 170 3PY -0.00003 0.00003 -0.00000 0.00002 -0.00000 171 3PZ 0.00002 0.00000 0.00001 0.00005 0.00001 172 4XX -0.00000 -0.00000 0.00000 0.00000 -0.00000 173 4YY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 174 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 175 4XY -0.00000 -0.00000 0.00000 0.00000 -0.00000 176 4XZ -0.00000 0.00000 0.00000 0.00000 -0.00000 177 4YZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 178 17 C 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 179 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 180 2PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 181 2PY 0.00000 0.00000 -0.00000 -0.00000 0.00000 182 2PZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 183 3S -0.00001 0.00000 -0.00002 -0.00000 0.00000 184 3PX 0.00001 -0.00000 0.00001 0.00000 -0.00000 185 3PY 0.00001 0.00001 0.00000 0.00000 0.00001 186 3PZ 0.00002 0.00000 0.00000 -0.00000 -0.00000 187 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 188 4YY -0.00000 0.00000 -0.00000 0.00000 0.00000 189 4ZZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 190 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 191 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00000 192 4YZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 193 18 C 1S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 194 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 195 2PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 196 2PY 0.00000 0.00000 0.00000 -0.00000 -0.00000 197 2PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 198 3S 0.00000 0.00000 0.00000 0.00000 0.00000 199 3PX 0.00000 0.00000 0.00000 0.00000 0.00000 200 3PY 0.00000 0.00000 0.00000 -0.00000 -0.00000 201 3PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 202 4XX -0.00000 0.00000 0.00000 0.00000 -0.00000 203 4YY 0.00000 0.00000 -0.00000 -0.00000 0.00000 204 4ZZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 205 4XY -0.00000 0.00000 -0.00000 0.00000 0.00000 206 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 207 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 210 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 211 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 212 2PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 213 3S -0.00000 -0.00000 0.00000 0.00000 -0.00000 214 3PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 215 3PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 216 3PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 217 4XX -0.00000 -0.00000 0.00000 0.00000 -0.00000 218 4YY 0.00000 0.00000 0.00000 -0.00000 -0.00000 219 4ZZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 221 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 222 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 223 20 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 224 2S 0.00000 0.00000 0.00000 0.00000 0.00000 225 2PX 0.00000 0.00000 0.00000 0.00000 -0.00000 226 2PY 0.00000 0.00000 0.00000 -0.00000 -0.00000 227 2PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 228 3S 0.00000 0.00000 0.00000 0.00000 -0.00000 229 3PX 0.00000 0.00000 0.00000 0.00000 -0.00000 230 3PY 0.00000 0.00000 0.00000 -0.00000 -0.00000 231 3PZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 232 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 233 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 234 4ZZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 235 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 236 4XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 237 4YZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 240 2PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 241 2PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 242 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 243 3S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 244 3PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 245 3PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 246 3PZ 0.00000 0.00000 0.00000 0.00000 0.00000 247 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 248 4YY -0.00000 -0.00000 0.00000 -0.00000 0.00000 249 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 250 4XY -0.00000 0.00000 -0.00000 0.00000 -0.00000 251 4XZ 0.00000 -0.00000 0.00000 0.00000 0.00000 252 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 253 22 H 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 254 2S -0.00000 -0.00000 0.00000 0.00000 0.00000 255 23 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 256 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 257 24 H 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 258 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 259 25 H 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 260 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 261 26 H 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 262 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 263 27 H 1S 0.00001 -0.00000 0.00006 0.00003 0.00000 264 2S 0.00030 -0.00006 0.00016 0.00009 0.00002 31 32 33 34 35 31 3 H 1S 0.21133 32 2S 0.08286 0.09313 33 4 Br 1S 0.00000 -0.00000 2.39682 34 2S -0.00000 0.00002 -0.50334 4.73646 35 3S 0.00000 -0.00003 0.07155 -1.86133 1.98432 36 4S 0.00000 -0.00010 0.06067 -1.78828 2.61880 37 5S -0.00005 -0.00051 0.00402 -0.10105 0.05470 38 6S -0.00029 0.00110 0.00175 -0.04749 0.04258 39 7PX -0.00000 -0.00000 0.00000 0.00000 0.00000 40 7PY 0.00000 0.00000 0.00000 0.00000 0.00000 41 7PZ -0.00000 -0.00001 0.00000 0.00000 0.00000 42 8PX 0.00000 0.00001 0.00000 0.00000 0.00000 43 8PY -0.00000 -0.00001 0.00000 0.00000 0.00000 44 8PZ 0.00000 0.00033 0.00000 0.00000 0.00000 45 9PX -0.00001 -0.00021 0.00000 0.00000 0.00000 46 9PY -0.00000 0.00021 0.00000 0.00000 0.00000 47 9PZ -0.00030 -0.00628 0.00000 0.00000 0.00000 48 10PX -0.00024 -0.00077 0.00000 0.00000 0.00000 49 10PY 0.00029 0.00229 0.00000 0.00000 0.00000 50 10PZ -0.00568 -0.02057 0.00000 0.00000 0.00000 51 11XX -0.00000 0.00005 -0.00960 0.58167 -0.71396 52 11YY -0.00000 0.00007 -0.00960 0.58169 -0.71427 53 11ZZ -0.00000 0.00002 -0.00960 0.58165 -0.71412 54 11XY -0.00000 0.00000 0.00000 -0.00000 0.00000 55 11XZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 56 11YZ -0.00000 0.00001 0.00000 0.00000 -0.00000 57 12XX -0.00001 -0.00007 -0.00001 0.00157 -0.00878 58 12YY -0.00012 -0.00067 -0.00001 0.00159 -0.00897 59 12ZZ 0.00026 0.00082 -0.00001 0.00158 -0.00886 60 12XY 0.00001 0.00002 0.00000 -0.00000 0.00000 61 12XZ 0.00002 0.00004 0.00000 0.00000 -0.00000 62 12YZ 0.00008 -0.00022 -0.00000 0.00000 -0.00000 63 5 C 1S 0.00000 0.00014 0.00000 0.00000 -0.00000 64 2S -0.00016 -0.00218 0.00000 -0.00000 0.00000 65 2PX -0.00003 -0.00014 -0.00000 0.00000 -0.00000 66 2PY -0.00031 -0.00343 0.00000 -0.00000 0.00000 67 2PZ -0.00027 -0.00381 0.00000 -0.00000 0.00000 68 3S -0.00381 -0.01202 0.00000 -0.00000 0.00001 69 3PX 0.00020 0.00077 -0.00000 0.00001 -0.00003 70 3PY -0.00180 -0.00398 -0.00000 0.00008 -0.00014 71 3PZ -0.00154 -0.00409 0.00000 -0.00003 0.00005 72 4XX -0.00001 -0.00015 -0.00000 0.00000 0.00000 73 4YY 0.00002 -0.00000 -0.00000 0.00000 -0.00000 74 4ZZ 0.00003 0.00041 0.00000 -0.00000 0.00000 75 4XY -0.00001 -0.00004 -0.00000 0.00000 -0.00000 76 4XZ 0.00001 0.00000 -0.00000 0.00000 -0.00000 77 4YZ 0.00007 0.00020 -0.00000 0.00000 -0.00000 78 6 C 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 79 2S 0.00000 0.00009 0.00000 -0.00000 0.00000 80 2PX 0.00000 0.00006 -0.00000 0.00000 -0.00000 81 2PY 0.00000 0.00003 0.00000 -0.00000 0.00000 82 2PZ 0.00000 0.00025 0.00000 -0.00000 0.00000 83 3S 0.00007 0.00099 -0.00000 0.00000 -0.00000 84 3PX 0.00003 0.00045 -0.00000 0.00000 -0.00000 85 3PY -0.00005 -0.00025 -0.00000 0.00001 -0.00001 86 3PZ 0.00018 0.00192 -0.00000 0.00001 -0.00002 87 4XX -0.00000 -0.00000 0.00000 -0.00000 0.00000 88 4YY -0.00000 -0.00001 0.00000 -0.00000 0.00000 89 4ZZ 0.00000 0.00001 -0.00000 0.00000 -0.00000 90 4XY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 91 4XZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 92 4YZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 93 7 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 94 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 95 2PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 96 2PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 97 2PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 98 3S -0.00000 -0.00003 -0.00000 0.00000 -0.00000 99 3PX -0.00000 -0.00001 -0.00000 0.00000 -0.00000 100 3PY -0.00000 -0.00005 -0.00000 0.00000 -0.00000 101 3PZ -0.00000 -0.00002 0.00000 -0.00000 0.00000 102 4XX 0.00000 0.00000 -0.00000 0.00000 -0.00000 103 4YY -0.00000 -0.00000 -0.00000 0.00000 0.00000 104 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 105 4XY 0.00000 0.00000 -0.00000 0.00000 -0.00000 106 4XZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 107 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 108 8 C 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 109 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 110 2PX -0.00000 -0.00000 0.00000 -0.00000 0.00000 111 2PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 112 2PZ -0.00000 0.00000 0.00000 -0.00000 0.00000 113 3S -0.00000 0.00000 -0.00000 0.00000 -0.00000 114 3PX -0.00000 -0.00002 -0.00000 0.00000 0.00000 115 3PY 0.00000 0.00003 -0.00000 0.00000 -0.00000 116 3PZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 117 4XX 0.00000 -0.00000 0.00000 0.00000 0.00000 118 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 119 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 120 4XY -0.00000 -0.00000 0.00000 0.00000 0.00000 121 4XZ 0.00000 -0.00000 0.00000 0.00000 0.00000 122 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 123 9 C 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 124 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 125 2PX 0.00000 -0.00001 0.00000 -0.00000 0.00000 126 2PY 0.00000 0.00001 0.00000 -0.00000 0.00000 127 2PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 128 3S 0.00000 0.00002 0.00000 -0.00000 0.00000 129 3PX 0.00000 -0.00010 0.00000 -0.00000 0.00000 130 3PY 0.00001 0.00019 0.00000 -0.00000 0.00000 131 3PZ 0.00000 0.00001 -0.00000 0.00000 -0.00000 132 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 133 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 134 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 135 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 136 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 137 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 138 10 C 1S 0.00000 0.00001 0.00000 0.00000 0.00000 139 2S -0.00001 -0.00033 -0.00000 0.00000 -0.00000 140 2PX 0.00000 -0.00006 -0.00000 0.00000 -0.00000 141 2PY -0.00005 -0.00084 -0.00000 0.00000 -0.00000 142 2PZ 0.00000 0.00014 -0.00000 0.00000 -0.00000 143 3S -0.00041 -0.00069 -0.00000 0.00000 -0.00000 144 3PX 0.00026 0.00024 0.00000 -0.00000 0.00000 145 3PY -0.00033 -0.00068 0.00000 -0.00000 0.00000 146 3PZ -0.00011 -0.00012 -0.00000 0.00000 -0.00000 147 4XX 0.00000 0.00001 -0.00000 0.00000 -0.00000 148 4YY 0.00000 -0.00008 0.00000 -0.00000 0.00000 149 4ZZ 0.00000 0.00005 -0.00000 0.00000 -0.00000 150 4XY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 151 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 152 4YZ 0.00000 0.00001 0.00000 -0.00000 0.00000 153 11 H 1S -0.00000 0.00051 -0.00000 0.00000 -0.00000 154 2S 0.00041 0.00381 -0.00000 0.00000 -0.00000 155 12 H 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 156 2S -0.00000 -0.00001 -0.00000 0.00000 -0.00000 157 13 H 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 158 2S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 159 14 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 160 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 161 15 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 162 2S 0.00001 0.00013 -0.00000 0.00004 -0.00007 163 16 C 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 164 2S 0.00000 0.00007 -0.00000 0.00000 -0.00000 165 2PX 0.00000 0.00021 0.00000 -0.00000 -0.00000 166 2PY 0.00000 0.00008 0.00000 -0.00000 0.00000 167 2PZ -0.00000 -0.00005 0.00000 -0.00000 0.00000 168 3S 0.00010 0.00104 0.00000 -0.00000 0.00000 169 3PX 0.00014 0.00083 0.00000 -0.00000 0.00000 170 3PY 0.00010 0.00064 -0.00000 0.00000 -0.00000 171 3PZ -0.00004 -0.00042 0.00000 -0.00000 0.00000 172 4XX -0.00000 -0.00001 0.00000 -0.00000 0.00000 173 4YY -0.00000 -0.00000 0.00000 -0.00000 0.00000 174 4ZZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 175 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 176 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 177 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 178 17 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 179 2S -0.00000 -0.00000 0.00000 -0.00000 0.00000 180 2PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 181 2PY 0.00000 0.00000 0.00000 -0.00000 0.00000 182 2PZ -0.00000 -0.00001 0.00000 -0.00000 0.00000 183 3S -0.00000 -0.00005 -0.00000 0.00000 -0.00000 184 3PX -0.00000 0.00001 0.00000 -0.00000 0.00000 185 3PY 0.00000 0.00009 0.00000 -0.00000 -0.00000 186 3PZ -0.00000 -0.00008 0.00000 -0.00000 0.00000 187 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 188 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 189 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 190 4XY 0.00000 0.00000 -0.00000 0.00000 -0.00000 191 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 192 4YZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 193 18 C 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 194 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 195 2PX 0.00000 0.00000 -0.00000 0.00000 -0.00000 196 2PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 197 2PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 198 3S 0.00000 0.00000 0.00000 -0.00000 0.00000 199 3PX 0.00000 0.00000 -0.00000 0.00000 -0.00000 200 3PY -0.00000 0.00000 0.00000 -0.00000 0.00000 201 3PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 202 4XX 0.00000 -0.00000 0.00000 0.00000 0.00000 203 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 204 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 205 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 206 4XZ -0.00000 -0.00000 0.00000 0.00000 0.00000 207 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 208 19 C 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 209 2S 0.00000 0.00000 0.00000 0.00000 0.00000 210 2PX 0.00000 -0.00000 0.00000 0.00000 0.00000 211 2PY -0.00000 -0.00000 0.00000 0.00000 0.00000 212 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 213 3S 0.00000 0.00000 -0.00000 0.00000 -0.00000 214 3PX 0.00000 -0.00000 -0.00000 0.00000 -0.00000 215 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 216 3PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 217 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 219 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 220 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 222 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 223 20 C 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 224 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 225 2PX 0.00000 0.00000 -0.00000 0.00000 -0.00000 226 2PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 227 2PZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 228 3S 0.00000 0.00000 0.00000 -0.00000 0.00000 229 3PX 0.00000 0.00000 0.00000 -0.00000 0.00000 230 3PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 231 3PZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 232 4XX -0.00000 -0.00000 0.00000 0.00000 0.00000 233 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 234 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 235 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 236 4XZ -0.00000 -0.00000 0.00000 0.00000 0.00000 237 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S -0.00000 -0.00000 0.00000 -0.00000 0.00000 240 2PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 241 2PY 0.00000 0.00000 0.00000 -0.00000 0.00000 242 2PZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 243 3S -0.00000 -0.00005 0.00000 -0.00000 0.00000 244 3PX -0.00000 -0.00010 0.00000 -0.00000 0.00000 245 3PY 0.00000 0.00001 0.00000 -0.00000 0.00000 246 3PZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 247 4XX 0.00000 0.00000 -0.00000 0.00000 -0.00000 248 4YY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 249 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 250 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 251 4XZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 252 4YZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 253 22 H 1S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 254 2S -0.00000 -0.00001 0.00000 -0.00000 0.00000 255 23 H 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 256 2S -0.00000 -0.00000 0.00000 -0.00000 0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 259 25 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 260 2S -0.00000 -0.00000 0.00000 -0.00000 0.00000 261 26 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 262 2S 0.00000 0.00001 -0.00000 0.00000 -0.00000 263 27 H 1S -0.00003 -0.00097 0.00000 -0.00000 0.00000 264 2S -0.00095 -0.00301 -0.00000 0.00002 -0.00005 36 37 38 39 40 36 4S 4.48170 37 5S 0.01435 1.01732 38 6S 0.06522 0.58593 0.54775 39 7PX 0.00000 0.00000 0.00000 2.30543 40 7PY 0.00000 0.00000 0.00000 0.00000 2.30052 41 7PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 42 8PX 0.00000 0.00000 0.00000 -0.31100 -0.00000 43 8PY 0.00000 0.00000 0.00000 -0.00000 -0.30577 44 8PZ 0.00000 0.00000 0.00000 0.00000 0.00000 45 9PX 0.00000 0.00000 0.00000 0.00202 0.00000 46 9PY 0.00000 0.00000 0.00000 0.00000 0.00119 47 9PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 48 10PX 0.00000 0.00000 0.00000 0.00088 0.00000 49 10PY 0.00000 0.00000 0.00000 0.00000 0.00069 50 10PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 51 11XX -1.21605 -0.09777 -0.06878 0.00000 0.00000 52 11YY -1.21561 -0.10364 -0.05867 0.00000 0.00000 53 11ZZ -1.21562 -0.10027 -0.06424 0.00000 0.00000 54 11XY -0.00000 0.00000 -0.00000 0.00000 0.00000 55 11XZ -0.00000 -0.00000 0.00000 0.00000 0.00000 56 11YZ 0.00000 -0.00000 0.00000 0.00000 0.00000 57 12XX -0.04554 -0.02463 -0.03848 0.00000 0.00000 58 12YY -0.04672 -0.01735 -0.04172 0.00000 0.00000 59 12ZZ -0.04608 -0.02089 -0.04068 0.00000 0.00000 60 12XY 0.00000 -0.00000 0.00000 0.00000 0.00000 61 12XZ -0.00000 0.00000 0.00000 0.00000 0.00000 62 12YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 63 5 C 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 64 2S 0.00000 -0.00001 0.00006 -0.00000 -0.00000 65 2PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 66 2PY 0.00000 -0.00005 -0.00010 -0.00000 -0.00000 67 2PZ 0.00000 -0.00000 -0.00002 -0.00000 -0.00000 68 3S 0.00004 -0.00015 0.00054 -0.00000 -0.00000 69 3PX -0.00009 0.00013 0.00014 -0.00000 -0.00000 70 3PY -0.00041 -0.00125 0.00134 0.00000 -0.00001 71 3PZ 0.00016 -0.00010 0.00018 0.00000 -0.00000 72 4XX 0.00000 -0.00000 0.00000 -0.00000 0.00000 73 4YY -0.00000 0.00000 -0.00007 -0.00000 0.00000 74 4ZZ 0.00000 -0.00000 0.00002 0.00000 0.00000 75 4XY -0.00000 -0.00000 -0.00001 -0.00000 -0.00000 76 4XZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 77 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 78 6 C 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 79 2S 0.00000 -0.00000 0.00006 -0.00000 -0.00000 80 2PX -0.00000 0.00000 -0.00004 -0.00000 0.00000 81 2PY 0.00000 -0.00001 0.00039 -0.00000 -0.00000 82 2PZ 0.00000 0.00000 -0.00001 -0.00000 0.00000 83 3S -0.00002 -0.00010 0.00042 -0.00000 0.00000 84 3PX -0.00001 0.00007 -0.00045 0.00000 0.00000 85 3PY -0.00002 -0.00051 0.00154 -0.00000 -0.00000 86 3PZ -0.00006 0.00003 -0.00003 -0.00000 -0.00000 87 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 88 4YY 0.00000 0.00000 -0.00001 0.00000 0.00000 89 4ZZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 90 4XY 0.00000 -0.00000 0.00000 -0.00000 0.00000 91 4XZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 92 4YZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 93 7 C 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 94 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 95 2PX -0.00000 0.00000 -0.00000 0.00000 0.00000 96 2PY -0.00000 0.00000 0.00000 -0.00000 0.00000 97 2PZ -0.00000 0.00000 0.00000 -0.00000 0.00000 98 3S -0.00000 0.00000 -0.00002 -0.00000 -0.00000 99 3PX -0.00000 0.00000 -0.00004 0.00000 -0.00000 100 3PY -0.00000 0.00000 0.00002 -0.00000 -0.00000 101 3PZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 102 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 103 4YY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 104 4ZZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 105 4XY -0.00000 0.00000 -0.00000 0.00000 -0.00000 106 4XZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 107 4YZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 108 8 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 109 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 110 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 111 2PY -0.00000 0.00000 0.00000 -0.00000 0.00000 112 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 113 3S -0.00000 -0.00000 0.00000 0.00000 -0.00000 114 3PX 0.00000 -0.00000 0.00000 0.00000 -0.00000 115 3PY -0.00000 0.00000 0.00000 0.00000 0.00000 116 3PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 117 4XX 0.00000 0.00000 -0.00000 0.00000 0.00000 118 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 119 4ZZ 0.00000 -0.00000 0.00000 0.00000 0.00000 120 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 121 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 122 4YZ 0.00000 -0.00000 0.00000 0.00000 0.00000 123 9 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 124 2S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 125 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 126 2PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 127 2PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 128 3S 0.00000 -0.00000 0.00000 -0.00000 0.00000 129 3PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 130 3PY 0.00000 0.00000 -0.00001 -0.00000 0.00000 131 3PZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 132 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 133 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 134 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 135 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 136 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 137 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 138 10 C 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 139 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 140 2PX -0.00000 0.00000 0.00000 0.00000 0.00000 141 2PY -0.00000 0.00000 -0.00000 0.00000 0.00000 142 2PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 143 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 144 3PX 0.00000 0.00000 0.00006 0.00000 0.00000 145 3PY 0.00000 0.00000 -0.00004 0.00000 0.00000 146 3PZ -0.00000 -0.00000 0.00001 0.00000 -0.00000 147 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 148 4YY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 149 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 150 4XY -0.00000 0.00000 0.00000 0.00000 -0.00000 151 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 152 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 153 11 H 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 154 2S -0.00000 -0.00000 0.00001 0.00000 -0.00000 155 12 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 156 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 157 13 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 158 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 159 14 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 160 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 161 15 H 1S 0.00000 -0.00001 0.00028 -0.00000 0.00000 162 2S -0.00023 -0.00019 0.00139 0.00000 -0.00000 163 16 C 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 164 2S -0.00000 0.00000 -0.00001 0.00000 -0.00000 165 2PX -0.00000 0.00000 -0.00000 0.00000 0.00000 166 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 167 2PZ 0.00000 -0.00000 0.00001 -0.00000 -0.00000 168 3S 0.00000 0.00000 -0.00005 0.00000 0.00000 169 3PX 0.00001 -0.00003 0.00003 -0.00000 0.00000 170 3PY -0.00000 -0.00007 0.00005 -0.00000 0.00000 171 3PZ 0.00000 -0.00003 0.00009 -0.00000 -0.00000 172 4XX 0.00000 0.00000 -0.00000 0.00000 0.00000 173 4YY 0.00000 -0.00000 0.00000 0.00000 0.00000 174 4ZZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 175 4XY 0.00000 -0.00000 -0.00000 0.00000 0.00000 176 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 177 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 178 17 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 179 2S 0.00000 -0.00000 0.00000 -0.00000 0.00000 180 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 181 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 182 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 183 3S -0.00000 -0.00000 0.00001 0.00000 -0.00000 184 3PX 0.00000 0.00000 0.00003 0.00000 0.00000 185 3PY -0.00000 0.00000 0.00000 -0.00000 0.00000 186 3PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 187 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 188 4YY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 189 4ZZ -0.00000 0.00000 -0.00000 0.00000 0.00000 190 4XY -0.00000 0.00000 -0.00000 0.00000 -0.00000 191 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 192 4YZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 193 18 C 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 194 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 195 2PX -0.00000 0.00000 0.00000 0.00000 0.00000 196 2PY -0.00000 0.00000 -0.00000 0.00000 0.00000 197 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 198 3S 0.00000 0.00000 0.00000 0.00000 0.00000 199 3PX -0.00000 0.00000 0.00000 0.00000 0.00000 200 3PY 0.00000 0.00000 0.00000 0.00000 0.00000 201 3PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 202 4XX 0.00000 -0.00000 0.00000 0.00000 0.00000 203 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 204 4ZZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 205 4XY 0.00000 -0.00000 0.00000 0.00000 0.00000 206 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 207 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 210 2PX 0.00000 0.00000 -0.00000 0.00000 0.00000 211 2PY 0.00000 0.00000 -0.00000 0.00000 0.00000 212 2PZ 0.00000 -0.00000 0.00000 0.00000 0.00000 213 3S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 214 3PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 215 3PY -0.00000 0.00000 -0.00000 0.00000 0.00000 216 3PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 217 4XX 0.00000 0.00000 -0.00000 0.00000 0.00000 218 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 219 4ZZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 221 4XZ 0.00000 -0.00000 0.00000 0.00000 0.00000 222 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 223 20 C 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 224 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 225 2PX -0.00000 0.00000 -0.00000 0.00000 0.00000 226 2PY -0.00000 0.00000 0.00000 0.00000 0.00000 227 2PZ -0.00000 0.00000 0.00000 0.00000 0.00000 228 3S 0.00000 0.00000 0.00000 0.00000 -0.00000 229 3PX 0.00000 0.00000 0.00000 0.00000 -0.00000 230 3PY 0.00000 0.00000 0.00000 0.00000 -0.00000 231 3PZ -0.00000 0.00000 0.00000 0.00000 0.00000 232 4XX 0.00000 -0.00000 -0.00000 0.00000 0.00000 233 4YY 0.00000 -0.00000 0.00000 0.00000 0.00000 234 4ZZ 0.00000 0.00000 -0.00000 0.00000 0.00000 235 4XY 0.00000 -0.00000 0.00000 0.00000 0.00000 236 4XZ 0.00000 -0.00000 0.00000 0.00000 0.00000 237 4YZ 0.00000 -0.00000 0.00000 0.00000 0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 240 2PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 241 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 242 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 243 3S 0.00000 -0.00000 0.00000 -0.00000 0.00000 244 3PX 0.00000 -0.00000 0.00001 -0.00000 -0.00000 245 3PY 0.00000 0.00000 0.00002 0.00000 -0.00000 246 3PZ 0.00000 -0.00000 0.00001 -0.00000 0.00000 247 4XX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 248 4YY -0.00000 -0.00000 -0.00000 0.00000 0.00000 249 4ZZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 250 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 251 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 252 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 253 22 H 1S -0.00000 -0.00000 0.00000 -0.00000 0.00000 254 2S 0.00000 -0.00000 0.00000 0.00000 0.00000 255 23 H 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 256 2S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 259 25 H 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 260 2S 0.00000 -0.00000 0.00000 0.00000 0.00000 261 26 H 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 262 2S -0.00000 0.00000 -0.00002 -0.00000 0.00000 263 27 H 1S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 264 2S -0.00016 -0.00007 0.00062 -0.00000 -0.00000 41 42 43 44 45 41 7PZ 2.30321 42 8PX 0.00000 2.47332 43 8PY 0.00000 0.00000 2.43075 44 8PZ -0.30858 -0.00000 -0.00000 2.45313 45 9PX -0.00000 -0.12839 -0.00000 0.00000 0.73100 46 9PY -0.00000 -0.00000 -0.09955 0.00000 0.00000 47 9PZ 0.00165 0.00000 0.00000 -0.11461 -0.00000 48 10PX -0.00000 -0.03970 -0.00000 0.00000 0.40404 49 10PY -0.00000 -0.00000 -0.02885 0.00000 0.00000 50 10PZ 0.00077 0.00000 0.00000 -0.03410 -0.00000 51 11XX 0.00000 0.00000 0.00000 0.00000 0.00000 52 11YY 0.00000 0.00000 0.00000 0.00000 0.00000 53 11ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 54 11XY 0.00000 0.00000 0.00000 0.00000 0.00000 55 11XZ 0.00000 0.00000 0.00000 0.00000 0.00000 56 11YZ 0.00000 0.00000 0.00000 0.00000 0.00000 57 12XX 0.00000 0.00000 0.00000 0.00000 0.00000 58 12YY 0.00000 0.00000 0.00000 0.00000 0.00000 59 12ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 60 12XY 0.00000 0.00000 0.00000 0.00000 0.00000 61 12XZ 0.00000 0.00000 0.00000 0.00000 0.00000 62 12YZ 0.00000 0.00000 0.00000 0.00000 0.00000 63 5 C 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 64 2S 0.00000 0.00000 0.00000 0.00000 -0.00001 65 2PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 66 2PY -0.00000 0.00000 0.00000 0.00000 -0.00002 67 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 68 3S 0.00000 0.00000 0.00014 -0.00003 -0.00007 69 3PX 0.00000 0.00000 0.00003 -0.00001 -0.00008 70 3PY -0.00000 -0.00000 0.00041 -0.00000 -0.00000 71 3PZ 0.00000 -0.00001 0.00001 -0.00001 0.00023 72 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 73 4YY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 74 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 75 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 76 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 77 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 78 6 C 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 79 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 80 2PX -0.00000 -0.00000 -0.00000 0.00000 0.00000 81 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 82 2PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 83 3S -0.00000 0.00000 0.00002 0.00000 -0.00011 84 3PX -0.00000 -0.00000 -0.00001 0.00000 0.00004 85 3PY -0.00000 0.00001 0.00001 -0.00000 -0.00014 86 3PZ 0.00000 0.00000 -0.00000 0.00000 -0.00004 87 4XX -0.00000 0.00000 -0.00000 0.00000 -0.00000 88 4YY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 89 4ZZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 90 4XY -0.00000 0.00000 -0.00000 0.00000 -0.00000 91 4XZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 92 4YZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 93 7 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 94 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 95 2PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 96 2PY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 97 2PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 98 3S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 99 3PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 100 3PY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 101 3PZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 102 4XX -0.00000 -0.00000 -0.00000 0.00000 0.00000 103 4YY 0.00000 0.00000 0.00000 -0.00000 -0.00000 104 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 105 4XY -0.00000 -0.00000 -0.00000 0.00000 0.00000 106 4XZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 107 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 108 8 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 109 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 110 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 111 2PY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 112 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 113 3S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 114 3PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 115 3PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 116 3PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 117 4XX 0.00000 -0.00000 -0.00000 0.00000 0.00000 118 4YY 0.00000 0.00000 -0.00000 0.00000 -0.00000 119 4ZZ 0.00000 -0.00000 0.00000 0.00000 0.00000 120 4XY 0.00000 -0.00000 -0.00000 0.00000 0.00000 121 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 122 4YZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 123 9 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 124 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 125 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 126 2PY -0.00000 -0.00000 0.00000 0.00000 0.00000 127 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 128 3S 0.00000 0.00000 -0.00000 0.00000 -0.00000 129 3PX 0.00000 0.00000 0.00000 0.00000 -0.00000 130 3PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 131 3PZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 132 4XX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 133 4YY 0.00000 0.00000 0.00000 0.00000 -0.00000 134 4ZZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 135 4XY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 136 4XZ 0.00000 -0.00000 0.00000 0.00000 0.00000 137 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 138 10 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 139 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 140 2PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 141 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 142 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 143 3S -0.00000 -0.00000 -0.00000 0.00000 0.00001 144 3PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 145 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 146 3PZ -0.00000 -0.00000 0.00000 0.00000 0.00001 147 4XX 0.00000 -0.00000 0.00000 0.00000 0.00000 148 4YY -0.00000 0.00000 0.00000 0.00000 -0.00000 149 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 150 4XY -0.00000 -0.00000 0.00000 0.00000 0.00000 151 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 152 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 153 11 H 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 154 2S -0.00000 -0.00000 0.00000 0.00000 0.00000 155 12 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 156 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 157 13 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 158 2S 0.00000 -0.00000 0.00000 -0.00000 0.00000 159 14 H 1S 0.00000 -0.00000 0.00000 -0.00000 0.00000 160 2S 0.00000 -0.00000 0.00000 -0.00000 0.00000 161 15 H 1S -0.00000 0.00000 0.00000 0.00000 -0.00000 162 2S -0.00000 0.00000 -0.00002 -0.00002 -0.00001 163 16 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 164 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 165 2PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 166 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 167 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 168 3S -0.00000 -0.00000 -0.00000 0.00000 0.00020 169 3PX 0.00000 0.00000 -0.00000 0.00000 -0.00002 170 3PY -0.00000 0.00000 0.00000 0.00000 -0.00017 171 3PZ 0.00000 0.00000 0.00000 -0.00000 -0.00019 172 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 173 4YY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 174 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 175 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 176 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 177 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 178 17 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 179 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 180 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 181 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 182 2PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 183 3S -0.00000 -0.00000 0.00000 0.00000 0.00000 184 3PX 0.00000 -0.00000 0.00000 -0.00000 0.00001 185 3PY -0.00000 0.00000 -0.00000 0.00000 -0.00002 186 3PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 187 4XX -0.00000 0.00000 0.00000 0.00000 -0.00000 188 4YY -0.00000 0.00000 0.00000 0.00000 -0.00000 189 4ZZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 190 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 191 4XZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 192 4YZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 193 18 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 194 2S -0.00000 -0.00000 0.00000 0.00000 0.00000 195 2PX -0.00000 -0.00000 -0.00000 0.00000 0.00000 196 2PY -0.00000 -0.00000 -0.00000 0.00000 0.00000 197 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 198 3S -0.00000 -0.00000 -0.00000 0.00000 0.00000 199 3PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 200 3PY -0.00000 -0.00000 -0.00000 0.00000 0.00000 201 3PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 202 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 203 4YY 0.00000 0.00000 0.00000 0.00000 -0.00000 204 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 205 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 206 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 207 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 209 2S 0.00000 -0.00000 -0.00000 0.00000 0.00000 210 2PX 0.00000 -0.00000 0.00000 0.00000 0.00000 211 2PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 212 2PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 213 3S 0.00000 0.00000 0.00000 -0.00000 -0.00000 214 3PX 0.00000 0.00000 0.00000 -0.00000 -0.00000 215 3PY -0.00000 -0.00000 -0.00000 0.00000 0.00000 216 3PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 218 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 219 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 220 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00000 222 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 224 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 225 2PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 226 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 227 2PZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 228 3S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 229 3PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 230 3PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 231 3PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 232 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 233 4YY 0.00000 0.00000 0.00000 0.00000 -0.00000 234 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 235 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 236 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00000 237 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 240 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 241 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 242 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 243 3S 0.00000 0.00000 0.00000 0.00000 -0.00000 244 3PX -0.00000 0.00000 0.00000 0.00000 -0.00001 245 3PY -0.00000 0.00000 0.00000 -0.00000 -0.00000 246 3PZ -0.00000 0.00000 0.00000 0.00000 -0.00001 247 4XX 0.00000 0.00000 -0.00000 -0.00000 -0.00000 248 4YY 0.00000 -0.00000 -0.00000 0.00000 0.00000 249 4ZZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 250 4XY -0.00000 0.00000 0.00000 0.00000 -0.00000 251 4XZ -0.00000 0.00000 0.00000 0.00000 -0.00000 252 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 254 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 256 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 258 2S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 259 25 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 260 2S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 261 26 H 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 262 2S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 263 27 H 1S -0.00000 0.00000 0.00000 0.00000 -0.00003 264 2S -0.00000 0.00003 0.00001 -0.00002 -0.00062 46 47 48 49 50 46 9PY 0.59537 47 9PZ -0.00000 0.66425 48 10PX 0.00000 -0.00000 0.51440 49 10PY 0.28656 -0.00000 0.00000 0.32820 50 10PZ -0.00000 0.34454 -0.00000 -0.00000 0.41830 51 11XX 0.00000 0.00000 0.00000 0.00000 0.00000 52 11YY 0.00000 0.00000 0.00000 0.00000 0.00000 53 11ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 54 11XY 0.00000 0.00000 0.00000 0.00000 0.00000 55 11XZ 0.00000 0.00000 0.00000 0.00000 0.00000 56 11YZ 0.00000 0.00000 0.00000 0.00000 0.00000 57 12XX 0.00000 0.00000 0.00000 0.00000 0.00000 58 12YY 0.00000 0.00000 0.00000 0.00000 0.00000 59 12ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 60 12XY 0.00000 0.00000 0.00000 0.00000 0.00000 61 12XZ 0.00000 0.00000 0.00000 0.00000 0.00000 62 12YZ 0.00000 0.00000 0.00000 0.00000 0.00000 63 5 C 1S 0.00000 -0.00000 0.00001 0.00011 -0.00001 64 2S -0.00005 -0.00000 -0.00023 -0.00179 0.00009 65 2PX -0.00001 0.00000 0.00011 -0.00009 0.00010 66 2PY -0.00029 -0.00002 -0.00035 -0.00561 -0.00023 67 2PZ -0.00001 -0.00000 0.00001 -0.00029 0.00011 68 3S -0.00391 0.00099 -0.00037 -0.01824 0.00526 69 3PX -0.00031 0.00024 -0.00015 -0.00055 0.00084 70 3PY -0.00670 0.00030 0.00010 -0.01728 0.00135 71 3PZ -0.00012 0.00022 0.00068 -0.00002 0.00149 72 4XX -0.00000 -0.00000 0.00000 -0.00013 -0.00001 73 4YY 0.00002 0.00000 -0.00001 0.00040 0.00003 74 4ZZ -0.00000 -0.00000 -0.00001 -0.00001 -0.00001 75 4XY -0.00000 0.00000 0.00001 -0.00004 0.00000 76 4XZ 0.00000 0.00000 0.00000 0.00001 -0.00000 77 4YZ 0.00001 0.00000 0.00001 0.00010 -0.00002 78 6 C 1S 0.00000 0.00000 0.00000 0.00003 0.00000 79 2S -0.00001 -0.00000 -0.00007 -0.00064 -0.00004 80 2PX 0.00000 -0.00000 0.00001 0.00014 -0.00004 81 2PY -0.00004 -0.00000 -0.00009 -0.00122 -0.00011 82 2PZ -0.00000 -0.00000 0.00000 -0.00004 -0.00015 83 3S -0.00077 -0.00013 -0.00072 -0.00431 -0.00081 84 3PX 0.00040 -0.00001 0.00049 0.00129 0.00000 85 3PY -0.00033 0.00010 -0.00047 -0.00060 0.00038 86 3PZ 0.00024 -0.00021 -0.00016 0.00102 -0.00168 87 4XX 0.00000 -0.00000 -0.00000 0.00002 -0.00000 88 4YY 0.00000 0.00000 0.00002 0.00005 0.00001 89 4ZZ -0.00000 -0.00000 -0.00001 -0.00002 -0.00000 90 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 91 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 92 4YZ -0.00000 -0.00000 -0.00000 -0.00002 -0.00001 93 7 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 94 2S 0.00000 0.00000 0.00000 0.00000 0.00000 95 2PX 0.00000 0.00000 0.00000 -0.00000 0.00000 96 2PY 0.00000 0.00000 -0.00000 0.00001 -0.00000 97 2PZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 98 3S 0.00001 0.00000 -0.00001 0.00022 0.00005 99 3PX 0.00000 0.00000 0.00000 -0.00003 0.00003 100 3PY 0.00001 0.00000 -0.00011 0.00031 0.00003 101 3PZ 0.00000 0.00000 0.00001 0.00001 0.00001 102 4XX 0.00000 -0.00000 0.00000 0.00000 -0.00000 103 4YY -0.00000 0.00000 -0.00000 -0.00000 0.00000 104 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 105 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 106 4XZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 107 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 108 8 C 1S 0.00000 -0.00000 0.00000 0.00000 -0.00000 109 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 110 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 111 2PY 0.00000 0.00000 -0.00000 0.00000 0.00000 112 2PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 113 3S -0.00000 0.00000 -0.00000 -0.00001 0.00000 114 3PX -0.00000 -0.00000 0.00000 -0.00003 -0.00000 115 3PY 0.00000 0.00000 0.00000 0.00003 0.00000 116 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 117 4XX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 118 4YY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 119 4ZZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 120 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 121 4XZ 0.00000 -0.00000 0.00000 0.00000 0.00000 122 4YZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 123 9 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 124 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 125 2PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 126 2PY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 127 2PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 128 3S -0.00000 -0.00000 -0.00001 -0.00001 -0.00000 129 3PX -0.00000 -0.00000 -0.00000 -0.00002 -0.00000 130 3PY -0.00000 -0.00000 -0.00001 -0.00002 -0.00000 131 3PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 132 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 133 4YY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 134 4ZZ -0.00000 0.00000 -0.00000 0.00000 0.00000 135 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 136 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 137 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 138 10 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 139 2S 0.00000 0.00000 0.00000 0.00005 0.00002 140 2PX 0.00000 0.00000 -0.00000 0.00006 0.00002 141 2PY 0.00000 0.00000 0.00001 0.00004 0.00002 142 2PZ 0.00000 0.00000 0.00000 0.00003 0.00000 143 3S 0.00003 0.00000 0.00025 0.00059 0.00005 144 3PX 0.00004 0.00000 -0.00000 0.00069 0.00006 145 3PY 0.00002 -0.00002 -0.00000 0.00023 -0.00028 146 3PZ 0.00001 -0.00000 0.00010 0.00023 -0.00004 147 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 148 4YY -0.00000 -0.00000 -0.00000 -0.00001 -0.00000 149 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 150 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 151 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 152 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 153 11 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 154 2S 0.00000 -0.00000 0.00001 0.00005 -0.00004 155 12 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 156 2S 0.00000 0.00000 0.00000 0.00000 0.00000 157 13 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 158 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 159 14 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 160 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 161 15 H 1S -0.00001 -0.00001 -0.00004 0.00003 -0.00049 162 2S 0.00082 0.00047 -0.00004 0.00452 0.00176 163 16 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 164 2S 0.00000 0.00000 0.00001 0.00001 0.00003 165 2PX 0.00000 0.00000 0.00007 0.00006 0.00004 166 2PY -0.00000 -0.00000 -0.00023 -0.00013 -0.00002 167 2PZ -0.00000 -0.00000 -0.00017 -0.00010 0.00003 168 3S 0.00003 -0.00000 0.00222 0.00029 -0.00011 169 3PX 0.00002 -0.00005 -0.00015 0.00025 -0.00037 170 3PY -0.00010 -0.00006 -0.00127 -0.00051 -0.00046 171 3PZ -0.00008 0.00003 -0.00134 -0.00047 0.00037 172 4XX -0.00000 -0.00000 -0.00001 -0.00002 -0.00000 173 4YY 0.00000 0.00000 0.00002 0.00000 0.00000 174 4ZZ 0.00000 -0.00000 -0.00001 0.00000 -0.00000 175 4XY 0.00000 0.00000 0.00001 0.00000 0.00000 176 4XZ 0.00000 0.00000 0.00001 0.00000 -0.00000 177 4YZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 178 17 C 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 179 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 180 2PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 181 2PY -0.00000 -0.00000 -0.00002 -0.00001 -0.00000 182 2PZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 183 3S -0.00000 -0.00000 0.00003 -0.00000 -0.00000 184 3PX -0.00000 0.00000 0.00009 -0.00005 0.00001 185 3PY -0.00000 -0.00000 -0.00034 0.00001 -0.00000 186 3PZ -0.00000 0.00000 -0.00001 -0.00001 0.00004 187 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 188 4YY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 189 4ZZ 0.00000 -0.00000 0.00000 0.00000 0.00000 190 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 191 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 192 4YZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 193 18 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 194 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 195 2PX 0.00000 -0.00000 0.00000 0.00000 -0.00000 196 2PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 197 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 198 3S 0.00000 -0.00000 0.00000 0.00000 -0.00000 199 3PX 0.00000 -0.00000 -0.00000 0.00000 -0.00000 200 3PY 0.00000 -0.00000 0.00001 0.00000 -0.00000 201 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 202 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 203 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 204 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 205 4XY -0.00000 0.00000 -0.00000 -0.00000 0.00000 206 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 207 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 208 19 C 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 209 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 210 2PX -0.00000 -0.00000 0.00000 -0.00000 0.00000 211 2PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 212 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 213 3S -0.00000 0.00000 -0.00000 -0.00000 0.00000 214 3PX -0.00000 0.00000 -0.00000 -0.00000 0.00000 215 3PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 216 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 217 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 218 4YY 0.00000 -0.00000 0.00000 0.00000 -0.00000 219 4ZZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 220 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 221 4XZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 222 4YZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 223 20 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 224 2S 0.00000 0.00000 0.00000 0.00000 0.00000 225 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 226 2PY 0.00000 0.00000 0.00000 0.00000 0.00000 227 2PZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 228 3S 0.00000 0.00000 0.00000 0.00000 0.00000 229 3PX 0.00000 0.00000 0.00000 0.00000 0.00000 230 3PY 0.00000 0.00000 0.00000 0.00000 0.00000 231 3PZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 232 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 233 4YY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 234 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 235 4XY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 236 4XZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 237 4YZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 240 2PX -0.00000 -0.00000 -0.00001 -0.00000 -0.00000 241 2PY -0.00000 -0.00000 -0.00001 -0.00000 -0.00000 242 2PZ -0.00000 -0.00000 -0.00001 -0.00000 0.00000 243 3S -0.00000 -0.00000 -0.00017 -0.00006 -0.00001 244 3PX -0.00000 -0.00000 -0.00030 -0.00005 -0.00002 245 3PY -0.00000 0.00000 -0.00009 -0.00001 0.00001 246 3PZ -0.00000 0.00000 -0.00016 -0.00003 0.00001 247 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 248 4YY 0.00000 -0.00000 0.00000 0.00000 -0.00000 249 4ZZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 250 4XY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 251 4XZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 252 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 253 22 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 254 2S 0.00000 -0.00000 -0.00001 0.00001 -0.00002 255 23 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 256 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 257 24 H 1S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 258 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 259 25 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 260 2S 0.00000 0.00000 0.00000 0.00000 -0.00000 261 26 H 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 262 2S 0.00001 0.00000 -0.00010 0.00011 0.00000 263 27 H 1S 0.00000 -0.00001 -0.00111 0.00003 -0.00032 264 2S -0.00030 0.00057 -0.00215 -0.00107 0.00297 51 52 53 54 55 51 11XX 2.69331 52 11YY -0.09355 2.69303 53 11ZZ -0.09360 -0.09351 2.69323 54 11XY -0.00000 -0.00000 -0.00000 1.98258 55 11XZ 0.00000 0.00000 0.00000 -0.00000 1.98270 56 11YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 57 12XX 0.04860 0.01159 0.01190 0.00000 -0.00000 58 12YY 0.01221 0.04808 0.01205 0.00000 -0.00000 59 12ZZ 0.01214 0.01167 0.04841 0.00000 -0.00000 60 12XY -0.00000 -0.00000 -0.00000 0.00834 0.00000 61 12XZ 0.00000 0.00000 0.00000 0.00000 0.00825 62 12YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 63 5 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 64 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 65 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 66 2PY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 67 2PZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 68 3S -0.00002 0.00001 -0.00002 -0.00000 -0.00000 69 3PX 0.00003 0.00006 0.00002 0.00000 -0.00000 70 3PY 0.00018 0.00029 0.00013 -0.00001 0.00000 71 3PZ -0.00007 -0.00010 -0.00004 -0.00000 0.00000 72 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 73 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 74 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 75 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 76 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 77 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 78 6 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 79 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 80 2PX 0.00000 0.00000 -0.00000 0.00000 0.00000 81 2PY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 82 2PZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 83 3S 0.00001 0.00002 -0.00000 0.00000 -0.00000 84 3PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 85 3PY 0.00002 -0.00003 0.00003 -0.00000 -0.00000 86 3PZ 0.00002 0.00003 0.00002 0.00000 0.00000 87 4XX -0.00000 -0.00000 -0.00000 0.00000 0.00000 88 4YY -0.00000 0.00000 -0.00000 0.00000 0.00000 89 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 90 4XY -0.00000 0.00000 -0.00000 0.00000 0.00000 91 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 92 4YZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 93 7 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 94 2S 0.00000 0.00000 0.00000 0.00000 0.00000 95 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 96 2PY 0.00000 0.00000 0.00000 -0.00000 0.00000 97 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 98 3S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 99 3PX 0.00000 0.00000 0.00000 -0.00000 -0.00000 100 3PY 0.00000 0.00000 0.00000 0.00000 -0.00000 101 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 102 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 103 4YY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 104 4ZZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 105 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 106 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 107 4YZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 108 8 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 109 2S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 110 2PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 111 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 112 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 113 3S 0.00000 0.00000 0.00000 0.00000 -0.00000 114 3PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 115 3PY 0.00000 0.00000 0.00000 0.00000 -0.00000 116 3PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 117 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 118 4YY 0.00000 0.00000 0.00000 0.00000 -0.00000 119 4ZZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 120 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 121 4XZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 122 4YZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 123 9 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 124 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 125 2PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 126 2PY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 127 2PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 128 3S -0.00000 -0.00000 -0.00000 0.00000 0.00000 129 3PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 130 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 131 3PZ 0.00000 0.00000 0.00000 0.00000 0.00000 132 4XX -0.00000 0.00000 -0.00000 0.00000 -0.00000 133 4YY -0.00000 -0.00000 -0.00000 0.00000 0.00000 134 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 135 4XY -0.00000 0.00000 -0.00000 0.00000 0.00000 136 4XZ -0.00000 0.00000 0.00000 -0.00000 0.00000 137 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 138 10 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 139 2S 0.00000 0.00000 0.00000 0.00000 0.00000 140 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 141 2PY 0.00000 0.00000 0.00000 0.00000 0.00000 142 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 143 3S 0.00000 0.00000 0.00000 -0.00000 -0.00000 144 3PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 145 3PY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 146 3PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 147 4XX 0.00000 0.00000 0.00000 -0.00000 -0.00000 148 4YY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 149 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 150 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 151 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 152 4YZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 153 11 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 154 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 155 12 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 156 2S 0.00000 0.00000 0.00000 0.00000 0.00000 157 13 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 158 2S 0.00000 0.00000 0.00000 0.00000 0.00000 159 14 H 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 160 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 161 15 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 162 2S 0.00009 0.00011 0.00008 0.00000 -0.00000 163 16 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 164 2S 0.00000 0.00000 0.00000 0.00000 0.00000 165 2PX -0.00000 0.00000 -0.00000 0.00000 0.00000 166 2PY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 167 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 168 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 169 3PX -0.00001 -0.00001 -0.00000 0.00000 -0.00000 170 3PY 0.00000 0.00000 0.00000 0.00000 -0.00000 171 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 172 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 173 4YY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 174 4ZZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 175 4XY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 176 4XZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 177 4YZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 178 17 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 179 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 180 2PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 181 2PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 182 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 183 3S 0.00000 0.00000 0.00000 0.00000 -0.00000 184 3PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 185 3PY -0.00000 0.00000 0.00000 0.00000 0.00000 186 3PZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 187 4XX 0.00000 0.00000 0.00000 -0.00000 -0.00000 188 4YY -0.00000 0.00000 0.00000 -0.00000 -0.00000 189 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 190 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 191 4XZ -0.00000 -0.00000 0.00000 0.00000 0.00000 192 4YZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 193 18 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 194 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 195 2PX 0.00000 0.00000 0.00000 -0.00000 -0.00000 196 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 197 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 198 3S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 199 3PX 0.00000 0.00000 0.00000 0.00000 -0.00000 200 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 201 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 202 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 203 4YY 0.00000 0.00000 0.00000 -0.00000 -0.00000 204 4ZZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 205 4XY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 206 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 207 4YZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 210 2PX 0.00000 -0.00000 0.00000 0.00000 -0.00000 211 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 212 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 213 3S 0.00000 0.00000 0.00000 0.00000 0.00000 214 3PX 0.00000 0.00000 0.00000 -0.00000 0.00000 215 3PY 0.00000 0.00000 0.00000 0.00000 0.00000 216 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 219 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 222 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 224 2S 0.00000 0.00000 0.00000 0.00000 0.00000 225 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 226 2PY 0.00000 0.00000 0.00000 0.00000 0.00000 227 2PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 228 3S -0.00000 -0.00000 -0.00000 0.00000 0.00000 229 3PX -0.00000 -0.00000 -0.00000 0.00000 0.00000 230 3PY -0.00000 -0.00000 -0.00000 0.00000 0.00000 231 3PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 232 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 233 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 234 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 235 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 236 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 237 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 240 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 241 2PY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 242 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 243 3S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 244 3PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 245 3PY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 246 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 247 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 248 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 249 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 250 4XY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 251 4XZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 252 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 254 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 256 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 0.00000 0.00000 0.00000 259 25 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 260 2S -0.00000 -0.00000 -0.00000 0.00000 0.00000 261 26 H 1S 0.00000 -0.00000 0.00000 -0.00000 0.00000 262 2S 0.00000 0.00000 0.00000 0.00000 0.00000 263 27 H 1S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 264 2S 0.00007 0.00006 0.00006 0.00000 0.00000 56 57 58 59 60 56 11YZ 1.98263 57 12XX -0.00000 0.06082 58 12YY -0.00000 0.01989 0.06720 59 12ZZ -0.00000 0.01974 0.02044 0.06351 60 12XY 0.00000 -0.00000 -0.00000 -0.00000 0.00261 61 12XZ -0.00000 0.00000 0.00000 0.00000 0.00000 62 12YZ 0.00847 0.00000 0.00000 0.00000 0.00000 63 5 C 1S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 64 2S 0.00000 -0.00000 -0.00001 -0.00001 0.00001 65 2PX 0.00000 -0.00000 0.00002 0.00000 -0.00000 66 2PY -0.00000 -0.00002 0.00004 -0.00005 0.00006 67 2PZ -0.00000 -0.00000 -0.00004 0.00000 0.00001 68 3S 0.00000 -0.00001 -0.00048 -0.00009 0.00005 69 3PX -0.00000 0.00001 0.00013 0.00013 0.00002 70 3PY 0.00000 0.00020 0.00009 -0.00008 0.00016 71 3PZ 0.00000 -0.00013 -0.00052 -0.00003 0.00004 72 4XX 0.00000 0.00000 0.00000 -0.00000 -0.00000 73 4YY 0.00000 0.00000 0.00003 0.00000 0.00000 74 4ZZ 0.00000 -0.00000 -0.00001 -0.00000 -0.00000 75 4XY -0.00000 -0.00000 0.00000 -0.00000 0.00000 76 4XZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 77 4YZ 0.00000 0.00000 0.00001 -0.00000 -0.00000 78 6 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 79 2S -0.00000 -0.00000 -0.00002 -0.00000 0.00000 80 2PX -0.00000 -0.00000 0.00000 0.00000 0.00000 81 2PY -0.00000 -0.00001 -0.00008 -0.00001 0.00002 82 2PZ -0.00000 0.00000 -0.00001 -0.00000 0.00000 83 3S -0.00000 -0.00001 -0.00022 0.00003 0.00000 84 3PX -0.00000 0.00001 0.00010 0.00005 0.00003 85 3PY -0.00000 -0.00016 -0.00011 -0.00021 0.00010 86 3PZ 0.00000 0.00006 0.00020 0.00001 -0.00001 87 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 88 4YY 0.00000 0.00000 0.00000 -0.00000 -0.00000 89 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 90 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 91 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 92 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 93 7 C 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 94 2S 0.00000 0.00000 0.00000 0.00000 -0.00000 95 2PX 0.00000 0.00000 0.00000 0.00000 -0.00000 96 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 97 2PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 98 3S -0.00000 0.00000 0.00001 0.00000 -0.00000 99 3PX -0.00000 0.00000 0.00001 0.00000 -0.00000 100 3PY -0.00000 0.00000 0.00002 0.00000 0.00000 101 3PZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 102 4XX -0.00000 0.00000 0.00000 0.00000 -0.00000 103 4YY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 104 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 105 4XY -0.00000 0.00000 0.00000 0.00000 -0.00000 106 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 107 4YZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 108 8 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 109 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 110 2PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 111 2PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 112 2PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 113 3S 0.00000 -0.00000 0.00000 -0.00000 0.00000 114 3PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 115 3PY 0.00000 0.00000 0.00000 0.00000 -0.00000 116 3PZ -0.00000 0.00000 0.00000 0.00000 0.00000 117 4XX -0.00000 0.00000 0.00000 0.00000 -0.00000 118 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 119 4ZZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 120 4XY -0.00000 0.00000 0.00000 0.00000 -0.00000 121 4XZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 122 4YZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 123 9 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 124 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 125 2PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 126 2PY -0.00000 0.00000 0.00000 0.00000 0.00000 127 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 128 3S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 129 3PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 130 3PY -0.00000 -0.00000 -0.00000 0.00000 0.00000 131 3PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 132 4XX 0.00000 -0.00000 0.00000 0.00000 -0.00000 133 4YY -0.00000 0.00000 0.00000 -0.00000 -0.00000 134 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 135 4XY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 136 4XZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 137 4YZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 138 10 C 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 139 2S 0.00000 0.00000 0.00000 0.00000 -0.00000 140 2PX 0.00000 -0.00000 0.00000 0.00000 -0.00000 141 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 142 2PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 143 3S -0.00000 0.00000 0.00001 0.00001 -0.00000 144 3PX -0.00000 -0.00000 -0.00000 0.00000 0.00000 145 3PY -0.00000 -0.00000 -0.00002 -0.00001 -0.00001 146 3PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 147 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 148 4YY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 149 4ZZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 150 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 151 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00000 152 4YZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 153 11 H 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 154 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 155 12 H 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 156 2S 0.00000 0.00000 0.00000 0.00000 -0.00000 157 13 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 158 2S 0.00000 0.00000 0.00000 0.00000 0.00000 159 14 H 1S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 160 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 161 15 H 1S -0.00000 -0.00001 -0.00004 -0.00002 0.00000 162 2S -0.00001 0.00007 0.00031 0.00017 -0.00002 163 16 C 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 164 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 165 2PX 0.00000 -0.00000 -0.00000 0.00000 -0.00000 166 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 167 2PZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 168 3S 0.00000 -0.00001 -0.00001 0.00001 0.00000 169 3PX 0.00000 -0.00005 -0.00008 -0.00002 -0.00001 170 3PY 0.00000 0.00001 -0.00005 -0.00001 0.00003 171 3PZ -0.00000 -0.00001 -0.00005 -0.00000 0.00001 172 4XX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 173 4YY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 174 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 175 4XY 0.00000 0.00000 -0.00000 -0.00000 0.00000 176 4XZ -0.00000 -0.00000 0.00000 0.00000 0.00000 177 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 178 17 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 179 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 180 2PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 181 2PY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 182 2PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 183 3S -0.00000 0.00000 0.00000 -0.00000 -0.00000 184 3PX -0.00000 -0.00000 -0.00001 -0.00000 -0.00000 185 3PY 0.00000 0.00000 -0.00001 0.00000 0.00000 186 3PZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 187 4XX 0.00000 0.00000 0.00000 -0.00000 0.00000 188 4YY -0.00000 0.00000 -0.00000 -0.00000 0.00000 189 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 190 4XY -0.00000 0.00000 0.00000 0.00000 -0.00000 191 4XZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 192 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 193 18 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 194 2S -0.00000 0.00000 0.00000 0.00000 0.00000 195 2PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 196 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 197 2PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 198 3S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 199 3PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 200 3PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 201 3PZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 202 4XX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 203 4YY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 204 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 205 4XY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 206 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 207 4YZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 208 19 C 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 209 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 210 2PX 0.00000 0.00000 0.00000 0.00000 -0.00000 211 2PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 212 2PZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 213 3S -0.00000 0.00000 0.00000 0.00000 -0.00000 214 3PX -0.00000 0.00000 0.00000 0.00000 0.00000 215 3PY -0.00000 0.00000 0.00000 0.00000 -0.00000 216 3PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY 0.00000 -0.00000 0.00000 0.00000 -0.00000 219 4ZZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 221 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 222 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 223 20 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 224 2S 0.00000 0.00000 0.00000 0.00000 -0.00000 225 2PX 0.00000 0.00000 0.00000 0.00000 -0.00000 226 2PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 227 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 228 3S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 229 3PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 230 3PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 231 3PZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 232 4XX 0.00000 0.00000 0.00000 -0.00000 0.00000 233 4YY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 234 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 235 4XY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 236 4XZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 237 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 238 21 C 1S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 239 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 240 2PX -0.00000 -0.00000 0.00000 -0.00000 0.00000 241 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 242 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 243 3S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 244 3PX 0.00000 -0.00001 -0.00000 -0.00000 0.00000 245 3PY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 246 3PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 247 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 248 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 249 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 250 4XY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 251 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 252 4YZ -0.00000 0.00000 0.00000 0.00000 -0.00000 253 22 H 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 254 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 255 23 H 1S 0.00000 -0.00000 0.00000 -0.00000 0.00000 256 2S -0.00000 -0.00000 0.00000 -0.00000 0.00000 257 24 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 258 2S -0.00000 0.00000 0.00000 0.00000 0.00000 259 25 H 1S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 260 2S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 261 26 H 1S 0.00000 -0.00000 0.00000 -0.00000 0.00000 262 2S -0.00000 0.00000 0.00001 0.00000 0.00000 263 27 H 1S 0.00000 0.00001 -0.00001 -0.00002 -0.00001 264 2S 0.00000 0.00033 0.00003 0.00015 -0.00010 61 62 63 64 65 61 12XZ 0.00180 62 12YZ -0.00000 0.00500 63 5 C 1S -0.00000 0.00000 2.05260 64 2S 0.00000 -0.00001 -0.01364 0.33013 65 2PX -0.00000 -0.00001 0.00000 0.00000 0.37071 66 2PY 0.00001 -0.00002 0.00000 0.00000 0.00000 67 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 68 3S -0.00000 -0.00006 -0.03214 0.21447 0.00000 69 3PX -0.00001 -0.00004 0.00000 0.00000 0.10564 70 3PY -0.00001 -0.00022 0.00000 0.00000 -0.00000 71 3PZ -0.00001 0.00005 0.00000 0.00000 -0.00000 72 4XX -0.00000 -0.00000 -0.00100 -0.00849 0.00000 73 4YY 0.00000 0.00001 -0.00117 -0.00525 0.00000 74 4ZZ -0.00000 -0.00000 -0.00130 -0.00224 0.00000 75 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 76 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 77 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 78 6 C 1S -0.00000 -0.00000 0.00000 -0.00050 -0.00008 79 2S 0.00000 0.00000 -0.00051 0.01047 0.00108 80 2PX 0.00000 0.00000 -0.00009 0.00141 0.01251 81 2PY 0.00000 0.00001 -0.00015 0.00230 0.00157 82 2PZ 0.00000 0.00000 -0.00251 0.03793 0.00440 83 3S 0.00000 0.00003 -0.00031 0.01025 0.00183 84 3PX 0.00000 0.00001 0.00000 -0.00006 0.02185 85 3PY 0.00001 0.00005 0.00002 -0.00027 0.00077 86 3PZ 0.00000 0.00001 -0.00116 0.01818 0.00168 87 4XX -0.00000 -0.00000 0.00000 -0.00042 0.00005 88 4YY -0.00000 -0.00000 0.00001 -0.00054 -0.00002 89 4ZZ 0.00000 0.00000 -0.00021 0.00306 0.00050 90 4XY 0.00000 0.00000 0.00000 -0.00001 0.00008 91 4XZ 0.00000 0.00000 -0.00002 0.00023 0.00141 92 4YZ 0.00000 0.00000 -0.00003 0.00037 0.00009 93 7 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 94 2S -0.00000 -0.00000 0.00000 -0.00009 -0.00004 95 2PX -0.00000 -0.00000 0.00000 -0.00007 0.00001 96 2PY -0.00000 -0.00000 0.00000 -0.00017 -0.00011 97 2PZ 0.00000 0.00000 0.00000 -0.00015 -0.00005 98 3S -0.00000 -0.00000 0.00003 -0.00114 -0.00076 99 3PX -0.00000 -0.00000 0.00005 -0.00069 -0.00006 100 3PY -0.00000 -0.00000 0.00011 -0.00191 -0.00145 101 3PZ 0.00000 -0.00000 -0.00004 -0.00034 -0.00004 102 4XX -0.00000 0.00000 0.00000 -0.00000 -0.00001 103 4YY 0.00000 0.00000 0.00000 -0.00000 0.00003 104 4ZZ -0.00000 0.00000 -0.00000 0.00001 0.00000 105 4XY -0.00000 0.00000 0.00000 -0.00000 -0.00001 106 4XZ -0.00000 -0.00000 -0.00000 0.00001 0.00000 107 4YZ -0.00000 -0.00000 -0.00000 0.00002 0.00001 108 8 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 109 2S -0.00000 -0.00000 0.00000 -0.00001 -0.00001 110 2PX -0.00000 -0.00000 0.00000 -0.00001 0.00007 111 2PY 0.00000 -0.00000 0.00000 -0.00002 -0.00012 112 2PZ -0.00000 0.00000 0.00000 -0.00000 -0.00001 113 3S -0.00000 -0.00000 0.00004 -0.00073 -0.00036 114 3PX -0.00000 -0.00000 0.00002 -0.00017 0.00095 115 3PY 0.00000 -0.00000 0.00006 -0.00074 -0.00218 116 3PZ 0.00000 0.00000 0.00000 -0.00005 -0.00008 117 4XX 0.00000 0.00000 -0.00000 0.00000 -0.00000 118 4YY 0.00000 0.00000 0.00000 -0.00000 0.00000 119 4ZZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 120 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 121 4XZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 122 4YZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 123 9 C 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 124 2S 0.00000 -0.00000 0.00000 -0.00008 -0.00008 125 2PX -0.00000 0.00000 0.00000 -0.00010 0.00001 126 2PY 0.00000 -0.00000 0.00000 -0.00027 -0.00026 127 2PZ -0.00000 0.00000 0.00000 -0.00001 -0.00000 128 3S 0.00000 -0.00000 0.00001 -0.00090 -0.00107 129 3PX -0.00000 0.00000 0.00003 -0.00072 0.00014 130 3PY 0.00000 -0.00000 0.00009 -0.00217 -0.00244 131 3PZ -0.00000 0.00000 -0.00004 0.00036 0.00032 132 4XX 0.00000 0.00000 -0.00000 0.00000 -0.00001 133 4YY -0.00000 0.00000 -0.00000 0.00001 0.00007 134 4ZZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 135 4XY 0.00000 0.00000 -0.00000 0.00001 -0.00001 136 4XZ -0.00000 -0.00000 -0.00000 0.00000 0.00001 137 4YZ -0.00000 -0.00000 -0.00000 0.00001 -0.00000 138 10 C 1S 0.00000 -0.00000 0.00000 -0.00050 -0.00032 139 2S -0.00000 0.00000 -0.00051 0.01040 0.00475 140 2PX -0.00000 0.00000 -0.00032 0.00475 0.00581 141 2PY -0.00000 0.00000 -0.00100 0.01590 0.01337 142 2PZ -0.00000 -0.00000 -0.00139 0.02075 0.00783 143 3S -0.00000 0.00000 0.00009 0.00805 0.00547 144 3PX -0.00000 0.00000 -0.00003 0.00061 0.01660 145 3PY -0.00000 -0.00000 -0.00034 0.00535 0.00614 146 3PZ -0.00000 -0.00000 -0.00064 0.01166 0.00292 147 4XX 0.00000 -0.00000 0.00001 -0.00032 0.00002 148 4YY 0.00000 -0.00000 -0.00001 0.00007 0.00025 149 4ZZ -0.00000 0.00000 -0.00004 0.00061 0.00039 150 4XY 0.00000 -0.00000 -0.00002 0.00024 0.00022 151 4XZ 0.00000 -0.00000 -0.00005 0.00053 0.00024 152 4YZ -0.00000 -0.00000 -0.00015 0.00166 0.00088 153 11 H 1S -0.00000 0.00000 0.00000 -0.00018 -0.00002 154 2S -0.00000 0.00000 0.00018 -0.00273 -0.00016 155 12 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 156 2S -0.00000 0.00000 -0.00000 0.00012 0.00008 157 13 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 158 2S -0.00000 -0.00000 0.00000 -0.00000 0.00000 159 14 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 160 2S -0.00000 -0.00000 -0.00000 0.00012 0.00003 161 15 H 1S 0.00000 0.00004 0.00000 -0.00018 0.00000 162 2S 0.00001 0.00023 0.00019 -0.00280 -0.00003 163 16 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 164 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 165 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 166 2PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 167 2PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 168 3S -0.00000 0.00001 -0.00000 0.00000 -0.00055 169 3PX -0.00000 -0.00000 -0.00001 0.00001 -0.00059 170 3PY -0.00000 -0.00001 -0.00000 0.00003 0.00001 171 3PZ 0.00000 0.00001 0.00000 -0.00000 -0.00000 172 4XX 0.00000 0.00000 0.00000 -0.00000 -0.00000 173 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 174 4ZZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 175 4XY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 176 4XZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 177 4YZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 178 17 C 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 179 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 180 2PX 0.00000 0.00000 0.00000 -0.00000 -0.00001 181 2PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 182 2PZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 183 3S 0.00000 0.00000 0.00000 -0.00004 -0.00035 184 3PX -0.00000 -0.00000 0.00000 -0.00008 -0.00004 185 3PY -0.00000 -0.00000 0.00001 -0.00002 0.00038 186 3PZ 0.00000 0.00000 0.00000 -0.00002 0.00014 187 4XX 0.00000 0.00000 -0.00000 -0.00000 -0.00000 188 4YY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 189 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 190 4XY -0.00000 -0.00000 -0.00000 0.00000 0.00000 191 4XZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 192 4YZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 193 18 C 1S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 194 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 195 2PX 0.00000 0.00000 -0.00000 0.00000 0.00000 196 2PY 0.00000 0.00000 0.00000 0.00000 0.00000 197 2PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 198 3S 0.00000 0.00000 0.00000 0.00000 0.00000 199 3PX 0.00000 0.00000 0.00000 -0.00000 0.00001 200 3PY 0.00000 0.00000 0.00000 0.00000 0.00000 201 3PZ 0.00000 -0.00000 0.00000 0.00000 0.00000 202 4XX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 203 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 204 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 205 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 206 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 207 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 208 19 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 209 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 210 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 211 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 212 2PZ -0.00000 -0.00000 0.00000 0.00000 0.00000 213 3S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 214 3PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 215 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 216 3PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 219 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 222 4YZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 223 20 C 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 224 2S -0.00000 -0.00000 -0.00000 0.00000 0.00000 225 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 226 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 227 2PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 228 3S -0.00000 -0.00000 0.00000 0.00000 0.00000 229 3PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 230 3PY -0.00000 0.00000 0.00000 -0.00000 0.00000 231 3PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 232 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 233 4YY -0.00000 -0.00000 0.00000 -0.00000 0.00000 234 4ZZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 235 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 236 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00000 237 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 238 21 C 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 239 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 240 2PX 0.00000 0.00000 0.00000 -0.00000 -0.00000 241 2PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 242 2PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 243 3S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 244 3PX 0.00000 -0.00000 -0.00000 0.00000 -0.00000 245 3PY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 246 3PZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 247 4XX -0.00000 -0.00000 -0.00000 0.00000 0.00000 248 4YY 0.00000 0.00000 -0.00000 0.00000 -0.00000 249 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 250 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 251 4XZ 0.00000 -0.00000 0.00000 0.00000 0.00000 252 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 254 2S 0.00000 -0.00000 -0.00000 0.00000 0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 256 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 259 25 H 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 260 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 261 26 H 1S -0.00000 -0.00000 0.00000 -0.00001 -0.00002 262 2S -0.00000 -0.00000 0.00005 -0.00067 0.00076 263 27 H 1S 0.00002 -0.00001 -0.00000 0.00000 0.00000 264 2S 0.00000 -0.00005 -0.00000 0.00005 0.00019 66 67 68 69 70 66 2PY 0.38400 67 2PZ 0.00000 0.43347 68 3S 0.00000 0.00000 0.28648 69 3PX -0.00000 -0.00000 0.00000 0.12508 70 3PY 0.05503 0.00000 0.00000 -0.00000 0.05601 71 3PZ 0.00000 0.05033 0.00000 -0.00000 0.00000 72 4XX 0.00000 0.00000 -0.00486 0.00000 0.00000 73 4YY 0.00000 0.00000 -0.00305 0.00000 0.00000 74 4ZZ 0.00000 0.00000 -0.00282 0.00000 0.00000 75 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 76 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 77 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 78 6 C 1S -0.00011 -0.00243 0.00006 0.00014 0.00018 79 2S 0.00142 0.03656 0.00864 0.00024 0.00054 80 2PX 0.00165 0.00487 0.00031 0.02329 0.00054 81 2PY 0.00465 0.00581 0.00111 0.00051 0.01670 82 2PZ 0.00525 0.08183 0.03406 0.00017 -0.00070 83 3S 0.00288 0.03579 0.00379 -0.00032 -0.00032 84 3PX 0.00078 0.00256 -0.00200 0.03385 0.00078 85 3PY 0.01356 0.00296 -0.00179 0.00080 0.01993 86 3PZ 0.00296 0.01628 0.01109 -0.00014 -0.00006 87 4XX -0.00004 -0.00084 -0.00062 -0.00014 0.00009 88 4YY 0.00005 -0.00122 -0.00163 0.00021 -0.00001 89 4ZZ 0.00070 0.00134 0.00309 -0.00004 -0.00022 90 4XY 0.00005 -0.00003 -0.00001 0.00002 -0.00002 91 4XZ 0.00008 0.00062 0.00014 0.00090 0.00003 92 4YZ 0.00113 0.00088 0.00021 0.00005 0.00035 93 7 C 1S 0.00000 0.00000 -0.00002 -0.00005 -0.00013 94 2S -0.00009 -0.00020 -0.00071 0.00053 0.00139 95 2PX -0.00010 -0.00013 -0.00083 -0.00018 0.00097 96 2PY -0.00007 -0.00024 -0.00042 0.00019 0.00111 97 2PZ -0.00009 -0.00025 -0.00310 0.00052 0.00179 98 3S -0.00204 -0.00098 -0.00264 0.00100 0.00156 99 3PX -0.00132 -0.00064 -0.00319 -0.00207 0.00028 100 3PY -0.00064 -0.00097 -0.00292 -0.00136 0.00049 101 3PZ -0.00026 -0.00006 -0.00341 0.00046 0.00131 102 4XX 0.00002 0.00000 -0.00000 -0.00016 0.00019 103 4YY -0.00002 -0.00001 -0.00003 0.00030 -0.00015 104 4ZZ 0.00001 0.00004 0.00015 -0.00007 -0.00017 105 4XY 0.00001 0.00000 -0.00001 0.00000 0.00004 106 4XZ 0.00001 0.00003 0.00005 -0.00000 0.00001 107 4YZ 0.00002 0.00007 0.00015 0.00001 0.00002 108 8 C 1S 0.00000 0.00000 0.00005 0.00003 0.00008 109 2S -0.00002 -0.00000 -0.00095 -0.00030 -0.00086 110 2PX -0.00013 -0.00001 -0.00057 0.00101 -0.00150 111 2PY 0.00005 -0.00001 -0.00121 -0.00205 0.00125 112 2PZ -0.00001 -0.00000 -0.00014 -0.00008 -0.00012 113 3S -0.00085 -0.00004 -0.00582 -0.00103 -0.00261 114 3PX -0.00230 -0.00007 -0.00148 0.00127 -0.00489 115 3PY 0.00149 -0.00001 -0.00274 -0.00659 0.00391 116 3PZ -0.00008 -0.00015 -0.00039 -0.00014 -0.00000 117 4XX 0.00000 -0.00000 0.00002 0.00001 0.00004 118 4YY -0.00000 -0.00000 0.00002 0.00002 0.00008 119 4ZZ 0.00000 0.00000 0.00002 -0.00001 -0.00004 120 4XY 0.00000 -0.00000 -0.00001 0.00001 0.00004 121 4XZ -0.00000 0.00000 0.00000 -0.00000 -0.00001 122 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 123 9 C 1S 0.00000 0.00000 -0.00004 -0.00004 -0.00012 124 2S -0.00021 -0.00004 -0.00046 0.00028 0.00069 125 2PX -0.00026 -0.00004 -0.00038 0.00027 0.00010 126 2PY -0.00033 -0.00010 -0.00229 0.00012 0.00246 127 2PZ -0.00002 0.00000 -0.00099 -0.00016 -0.00061 128 3S -0.00271 0.00036 -0.00049 -0.00001 0.00039 129 3PX -0.00242 0.00008 -0.00094 -0.00052 -0.00195 130 3PY -0.00156 0.00031 -0.00630 -0.00210 0.00297 131 3PZ 0.00066 -0.00004 -0.00037 0.00001 -0.00047 132 4XX 0.00003 0.00000 0.00006 -0.00019 0.00025 133 4YY 0.00000 0.00002 0.00016 0.00045 -0.00008 134 4ZZ -0.00001 -0.00000 -0.00010 -0.00003 -0.00014 135 4XY 0.00006 0.00001 0.00006 -0.00002 0.00014 136 4XZ 0.00000 0.00000 0.00003 0.00001 -0.00002 137 4YZ 0.00004 0.00000 0.00008 -0.00005 0.00006 138 10 C 1S -0.00094 -0.00138 0.00034 -0.00004 -0.00014 139 2S 0.01366 0.02133 0.00654 0.00304 0.00808 140 2PX 0.01351 0.00780 0.00392 0.01871 0.00393 141 2PY 0.00249 0.02747 0.00810 0.00501 0.00263 142 2PZ 0.02608 0.01795 0.02369 0.00134 0.00691 143 3S 0.01603 0.01612 -0.00496 0.00183 0.00497 144 3PX 0.00681 0.00410 0.00023 0.03294 0.00448 145 3PY 0.00101 0.01461 -0.00445 0.00532 0.00606 146 3PZ 0.01189 -0.00030 0.01544 -0.00053 0.00263 147 4XX -0.00014 -0.00026 -0.00022 -0.00047 0.00039 148 4YY -0.00069 0.00060 0.00054 0.00074 -0.00056 149 4ZZ 0.00116 -0.00121 -0.00021 -0.00014 -0.00026 150 4XY 0.00004 0.00059 0.00009 0.00020 -0.00003 151 4XZ 0.00091 0.00036 0.00027 0.00038 0.00013 152 4YZ 0.00032 0.00105 0.00075 0.00012 0.00003 153 11 H 1S -0.00008 -0.00067 -0.00450 -0.00013 -0.00071 154 2S -0.00044 -0.00981 -0.01351 -0.00059 -0.00175 155 12 H 1S 0.00000 0.00000 0.00011 -0.00000 0.00001 156 2S 0.00023 0.00013 0.00129 0.00003 0.00027 157 13 H 1S 0.00000 0.00000 0.00001 -0.00000 0.00000 158 2S 0.00001 0.00000 0.00022 0.00007 0.00023 159 14 H 1S 0.00000 0.00000 0.00011 -0.00003 -0.00007 160 2S 0.00006 0.00033 0.00130 -0.00022 -0.00060 161 15 H 1S -0.00000 -0.00075 -0.00365 0.00006 0.00043 162 2S -0.00059 -0.00937 -0.01297 0.00014 0.00024 163 16 C 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 164 2S -0.00000 0.00000 -0.00004 -0.00007 -0.00002 165 2PX -0.00000 0.00000 -0.00018 -0.00010 -0.00005 166 2PY -0.00000 -0.00000 0.00002 0.00006 -0.00005 167 2PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 168 3S -0.00001 0.00000 -0.00070 -0.00302 0.00000 169 3PX -0.00001 0.00000 -0.00059 -0.00193 0.00009 170 3PY -0.00003 -0.00000 0.00017 -0.00000 -0.00011 171 3PZ -0.00000 -0.00001 0.00000 -0.00001 0.00000 172 4XX -0.00000 0.00000 -0.00001 -0.00005 -0.00000 173 4YY -0.00000 -0.00000 0.00000 0.00001 0.00000 174 4ZZ 0.00000 0.00000 0.00000 0.00001 0.00000 175 4XY -0.00000 -0.00000 0.00000 0.00000 -0.00000 176 4XZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 177 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 178 17 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 179 2S -0.00000 -0.00000 0.00005 -0.00007 -0.00011 180 2PX -0.00000 -0.00000 0.00009 -0.00043 -0.00017 181 2PY 0.00000 -0.00000 0.00001 0.00016 0.00001 182 2PZ -0.00000 0.00000 0.00004 0.00006 -0.00001 183 3S -0.00008 -0.00003 0.00047 -0.00122 -0.00073 184 3PX -0.00007 -0.00004 0.00042 0.00034 -0.00014 185 3PY -0.00002 0.00002 -0.00007 0.00174 -0.00014 186 3PZ 0.00001 -0.00001 0.00022 0.00084 0.00006 187 4XX -0.00000 -0.00000 0.00001 -0.00001 -0.00001 188 4YY -0.00000 0.00000 -0.00000 -0.00001 0.00000 189 4ZZ -0.00000 0.00000 -0.00000 -0.00001 0.00000 190 4XY 0.00000 0.00000 -0.00000 0.00001 -0.00000 191 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 192 4YZ -0.00000 0.00000 0.00000 -0.00000 0.00000 193 18 C 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 194 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 195 2PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 196 2PY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 197 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 198 3S 0.00000 0.00000 -0.00001 0.00013 0.00004 199 3PX 0.00000 0.00000 -0.00003 0.00013 0.00005 200 3PY 0.00000 0.00000 -0.00000 0.00004 0.00000 201 3PZ 0.00000 0.00000 0.00000 0.00003 0.00001 202 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 203 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 204 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 205 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 206 4XZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 207 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 208 19 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 209 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 210 2PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 211 2PY 0.00000 0.00000 0.00000 -0.00000 -0.00000 212 2PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 213 3S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 214 3PX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 215 3PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 216 3PZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 217 4XX 0.00000 0.00000 -0.00000 0.00000 0.00000 218 4YY -0.00000 0.00000 0.00000 0.00000 -0.00000 219 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 220 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 222 4YZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 223 20 C 1S -0.00000 0.00000 0.00000 -0.00000 -0.00000 224 2S 0.00000 -0.00000 -0.00000 0.00000 0.00000 225 2PX 0.00000 -0.00000 0.00000 0.00000 0.00000 226 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 227 2PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 228 3S 0.00000 -0.00000 0.00000 0.00000 0.00000 229 3PX 0.00000 -0.00000 0.00000 0.00000 0.00000 230 3PY 0.00000 0.00000 -0.00000 -0.00000 0.00000 231 3PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 232 4XX 0.00000 -0.00000 0.00000 -0.00000 0.00000 233 4YY 0.00000 0.00000 -0.00000 0.00000 -0.00000 234 4ZZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 235 4XY -0.00000 -0.00000 0.00000 -0.00000 0.00000 236 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 237 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 238 21 C 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 239 2S -0.00000 -0.00000 0.00000 -0.00000 0.00000 240 2PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 241 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 242 2PZ -0.00000 0.00000 0.00000 0.00000 0.00000 243 3S -0.00000 -0.00000 0.00000 -0.00003 0.00000 244 3PX 0.00000 0.00000 0.00003 -0.00010 0.00001 245 3PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 246 3PZ -0.00000 0.00000 0.00000 0.00001 0.00000 247 4XX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 248 4YY -0.00000 -0.00000 0.00000 -0.00000 0.00000 249 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 250 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 251 4XZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 252 4YZ -0.00000 0.00000 0.00000 0.00000 -0.00000 253 22 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 254 2S -0.00000 -0.00000 0.00000 0.00000 0.00000 255 23 H 1S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 256 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 259 25 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 260 2S 0.00000 -0.00000 0.00000 0.00001 0.00000 261 26 H 1S -0.00001 -0.00000 0.00029 -0.00000 -0.00040 262 2S 0.00038 0.00007 -0.00012 0.00264 0.00034 263 27 H 1S 0.00000 0.00000 0.00005 0.00011 0.00009 264 2S 0.00009 0.00002 0.00089 0.00161 0.00053 71 72 73 74 75 71 3PZ 0.03671 72 4XX 0.00000 0.00090 73 4YY 0.00000 0.00011 0.00115 74 4ZZ 0.00000 -0.00002 -0.00014 0.00118 75 4XY 0.00000 0.00000 0.00000 -0.00000 0.00064 76 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 77 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 78 6 C 1S -0.00042 0.00000 0.00001 -0.00021 0.00000 79 2S 0.01300 -0.00040 -0.00048 0.00283 -0.00001 80 2PX 0.00011 0.00003 -0.00006 0.00042 0.00009 81 2PY 0.00019 -0.00006 0.00005 0.00054 0.00007 82 2PZ 0.00918 -0.00089 -0.00102 0.00034 -0.00004 83 3S 0.00394 -0.00095 -0.00167 0.00380 -0.00002 84 3PX 0.00006 -0.00007 -0.00001 0.00024 0.00004 85 3PY 0.00080 0.00000 -0.00008 0.00019 0.00002 86 3PZ 0.00068 -0.00090 -0.00119 0.00056 -0.00002 87 4XX -0.00036 0.00002 0.00001 -0.00006 -0.00000 88 4YY -0.00085 0.00001 0.00002 -0.00003 -0.00000 89 4ZZ 0.00011 -0.00007 -0.00008 0.00007 -0.00000 90 4XY -0.00001 -0.00000 -0.00000 0.00000 0.00000 91 4XZ 0.00006 0.00001 0.00001 -0.00003 -0.00000 92 4YZ 0.00009 0.00000 -0.00000 -0.00007 -0.00001 93 7 C 1S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 94 2S -0.00082 0.00000 0.00001 -0.00000 0.00000 95 2PX 0.00019 0.00000 0.00001 0.00000 0.00000 96 2PY 0.00170 0.00001 0.00001 -0.00000 0.00001 97 2PZ -0.00282 0.00000 0.00001 0.00000 0.00001 98 3S -0.00033 0.00004 0.00010 -0.00009 0.00002 99 3PX 0.00009 0.00003 0.00006 0.00000 -0.00000 100 3PY 0.00249 0.00007 0.00014 -0.00010 0.00002 101 3PZ -0.00137 -0.00001 0.00000 0.00003 0.00000 102 4XX -0.00003 -0.00000 0.00000 0.00000 -0.00000 103 4YY -0.00009 0.00000 -0.00000 0.00000 0.00000 104 4ZZ 0.00027 -0.00000 -0.00000 -0.00000 -0.00000 105 4XY -0.00002 -0.00000 0.00000 0.00000 0.00000 106 4XZ 0.00006 -0.00000 -0.00000 0.00000 -0.00000 107 4YZ 0.00012 -0.00000 -0.00000 0.00000 0.00000 108 8 C 1S 0.00001 -0.00000 0.00000 -0.00000 0.00000 109 2S -0.00006 0.00000 -0.00000 0.00000 -0.00000 110 2PX -0.00005 -0.00000 0.00000 0.00000 -0.00000 111 2PY -0.00027 0.00000 -0.00000 0.00000 -0.00000 112 2PZ -0.00048 -0.00000 -0.00000 0.00000 -0.00000 113 3S -0.00013 0.00001 -0.00001 0.00002 -0.00001 114 3PX -0.00005 -0.00000 0.00003 -0.00000 0.00000 115 3PY -0.00029 0.00003 0.00000 -0.00000 0.00001 116 3PZ -0.00140 -0.00000 -0.00002 0.00001 -0.00001 117 4XX -0.00000 -0.00000 0.00000 -0.00000 0.00000 118 4YY -0.00002 0.00000 0.00000 -0.00000 0.00000 119 4ZZ 0.00001 -0.00000 -0.00000 0.00000 -0.00000 120 4XY -0.00001 0.00000 0.00000 -0.00000 0.00000 121 4XZ -0.00001 -0.00000 0.00000 -0.00000 -0.00000 122 4YZ -0.00002 0.00000 0.00000 -0.00000 0.00000 123 9 C 1S 0.00003 -0.00000 -0.00000 0.00000 -0.00000 124 2S -0.00064 0.00000 0.00002 -0.00000 0.00001 125 2PX -0.00057 -0.00000 0.00007 -0.00001 0.00000 126 2PY -0.00083 0.00003 0.00006 -0.00001 0.00007 127 2PZ 0.00103 -0.00000 -0.00001 0.00000 -0.00000 128 3S -0.00031 0.00006 0.00024 -0.00013 0.00006 129 3PX -0.00057 -0.00006 0.00039 -0.00008 -0.00000 130 3PY 0.00012 0.00025 0.00019 -0.00014 0.00015 131 3PZ 0.00156 -0.00002 -0.00003 0.00000 -0.00001 132 4XX 0.00000 -0.00000 0.00000 0.00000 -0.00000 133 4YY 0.00010 0.00000 -0.00000 -0.00000 0.00000 134 4ZZ 0.00001 -0.00000 -0.00000 0.00000 -0.00000 135 4XY 0.00001 -0.00000 0.00000 -0.00000 0.00000 136 4XZ -0.00002 -0.00000 -0.00000 -0.00000 -0.00000 137 4YZ -0.00006 -0.00000 -0.00000 -0.00000 -0.00000 138 10 C 1S -0.00062 0.00001 -0.00001 -0.00005 -0.00002 139 2S 0.00746 -0.00030 0.00006 0.00050 0.00024 140 2PX 0.00139 0.00001 0.00001 0.00039 0.00024 141 2PY 0.00909 -0.00023 -0.00075 0.00114 -0.00007 142 2PZ -0.00040 -0.00031 0.00069 -0.00122 0.00060 143 3S 0.00225 -0.00059 -0.00046 0.00132 -0.00000 144 3PX 0.00018 -0.00037 0.00041 0.00019 0.00024 145 3PY 0.00573 0.00018 -0.00075 0.00064 -0.00000 146 3PZ -0.00101 -0.00037 -0.00005 -0.00049 0.00001 147 4XX -0.00002 0.00001 0.00001 -0.00003 -0.00000 148 4YY 0.00014 0.00001 0.00002 -0.00012 0.00001 149 4ZZ -0.00056 -0.00005 -0.00017 0.00010 -0.00007 150 4XY 0.00004 0.00000 0.00001 -0.00003 -0.00001 151 4XZ 0.00000 0.00001 0.00001 -0.00001 0.00000 152 4YZ 0.00000 -0.00003 -0.00003 -0.00003 0.00001 153 11 H 1S -0.00280 -0.00000 -0.00001 0.00012 -0.00000 154 2S -0.01023 -0.00007 -0.00031 0.00089 -0.00002 155 12 H 1S 0.00016 -0.00000 -0.00000 0.00000 -0.00000 156 2S 0.00142 -0.00000 -0.00001 0.00000 -0.00000 157 13 H 1S -0.00000 0.00000 0.00000 -0.00000 0.00000 158 2S 0.00002 0.00000 0.00000 -0.00000 0.00000 159 14 H 1S 0.00025 -0.00000 -0.00000 -0.00000 -0.00000 160 2S 0.00230 -0.00000 -0.00001 0.00000 -0.00000 161 15 H 1S -0.00423 -0.00000 -0.00000 0.00009 -0.00000 162 2S -0.01258 -0.00000 -0.00006 0.00041 -0.00000 163 16 C 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 164 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 165 2PX 0.00000 -0.00000 0.00000 0.00000 -0.00000 166 2PY -0.00000 0.00000 0.00000 -0.00000 -0.00000 167 2PZ 0.00003 -0.00000 0.00000 0.00000 -0.00000 168 3S 0.00000 -0.00001 -0.00000 0.00001 -0.00000 169 3PX 0.00000 -0.00001 -0.00000 0.00001 -0.00000 170 3PY -0.00000 0.00000 0.00000 -0.00000 -0.00000 171 3PZ 0.00020 0.00000 -0.00000 -0.00000 -0.00000 172 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 173 4YY 0.00000 -0.00000 0.00000 -0.00000 0.00000 174 4ZZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 175 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 176 4XZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 177 4YZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 178 17 C 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 179 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 180 2PX -0.00000 0.00000 -0.00000 -0.00000 0.00000 181 2PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 182 2PZ -0.00002 -0.00000 0.00000 -0.00000 -0.00000 183 3S -0.00003 0.00001 -0.00000 -0.00000 0.00000 184 3PX -0.00008 0.00002 -0.00001 -0.00001 0.00000 185 3PY 0.00003 -0.00000 0.00000 0.00000 -0.00000 186 3PZ -0.00020 -0.00000 0.00000 -0.00000 0.00000 187 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 188 4YY 0.00000 -0.00000 0.00000 0.00000 0.00000 189 4ZZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 190 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 191 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 192 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 193 18 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 194 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 195 2PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 196 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 197 2PZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 198 3S 0.00000 -0.00000 0.00000 0.00000 0.00000 199 3PX 0.00000 -0.00000 0.00000 0.00000 0.00000 200 3PY -0.00001 0.00000 0.00000 -0.00000 -0.00000 201 3PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 202 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 203 4YY -0.00000 -0.00000 0.00000 0.00000 -0.00000 204 4ZZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 205 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 206 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 207 4YZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 208 19 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 209 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 210 2PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 211 2PY -0.00000 0.00000 0.00000 -0.00000 -0.00000 212 2PZ -0.00000 -0.00000 0.00000 0.00000 0.00000 213 3S 0.00000 0.00000 -0.00000 -0.00000 0.00000 214 3PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 215 3PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 216 3PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 217 4XX -0.00000 -0.00000 0.00000 0.00000 -0.00000 218 4YY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 219 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 220 4XY -0.00000 -0.00000 0.00000 0.00000 -0.00000 221 4XZ -0.00000 -0.00000 0.00000 0.00000 0.00000 222 4YZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 223 20 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 224 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 225 2PX 0.00000 -0.00000 0.00000 0.00000 -0.00000 226 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 227 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 228 3S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 229 3PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 230 3PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 231 3PZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 232 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 233 4YY 0.00000 -0.00000 -0.00000 0.00000 0.00000 234 4ZZ -0.00000 0.00000 0.00000 -0.00000 0.00000 235 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 236 4XZ 0.00000 -0.00000 0.00000 0.00000 0.00000 237 4YZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 238 21 C 1S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 239 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 240 2PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 241 2PY 0.00000 0.00000 0.00000 -0.00000 0.00000 242 2PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 243 3S -0.00000 0.00000 -0.00000 0.00000 0.00000 244 3PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 245 3PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 246 3PZ 0.00001 0.00000 -0.00000 0.00000 -0.00000 247 4XX 0.00000 -0.00000 0.00000 0.00000 -0.00000 248 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 249 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 250 4XY 0.00000 0.00000 -0.00000 -0.00000 0.00000 251 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 252 4YZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 253 22 H 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 254 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 255 23 H 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 256 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 257 24 H 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 258 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 259 25 H 1S 0.00000 -0.00000 0.00000 0.00000 -0.00000 260 2S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 261 26 H 1S -0.00003 0.00000 -0.00000 -0.00000 0.00000 262 2S 0.00017 0.00002 -0.00000 -0.00002 0.00003 263 27 H 1S 0.00001 -0.00000 0.00000 -0.00000 -0.00000 264 2S 0.00003 -0.00001 0.00000 -0.00000 0.00000 76 77 78 79 80 76 4XZ 0.00093 77 4YZ 0.00000 0.00120 78 6 C 1S -0.00002 -0.00003 2.05365 79 2S 0.00025 0.00039 -0.01362 0.32637 80 2PX 0.00148 0.00006 0.00000 0.00000 0.35606 81 2PY 0.00003 0.00128 0.00000 0.00000 0.00000 82 2PZ 0.00045 0.00082 0.00000 0.00000 0.00000 83 3S 0.00006 0.00011 -0.03390 0.22263 0.00000 84 3PX 0.00102 0.00004 0.00000 0.00000 0.11473 85 3PY 0.00003 0.00054 0.00000 0.00000 -0.00000 86 3PZ 0.00002 0.00005 0.00000 0.00000 0.00000 87 4XX -0.00001 -0.00001 -0.00100 -0.00857 0.00000 88 4YY -0.00001 -0.00000 -0.00130 -0.00310 0.00000 89 4ZZ -0.00003 -0.00007 -0.00145 -0.00062 0.00000 90 4XY -0.00002 -0.00000 -0.00000 0.00000 0.00000 91 4XZ -0.00005 0.00002 0.00000 -0.00000 0.00000 92 4YZ 0.00001 -0.00011 -0.00000 0.00000 0.00000 93 7 C 1S -0.00000 -0.00000 0.00000 -0.00053 -0.00073 94 2S 0.00001 0.00002 -0.00054 0.01096 0.01087 95 2PX -0.00001 0.00005 -0.00071 0.01105 -0.00053 96 2PY 0.00006 0.00003 -0.00193 0.02991 0.04041 97 2PZ 0.00001 0.00002 -0.00017 0.00229 0.00243 98 3S 0.00004 0.00011 0.00055 0.00629 0.00875 99 3PX 0.00001 0.00017 -0.00026 0.00471 0.00977 100 3PY 0.00018 0.00000 -0.00098 0.01430 0.01677 101 3PZ 0.00003 0.00004 0.00007 0.00158 0.00093 102 4XX -0.00000 0.00000 -0.00000 -0.00003 -0.00029 103 4YY 0.00000 -0.00000 -0.00012 0.00162 0.00185 104 4ZZ -0.00000 -0.00000 0.00001 -0.00062 -0.00037 105 4XY -0.00000 0.00000 -0.00012 0.00128 -0.00007 106 4XZ 0.00000 0.00000 -0.00001 0.00012 -0.00000 107 4YZ 0.00000 0.00000 -0.00003 0.00035 0.00043 108 8 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 109 2S -0.00000 -0.00000 0.00000 -0.00009 -0.00009 110 2PX -0.00000 -0.00000 0.00000 -0.00008 -0.00002 111 2PY -0.00000 -0.00000 0.00000 -0.00025 -0.00022 112 2PZ 0.00000 0.00000 0.00000 -0.00005 -0.00003 113 3S -0.00000 -0.00000 -0.00005 -0.00024 -0.00073 114 3PX -0.00000 -0.00000 -0.00002 -0.00009 0.00010 115 3PY 0.00000 -0.00000 -0.00007 -0.00063 -0.00103 116 3PZ -0.00001 -0.00001 0.00004 -0.00067 -0.00059 117 4XX -0.00000 0.00000 -0.00000 0.00000 -0.00000 118 4YY 0.00000 0.00000 -0.00000 0.00002 0.00007 119 4ZZ -0.00000 -0.00000 0.00000 -0.00000 -0.00001 120 4XY -0.00000 0.00000 -0.00000 0.00001 0.00000 121 4XZ 0.00000 -0.00000 -0.00000 0.00000 -0.00001 122 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00002 123 9 C 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 124 2S 0.00000 0.00000 0.00000 -0.00001 -0.00000 125 2PX -0.00001 0.00002 0.00000 -0.00000 0.00002 126 2PY 0.00002 -0.00001 0.00000 -0.00001 -0.00005 127 2PZ -0.00000 0.00000 0.00000 -0.00002 -0.00001 128 3S 0.00001 0.00000 0.00005 -0.00086 -0.00020 129 3PX -0.00002 0.00008 0.00001 -0.00010 -0.00022 130 3PY 0.00009 -0.00006 0.00004 -0.00053 -0.00093 131 3PZ -0.00001 -0.00002 0.00006 -0.00069 -0.00024 132 4XX -0.00000 0.00000 -0.00000 0.00000 0.00000 133 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 134 4ZZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 135 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 136 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 137 4YZ -0.00000 0.00000 0.00000 -0.00000 0.00000 138 10 C 1S -0.00005 -0.00015 -0.00000 0.00000 -0.00000 139 2S 0.00054 0.00166 0.00000 -0.00009 0.00000 140 2PX 0.00032 0.00079 0.00000 -0.00000 -0.00004 141 2PY 0.00084 0.00024 0.00000 -0.00003 -0.00001 142 2PZ 0.00028 0.00090 0.00000 -0.00032 0.00000 143 3S 0.00022 0.00076 -0.00003 -0.00060 -0.00007 144 3PX 0.00045 0.00020 0.00001 -0.00012 -0.00091 145 3PY 0.00022 -0.00001 0.00004 -0.00056 -0.00008 146 3PZ 0.00000 0.00000 -0.00009 -0.00078 -0.00019 147 4XX -0.00000 -0.00007 0.00000 -0.00000 0.00000 148 4YY -0.00005 -0.00001 0.00000 -0.00000 0.00000 149 4ZZ -0.00000 -0.00001 -0.00000 0.00004 -0.00000 150 4XY -0.00001 0.00000 0.00000 -0.00000 0.00000 151 4XZ -0.00000 0.00001 0.00000 -0.00000 0.00001 152 4YZ 0.00001 0.00002 -0.00000 -0.00000 0.00000 153 11 H 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 154 2S -0.00002 -0.00005 -0.00000 0.00012 -0.00000 155 12 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 156 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 157 13 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 158 2S 0.00000 0.00000 -0.00000 0.00013 0.00013 159 14 H 1S -0.00000 -0.00000 0.00000 -0.00021 -0.00013 160 2S -0.00000 -0.00000 0.00023 -0.00318 -0.00158 161 15 H 1S 0.00000 0.00002 -0.00205 0.03186 0.01012 162 2S 0.00002 0.00011 -0.00117 0.01053 0.00644 163 16 C 1S -0.00000 0.00000 0.00000 -0.00000 -0.00000 164 2S 0.00000 -0.00000 -0.00000 0.00000 0.00000 165 2PX 0.00000 -0.00000 -0.00000 0.00000 0.00000 166 2PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 167 2PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 168 3S 0.00000 -0.00000 -0.00000 0.00002 -0.00002 169 3PX 0.00000 -0.00000 -0.00000 0.00003 0.00003 170 3PY 0.00000 -0.00000 -0.00000 0.00000 -0.00001 171 3PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00001 172 4XX -0.00000 0.00000 0.00000 -0.00000 -0.00000 173 4YY 0.00000 0.00000 -0.00000 -0.00000 0.00000 174 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 175 4XY -0.00000 0.00000 0.00000 -0.00000 -0.00000 176 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 177 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 178 17 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 179 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 180 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00001 181 2PY 0.00000 0.00000 -0.00000 0.00000 0.00000 182 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 183 3S -0.00000 -0.00000 0.00000 -0.00003 -0.00028 184 3PX -0.00001 -0.00000 -0.00000 -0.00008 -0.00055 185 3PY 0.00000 -0.00000 0.00000 -0.00002 0.00012 186 3PZ 0.00000 0.00000 -0.00000 0.00001 -0.00002 187 4XX 0.00000 0.00000 0.00000 -0.00000 -0.00000 188 4YY -0.00000 0.00000 0.00000 -0.00000 -0.00000 189 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 190 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 191 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 192 4YZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 193 18 C 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 194 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 195 2PX -0.00000 -0.00000 -0.00000 0.00000 0.00000 196 2PY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 197 2PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 198 3S -0.00000 0.00000 -0.00000 0.00000 0.00000 199 3PX -0.00000 0.00000 0.00000 -0.00000 0.00001 200 3PY -0.00000 -0.00000 -0.00000 0.00000 0.00000 201 3PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 202 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 203 4YY -0.00000 0.00000 -0.00000 0.00000 0.00000 204 4ZZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 205 4XY -0.00000 0.00000 -0.00000 0.00000 0.00000 206 4XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 207 4YZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 210 2PX 0.00000 0.00000 0.00000 -0.00000 -0.00000 211 2PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 212 2PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 213 3S -0.00000 0.00000 0.00000 -0.00000 -0.00000 214 3PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 215 3PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 216 3PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 219 4ZZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 220 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 222 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 224 2S -0.00000 -0.00000 0.00000 -0.00000 0.00000 225 2PX -0.00000 -0.00000 0.00000 -0.00000 0.00000 226 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 227 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 228 3S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 229 3PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 230 3PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 231 3PZ -0.00000 0.00000 0.00000 0.00000 0.00000 232 4XX -0.00000 0.00000 0.00000 -0.00000 -0.00000 233 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 234 4ZZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 235 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 236 4XZ -0.00000 -0.00000 0.00000 0.00000 0.00000 237 4YZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 238 21 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 239 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 240 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 241 2PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 242 2PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 243 3S 0.00000 -0.00000 0.00000 0.00000 -0.00000 244 3PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 245 3PY 0.00000 0.00000 0.00000 0.00000 0.00000 246 3PZ -0.00000 -0.00000 0.00000 0.00000 0.00000 247 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 248 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 249 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 250 4XY -0.00000 -0.00000 0.00000 0.00000 -0.00000 251 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 252 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 253 22 H 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 254 2S -0.00000 0.00000 0.00000 0.00000 0.00000 255 23 H 1S -0.00000 0.00000 0.00000 -0.00000 -0.00000 256 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 257 24 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 258 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 259 25 H 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 260 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 261 26 H 1S 0.00000 0.00000 0.00000 -0.00001 -0.00002 262 2S 0.00003 0.00001 0.00007 -0.00056 0.00186 263 27 H 1S -0.00000 0.00000 0.00000 -0.00000 0.00000 264 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 81 82 83 84 85 81 2PY 0.40518 82 2PZ 0.00000 0.41810 83 3S 0.00000 0.00000 0.27962 84 3PX -0.00000 -0.00000 0.00000 0.12915 85 3PY 0.08818 0.00000 0.00000 -0.00000 0.07515 86 3PZ -0.00000 0.08261 0.00000 0.00000 0.00000 87 4XX 0.00000 0.00000 -0.00593 0.00000 0.00000 88 4YY 0.00000 0.00000 -0.00247 0.00000 0.00000 89 4ZZ 0.00000 0.00000 0.00112 0.00000 0.00000 90 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 91 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 92 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 93 7 C 1S -0.00191 -0.00015 0.00050 -0.00032 -0.00085 94 2S 0.02849 0.00232 0.00533 0.00530 0.01379 95 2PX 0.04026 0.00253 0.00575 0.00989 0.01620 96 2PY 0.02977 0.00487 0.01609 0.01816 0.00150 97 2PZ 0.00483 -0.00010 0.00406 0.00050 0.00053 98 3S 0.02478 0.00101 -0.01576 0.00362 0.01147 99 3PX 0.01760 0.00135 0.00047 0.02505 0.01231 100 3PY 0.00140 0.00241 0.00442 0.01305 0.00090 101 3PZ 0.00101 0.00206 0.00294 0.00053 -0.00013 102 4XX 0.00041 0.00005 0.00046 -0.00091 0.00111 103 4YY -0.00092 0.00043 0.00232 0.00158 -0.00098 104 4ZZ -0.00097 0.00006 -0.00201 -0.00031 -0.00086 105 4XY 0.00141 0.00028 0.00049 0.00018 0.00008 106 4XZ 0.00043 0.00032 0.00001 0.00000 0.00006 107 4YZ 0.00054 0.00083 0.00006 0.00007 0.00002 108 8 C 1S 0.00000 0.00000 -0.00005 0.00002 0.00003 109 2S -0.00027 -0.00001 -0.00040 -0.00066 -0.00172 110 2PX -0.00023 -0.00001 -0.00126 0.00003 -0.00258 111 2PY -0.00047 -0.00000 -0.00224 -0.00233 -0.00230 112 2PZ -0.00011 0.00000 0.00084 0.00002 0.00012 113 3S -0.00224 -0.00067 0.00262 -0.00166 -0.00424 114 3PX -0.00109 -0.00014 -0.00179 -0.00036 -0.00436 115 3PY -0.00058 -0.00036 -0.00158 -0.00365 -0.00051 116 3PZ -0.00161 0.00036 0.00061 -0.00048 -0.00100 117 4XX 0.00003 -0.00000 0.00005 -0.00005 0.00022 118 4YY 0.00006 -0.00000 0.00026 0.00037 0.00022 119 4ZZ -0.00001 0.00000 -0.00016 -0.00009 -0.00015 120 4XY 0.00007 -0.00000 0.00008 -0.00000 0.00015 121 4XZ 0.00002 -0.00000 0.00001 -0.00002 0.00008 122 4YZ -0.00001 0.00000 0.00002 0.00008 -0.00005 123 9 C 1S 0.00000 0.00000 0.00005 0.00002 0.00005 124 2S -0.00001 -0.00002 -0.00088 -0.00020 -0.00069 125 2PX -0.00005 -0.00001 -0.00025 -0.00023 -0.00108 126 2PY 0.00005 -0.00006 -0.00039 -0.00111 0.00061 127 2PZ -0.00005 0.00000 -0.00141 -0.00016 -0.00081 128 3S -0.00047 -0.00095 -0.00580 -0.00100 -0.00224 129 3PX -0.00089 -0.00014 -0.00096 -0.00280 -0.00336 130 3PY 0.00087 -0.00100 -0.00127 -0.00360 0.00151 131 3PZ -0.00083 0.00028 -0.00363 -0.00020 -0.00107 132 4XX 0.00000 -0.00000 0.00002 0.00001 0.00002 133 4YY 0.00000 -0.00000 0.00003 0.00001 0.00005 134 4ZZ -0.00000 0.00000 0.00002 -0.00002 -0.00006 135 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00001 136 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 137 4YZ -0.00000 -0.00000 0.00000 0.00001 0.00001 138 10 C 1S 0.00000 0.00000 -0.00003 -0.00001 -0.00004 139 2S -0.00001 -0.00035 -0.00067 0.00008 0.00030 140 2PX -0.00001 -0.00001 -0.00002 -0.00125 -0.00002 141 2PY -0.00000 -0.00009 0.00010 -0.00003 -0.00060 142 2PZ -0.00001 -0.00088 -0.00387 0.00034 0.00114 143 3S -0.00054 -0.00320 0.00054 0.00019 -0.00007 144 3PX -0.00007 -0.00040 -0.00039 -0.00456 -0.00016 145 3PY -0.00017 -0.00185 -0.00080 -0.00022 -0.00130 146 3PZ -0.00104 -0.00065 -0.00328 0.00026 0.00021 147 4XX 0.00000 -0.00000 -0.00002 -0.00003 0.00006 148 4YY -0.00000 -0.00001 -0.00011 0.00005 -0.00005 149 4ZZ -0.00001 0.00022 0.00040 -0.00002 -0.00001 150 4XY -0.00000 -0.00000 -0.00000 0.00002 -0.00000 151 4XZ 0.00000 0.00000 -0.00000 0.00006 0.00001 152 4YZ 0.00000 0.00001 0.00001 0.00001 -0.00002 153 11 H 1S -0.00000 0.00000 0.00009 -0.00000 -0.00001 154 2S -0.00001 0.00052 0.00121 -0.00001 -0.00010 155 12 H 1S 0.00000 0.00000 0.00001 0.00000 0.00001 156 2S 0.00000 0.00000 0.00027 0.00003 0.00015 157 13 H 1S 0.00000 -0.00000 0.00010 0.00008 0.00020 158 2S 0.00035 -0.00001 0.00116 0.00076 0.00197 159 14 H 1S -0.00030 -0.00029 -0.00400 -0.00030 -0.00076 160 2S -0.00370 -0.00387 -0.01221 -0.00127 -0.00325 161 15 H 1S 0.03810 0.05208 0.04649 0.00579 0.01961 162 2S 0.02134 0.02894 0.02921 0.00551 0.01487 163 16 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 164 2S -0.00000 0.00000 0.00000 0.00001 0.00000 165 2PX 0.00000 0.00000 0.00001 0.00002 -0.00000 166 2PY -0.00000 -0.00000 -0.00000 -0.00001 0.00000 167 2PZ -0.00000 0.00000 -0.00000 0.00001 -0.00000 168 3S 0.00001 0.00001 0.00022 -0.00019 0.00008 169 3PX 0.00001 0.00002 0.00026 0.00008 0.00003 170 3PY 0.00000 -0.00001 -0.00001 -0.00005 0.00000 171 3PZ -0.00000 0.00000 -0.00002 0.00003 -0.00001 172 4XX 0.00000 0.00000 0.00000 -0.00001 0.00000 173 4YY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 174 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 175 4XY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 176 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 177 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 178 17 C 1S 0.00000 0.00000 -0.00000 0.00001 -0.00000 179 2S -0.00000 -0.00000 0.00001 -0.00019 0.00000 180 2PX -0.00000 -0.00000 -0.00005 -0.00058 -0.00003 181 2PY -0.00000 0.00000 0.00000 0.00004 -0.00001 182 2PZ -0.00000 -0.00000 0.00001 0.00003 0.00000 183 3S -0.00002 -0.00001 0.00002 -0.00239 -0.00011 184 3PX -0.00005 -0.00002 0.00000 -0.00240 -0.00020 185 3PY -0.00003 0.00000 -0.00003 0.00065 -0.00031 186 3PZ -0.00000 0.00000 0.00015 0.00012 0.00000 187 4XX -0.00000 -0.00000 -0.00000 -0.00002 -0.00000 188 4YY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 189 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 190 4XY -0.00000 0.00000 0.00000 0.00001 -0.00000 191 4XZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 192 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 193 18 C 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 194 2S 0.00000 0.00000 0.00000 0.00000 0.00000 195 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 196 2PY 0.00000 0.00000 0.00000 0.00000 0.00000 197 2PZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 198 3S 0.00000 0.00000 0.00000 0.00009 0.00001 199 3PX 0.00000 0.00000 0.00000 0.00014 0.00002 200 3PY -0.00000 0.00000 0.00001 0.00002 -0.00000 201 3PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 202 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 203 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 204 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 205 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 206 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 207 4YZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 210 2PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 211 2PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 212 2PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 213 3S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 214 3PX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 215 3PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 216 3PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 219 4ZZ 0.00000 -0.00000 0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 221 4XZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 222 4YZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 223 20 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 224 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 225 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 226 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 227 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 228 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 229 3PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 230 3PY -0.00000 0.00000 0.00000 0.00000 -0.00000 231 3PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 232 4XX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 233 4YY 0.00000 0.00000 -0.00000 0.00000 -0.00000 234 4ZZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 235 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 236 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 237 4YZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 238 21 C 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 239 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 240 2PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 241 2PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 242 2PZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 243 3S 0.00000 0.00000 0.00000 -0.00001 0.00000 244 3PX -0.00000 -0.00000 -0.00000 -0.00001 0.00000 245 3PY 0.00000 0.00000 0.00000 0.00000 0.00000 246 3PZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 247 4XX -0.00000 -0.00000 -0.00000 0.00000 0.00000 248 4YY -0.00000 0.00000 0.00000 0.00000 -0.00000 249 4ZZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 250 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 251 4XZ -0.00000 0.00000 0.00000 0.00000 -0.00000 252 4YZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 253 22 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 254 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 255 23 H 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 256 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 0.00000 0.00000 0.00000 259 25 H 1S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 260 2S 0.00000 0.00000 -0.00000 0.00001 0.00000 261 26 H 1S -0.00000 -0.00000 0.00003 -0.00062 0.00009 262 2S 0.00047 0.00001 -0.00107 0.00513 0.00155 263 27 H 1S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 264 2S -0.00000 -0.00000 -0.00003 0.00005 -0.00004 86 87 88 89 90 86 3PZ 0.06293 87 4XX 0.00000 0.00093 88 4YY 0.00000 0.00005 0.00099 89 4ZZ 0.00000 -0.00003 -0.00012 0.00115 90 4XY 0.00000 -0.00000 0.00000 -0.00000 0.00055 91 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 92 4YZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 93 7 C 1S -0.00019 -0.00000 -0.00011 0.00001 -0.00012 94 2S 0.00075 -0.00003 0.00155 -0.00061 0.00126 95 2PX 0.00179 -0.00027 0.00192 -0.00042 -0.00009 96 2PY 0.00432 0.00039 -0.00086 -0.00114 0.00127 97 2PZ 0.00472 0.00001 0.00048 0.00007 0.00038 98 3S -0.00032 0.00022 0.00190 -0.00156 0.00039 99 3PX 0.00113 -0.00081 0.00168 -0.00042 0.00018 100 3PY 0.00240 0.00108 -0.00074 -0.00122 0.00008 101 3PZ 0.00436 -0.00000 0.00008 -0.00014 0.00003 102 4XX 0.00005 0.00000 -0.00005 0.00001 -0.00001 103 4YY 0.00031 -0.00006 -0.00000 -0.00001 0.00003 104 4ZZ -0.00019 0.00001 -0.00003 0.00003 -0.00003 105 4XY 0.00004 -0.00001 0.00002 -0.00003 0.00002 106 4XZ 0.00006 -0.00000 0.00000 -0.00000 -0.00001 107 4YZ 0.00018 -0.00000 -0.00005 -0.00000 -0.00000 108 8 C 1S -0.00005 -0.00000 -0.00000 0.00000 -0.00000 109 2S 0.00043 0.00000 0.00001 -0.00000 0.00001 110 2PX 0.00021 -0.00001 0.00007 -0.00000 -0.00001 111 2PY 0.00140 0.00003 0.00001 -0.00001 0.00006 112 2PZ -0.00046 0.00000 0.00002 -0.00000 0.00001 113 3S -0.00018 0.00002 0.00013 -0.00006 0.00004 114 3PX -0.00019 -0.00018 0.00049 0.00000 -0.00002 115 3PY 0.00099 0.00033 -0.00016 -0.00008 0.00015 116 3PZ -0.00021 0.00000 0.00007 0.00002 0.00001 117 4XX -0.00003 -0.00000 0.00000 -0.00000 -0.00000 118 4YY -0.00005 0.00000 -0.00000 -0.00000 0.00000 119 4ZZ 0.00001 0.00000 -0.00000 0.00000 -0.00000 120 4XY -0.00002 -0.00000 0.00000 -0.00000 0.00000 121 4XZ -0.00001 -0.00000 0.00000 -0.00000 0.00000 122 4YZ -0.00003 0.00000 0.00000 -0.00000 0.00000 123 9 C 1S 0.00005 -0.00000 -0.00000 -0.00000 0.00000 124 2S -0.00079 0.00000 -0.00000 0.00000 -0.00000 125 2PX -0.00036 -0.00000 0.00000 -0.00000 0.00000 126 2PY -0.00068 0.00000 0.00000 -0.00000 0.00000 127 2PZ -0.00027 -0.00000 -0.00000 0.00000 -0.00000 128 3S -0.00301 0.00002 0.00003 0.00000 -0.00000 129 3PX -0.00068 0.00000 0.00003 -0.00002 -0.00000 130 3PY -0.00090 0.00003 0.00004 -0.00008 0.00001 131 3PZ 0.00004 -0.00001 -0.00004 0.00008 -0.00002 132 4XX -0.00000 0.00000 -0.00000 0.00000 0.00000 133 4YY -0.00005 -0.00000 0.00000 0.00000 -0.00000 134 4ZZ 0.00009 0.00000 0.00000 -0.00000 0.00000 135 4XY -0.00001 0.00000 -0.00000 0.00000 0.00000 136 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 137 4YZ 0.00003 0.00000 -0.00000 0.00000 0.00000 138 10 C 1S 0.00004 0.00000 0.00000 -0.00000 0.00000 139 2S -0.00219 -0.00000 -0.00000 0.00002 -0.00000 140 2PX 0.00006 -0.00000 -0.00000 0.00000 -0.00000 141 2PY 0.00015 -0.00000 0.00000 0.00002 0.00000 142 2PZ -0.00513 -0.00000 -0.00001 0.00013 -0.00000 143 3S -0.00534 -0.00003 -0.00006 0.00027 -0.00000 144 3PX -0.00023 0.00002 -0.00002 -0.00001 -0.00001 145 3PY -0.00118 -0.00004 0.00004 0.00003 0.00000 146 3PZ -0.00209 -0.00005 -0.00019 0.00061 -0.00000 147 4XX -0.00006 0.00000 0.00000 -0.00000 -0.00000 148 4YY -0.00025 -0.00000 0.00000 -0.00000 -0.00000 149 4ZZ 0.00091 -0.00000 -0.00000 0.00000 -0.00000 150 4XY -0.00001 -0.00000 -0.00000 -0.00000 0.00000 151 4XZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 152 4YZ 0.00000 -0.00000 0.00000 0.00000 0.00000 153 11 H 1S 0.00025 -0.00000 -0.00000 -0.00000 0.00000 154 2S 0.00295 -0.00000 -0.00000 -0.00001 -0.00000 155 12 H 1S 0.00001 0.00000 0.00000 0.00000 0.00000 156 2S 0.00026 -0.00000 0.00000 0.00000 0.00000 157 13 H 1S -0.00002 -0.00000 -0.00000 -0.00000 -0.00000 158 2S -0.00017 -0.00000 -0.00001 -0.00000 -0.00000 159 14 H 1S -0.00059 0.00000 -0.00001 0.00003 -0.00001 160 2S -0.00342 0.00000 -0.00029 0.00052 -0.00007 161 15 H 1S 0.02253 -0.00066 0.00023 0.00088 0.00049 162 2S 0.01563 -0.00047 0.00057 0.00111 0.00005 163 16 C 1S -0.00000 0.00000 0.00000 -0.00000 0.00000 164 2S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 165 2PX 0.00001 -0.00000 -0.00000 0.00000 0.00000 166 2PY -0.00000 -0.00000 0.00000 0.00000 0.00000 167 2PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 168 3S 0.00011 -0.00000 -0.00000 0.00000 -0.00000 169 3PX 0.00016 -0.00001 0.00000 0.00000 -0.00000 170 3PY -0.00005 -0.00000 0.00000 0.00000 -0.00000 171 3PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 172 4XX 0.00000 0.00000 -0.00000 0.00000 -0.00000 173 4YY -0.00000 -0.00000 0.00000 -0.00000 0.00000 174 4ZZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 175 4XY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 176 4XZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 177 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 178 17 C 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 179 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 180 2PX -0.00001 0.00000 -0.00000 -0.00000 0.00000 181 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 182 2PZ -0.00001 0.00000 -0.00000 -0.00000 0.00000 183 3S -0.00002 0.00000 -0.00000 -0.00000 0.00000 184 3PX -0.00004 0.00004 -0.00001 -0.00001 -0.00000 185 3PY 0.00003 0.00000 -0.00000 -0.00000 -0.00000 186 3PZ -0.00009 -0.00000 -0.00000 -0.00000 -0.00000 187 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 188 4YY 0.00000 -0.00000 0.00000 0.00000 -0.00000 189 4ZZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 190 4XY -0.00000 -0.00000 -0.00000 0.00000 0.00000 191 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 192 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 193 18 C 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 194 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 195 2PX 0.00000 -0.00000 0.00000 0.00000 -0.00000 196 2PY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 197 2PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 198 3S 0.00000 0.00000 -0.00000 0.00000 -0.00000 199 3PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 200 3PY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 201 3PZ -0.00001 -0.00000 -0.00000 -0.00000 0.00000 202 4XX 0.00000 0.00000 -0.00000 -0.00000 0.00000 203 4YY 0.00000 -0.00000 0.00000 0.00000 -0.00000 204 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 205 4XY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 206 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 207 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 210 2PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 211 2PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 212 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 213 3S -0.00000 -0.00000 0.00000 -0.00000 0.00000 214 3PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 215 3PY -0.00000 -0.00000 0.00000 0.00000 0.00000 216 3PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 217 4XX 0.00000 -0.00000 0.00000 0.00000 -0.00000 218 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 219 4ZZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 220 4XY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 221 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 222 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 223 20 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 224 2S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 225 2PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 226 2PY 0.00000 0.00000 0.00000 -0.00000 -0.00000 227 2PZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 228 3S -0.00000 0.00000 0.00000 -0.00000 0.00000 229 3PX -0.00000 0.00000 0.00000 -0.00000 0.00000 230 3PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 231 3PZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 232 4XX -0.00000 0.00000 0.00000 -0.00000 -0.00000 233 4YY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 234 4ZZ 0.00000 -0.00000 0.00000 0.00000 0.00000 235 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 236 4XZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 237 4YZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 240 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 241 2PY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 242 2PZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 243 3S -0.00000 -0.00000 0.00000 0.00000 -0.00000 244 3PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 245 3PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 246 3PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 247 4XX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 248 4YY 0.00000 -0.00000 0.00000 0.00000 0.00000 249 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 250 4XY -0.00000 -0.00000 0.00000 0.00000 -0.00000 251 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 252 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 253 22 H 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 254 2S 0.00000 -0.00000 0.00000 0.00000 0.00000 255 23 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 256 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 257 24 H 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 258 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 259 25 H 1S 0.00000 -0.00000 0.00000 0.00000 -0.00000 260 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 261 26 H 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 262 2S 0.00006 -0.00000 0.00002 -0.00002 0.00003 263 27 H 1S -0.00000 0.00000 0.00000 -0.00000 0.00000 264 2S -0.00004 0.00000 0.00000 -0.00000 0.00000 91 92 93 94 95 91 4XZ 0.00079 92 4YZ 0.00000 0.00141 93 7 C 1S -0.00001 -0.00003 2.05290 94 2S 0.00011 0.00032 -0.01393 0.32962 95 2PX -0.00001 0.00030 0.00000 0.00000 0.34945 96 2PY 0.00026 0.00030 0.00000 0.00000 0.00000 97 2PZ 0.00035 0.00091 0.00000 0.00000 0.00000 98 3S 0.00007 0.00020 -0.03152 0.21445 0.00000 99 3PX 0.00003 0.00006 0.00000 0.00000 0.11084 100 3PY 0.00005 0.00000 0.00000 0.00000 -0.00000 101 3PZ 0.00012 0.00032 0.00000 0.00000 0.00000 102 4XX 0.00000 -0.00003 -0.00101 -0.00900 0.00000 103 4YY -0.00005 -0.00003 -0.00120 -0.00509 0.00000 104 4ZZ -0.00001 -0.00001 -0.00161 0.00190 0.00000 105 4XY 0.00000 -0.00002 -0.00000 0.00000 0.00000 106 4XZ -0.00000 -0.00005 -0.00000 0.00000 0.00000 107 4YZ -0.00005 -0.00008 0.00000 -0.00000 0.00000 108 8 C 1S -0.00000 -0.00000 0.00000 -0.00051 -0.00030 109 2S 0.00000 0.00001 -0.00052 0.01056 0.00461 110 2PX 0.00001 -0.00000 -0.00031 0.00450 0.00660 111 2PY 0.00000 0.00004 -0.00103 0.01535 0.01285 112 2PZ 0.00000 0.00000 -0.00141 0.02206 0.00727 113 3S 0.00002 0.00007 0.00039 0.00626 0.00289 114 3PX 0.00001 -0.00004 -0.00009 0.00251 0.01680 115 3PY -0.00002 0.00010 -0.00031 0.00834 0.00624 116 3PZ -0.00002 -0.00005 -0.00076 0.00826 0.00303 117 4XX -0.00000 -0.00000 0.00001 -0.00031 0.00003 118 4YY -0.00000 -0.00000 -0.00001 0.00012 0.00014 119 4ZZ -0.00000 -0.00000 -0.00005 0.00050 0.00031 120 4XY 0.00000 -0.00000 -0.00002 0.00023 0.00026 121 4XZ 0.00000 0.00000 -0.00004 0.00051 0.00027 122 4YZ 0.00000 0.00000 -0.00015 0.00170 0.00073 123 9 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 124 2S -0.00000 -0.00000 0.00000 -0.00009 -0.00001 125 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00001 126 2PY -0.00000 -0.00000 0.00000 -0.00001 -0.00000 127 2PZ -0.00000 -0.00000 0.00000 -0.00037 -0.00002 128 3S -0.00000 -0.00001 -0.00004 -0.00031 0.00003 129 3PX -0.00000 -0.00000 -0.00001 0.00009 -0.00044 130 3PY 0.00000 0.00001 -0.00004 0.00034 -0.00003 131 3PZ -0.00000 -0.00000 0.00004 -0.00209 0.00007 132 4XX -0.00000 0.00000 0.00000 -0.00000 -0.00000 133 4YY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 134 4ZZ 0.00000 0.00000 -0.00000 0.00003 0.00000 135 4XY -0.00000 0.00000 0.00000 -0.00000 -0.00000 136 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00001 137 4YZ 0.00000 0.00000 -0.00000 0.00001 0.00000 138 10 C 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 139 2S 0.00000 0.00001 0.00000 -0.00001 0.00000 140 2PX 0.00001 0.00000 0.00000 -0.00000 -0.00002 141 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00001 142 2PZ 0.00001 0.00004 0.00000 -0.00003 -0.00001 143 3S 0.00001 0.00006 0.00005 -0.00090 -0.00004 144 3PX 0.00012 0.00002 0.00000 -0.00007 -0.00093 145 3PY 0.00002 -0.00001 0.00001 -0.00012 -0.00018 146 3PZ 0.00001 0.00010 0.00011 -0.00158 -0.00031 147 4XX 0.00000 0.00000 -0.00000 0.00000 -0.00000 148 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 149 4ZZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 150 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 151 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 152 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 153 11 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 154 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 155 12 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 156 2S 0.00000 0.00000 -0.00000 0.00013 0.00002 157 13 H 1S -0.00000 -0.00000 0.00000 -0.00019 -0.00016 158 2S -0.00000 -0.00000 0.00021 -0.00290 -0.00212 159 14 H 1S 0.00003 0.00007 -0.00205 0.03222 0.00325 160 2S 0.00010 0.00024 -0.00127 0.01267 0.00187 161 15 H 1S 0.00101 0.00353 0.00000 -0.00019 -0.00018 162 2S 0.00020 0.00071 0.00020 -0.00284 -0.00230 163 16 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 164 2S -0.00000 -0.00000 0.00000 -0.00000 0.00000 165 2PX -0.00000 -0.00000 0.00000 -0.00000 0.00000 166 2PY -0.00000 0.00000 -0.00000 0.00000 0.00000 167 2PZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 168 3S -0.00000 -0.00000 -0.00000 0.00000 0.00000 169 3PX -0.00000 0.00000 0.00000 -0.00000 0.00000 170 3PY -0.00000 -0.00000 -0.00000 0.00000 0.00000 171 3PZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 172 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 173 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 174 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 175 4XY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 176 4XZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 177 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 178 17 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 179 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 180 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 181 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 182 2PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 183 3S -0.00000 -0.00000 0.00000 -0.00000 -0.00001 184 3PX -0.00000 0.00000 -0.00000 0.00001 -0.00009 185 3PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 186 3PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 187 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 188 4YY -0.00000 0.00000 0.00000 -0.00000 0.00000 189 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 190 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 191 4XZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 192 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 193 18 C 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 194 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 195 2PX 0.00000 0.00000 -0.00000 0.00000 0.00000 196 2PY 0.00000 0.00000 0.00000 -0.00000 -0.00000 197 2PZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 198 3S 0.00000 0.00000 -0.00000 0.00000 -0.00000 199 3PX 0.00000 0.00000 0.00000 -0.00000 -0.00000 200 3PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 201 3PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 202 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 203 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 204 4ZZ 0.00000 -0.00000 0.00000 0.00000 0.00000 205 4XY 0.00000 0.00000 -0.00000 0.00000 -0.00000 206 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 207 4YZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 210 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 211 2PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 212 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 213 3S -0.00000 -0.00000 0.00000 -0.00000 0.00000 214 3PX -0.00000 -0.00000 0.00000 -0.00000 0.00000 215 3PY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 216 3PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 217 4XX 0.00000 0.00000 0.00000 -0.00000 0.00000 218 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 219 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 220 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 221 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 222 4YZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 224 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 225 2PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 226 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 227 2PZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 228 3S 0.00000 0.00000 -0.00000 0.00000 -0.00000 229 3PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 230 3PY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 231 3PZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 232 4XX -0.00000 0.00000 0.00000 -0.00000 -0.00000 233 4YY 0.00000 0.00000 0.00000 -0.00000 -0.00000 234 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 235 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 236 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 237 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 240 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 241 2PY -0.00000 0.00000 0.00000 0.00000 0.00000 242 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 243 3S -0.00000 -0.00000 0.00000 -0.00000 0.00000 244 3PX -0.00000 0.00000 -0.00000 0.00000 0.00000 245 3PY -0.00000 0.00000 0.00000 -0.00000 0.00000 246 3PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 247 4XX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 248 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 249 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 250 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 251 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 252 4YZ 0.00000 -0.00000 0.00000 0.00000 0.00000 253 22 H 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 254 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 256 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 259 25 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 260 2S -0.00000 -0.00000 -0.00000 0.00000 0.00000 261 26 H 1S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 262 2S 0.00001 -0.00000 0.00000 -0.00007 0.00051 263 27 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 264 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 96 97 98 99 100 96 2PY 0.39480 97 2PZ 0.00000 0.43031 98 3S 0.00000 0.00000 0.24140 99 3PX -0.00000 -0.00000 0.00000 0.12219 100 3PY 0.08295 -0.00000 0.00000 -0.00000 0.06772 101 3PZ -0.00000 0.07674 0.00000 -0.00000 -0.00000 102 4XX 0.00000 0.00000 -0.00608 0.00000 0.00000 103 4YY 0.00000 0.00000 -0.00424 0.00000 0.00000 104 4ZZ 0.00000 0.00000 0.00322 0.00000 0.00000 105 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 106 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 107 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 108 8 C 1S -0.00102 -0.00143 0.00034 -0.00017 -0.00057 109 2S 0.01582 0.02129 0.00776 0.00157 0.00581 110 2PX 0.01285 0.00707 0.00537 0.01751 0.00608 111 2PY 0.00322 0.02718 0.01538 0.00628 0.00079 112 2PZ 0.02802 0.01810 0.01243 0.00312 0.01202 113 3S 0.01008 0.02003 -0.00727 0.00066 0.00232 114 3PX 0.00600 0.00169 0.00383 0.03157 0.00538 115 3PY 0.00082 0.00782 0.00889 0.00572 0.00592 116 3PZ 0.01292 -0.00045 0.00230 0.00141 0.00746 117 4XX -0.00019 -0.00030 -0.00056 -0.00036 0.00026 118 4YY -0.00071 0.00093 -0.00045 0.00047 -0.00073 119 4ZZ 0.00102 -0.00136 0.00129 0.00008 0.00045 120 4XY -0.00002 0.00065 0.00000 0.00023 -0.00001 121 4XZ 0.00077 0.00034 0.00021 0.00035 0.00018 122 4YZ 0.00032 0.00107 0.00069 0.00018 -0.00003 123 9 C 1S 0.00000 0.00000 -0.00004 0.00001 0.00004 124 2S -0.00003 -0.00035 -0.00034 -0.00011 -0.00052 125 2PX -0.00000 0.00000 -0.00011 -0.00033 -0.00006 126 2PY 0.00000 -0.00000 -0.00054 -0.00007 0.00031 127 2PZ -0.00010 -0.00095 -0.00218 -0.00034 -0.00148 128 3S 0.00024 -0.00322 0.00293 -0.00018 -0.00032 129 3PX -0.00002 0.00032 0.00005 -0.00199 -0.00012 130 3PY -0.00026 0.00119 -0.00006 -0.00015 -0.00003 131 3PZ 0.00038 -0.00458 -0.00394 -0.00021 -0.00050 132 4XX -0.00000 -0.00000 -0.00003 0.00002 -0.00004 133 4YY 0.00000 -0.00001 -0.00006 -0.00003 0.00003 134 4ZZ 0.00003 0.00014 0.00028 0.00001 0.00007 135 4XY 0.00000 -0.00000 -0.00000 -0.00001 0.00000 136 4XZ 0.00000 0.00001 0.00001 0.00014 0.00002 137 4YZ -0.00000 0.00004 0.00006 0.00002 -0.00002 138 10 C 1S 0.00000 0.00000 0.00005 0.00000 0.00001 139 2S -0.00000 -0.00003 -0.00079 -0.00000 -0.00007 140 2PX -0.00001 -0.00001 -0.00004 -0.00095 -0.00013 141 2PY -0.00000 -0.00001 -0.00008 -0.00015 -0.00045 142 2PZ -0.00001 -0.00008 -0.00157 -0.00011 -0.00020 143 3S 0.00001 -0.00203 -0.00553 -0.00017 -0.00003 144 3PX -0.00017 -0.00016 -0.00026 -0.00507 -0.00058 145 3PY -0.00034 -0.00011 -0.00058 -0.00063 -0.00180 146 3PZ -0.00018 -0.00174 -0.00594 -0.00069 -0.00020 147 4XX 0.00000 0.00000 0.00002 -0.00000 0.00001 148 4YY 0.00000 -0.00000 0.00002 0.00001 0.00000 149 4ZZ -0.00000 -0.00000 0.00000 -0.00001 -0.00002 150 4XY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 151 4XZ 0.00000 -0.00000 0.00000 -0.00001 0.00000 152 4YZ -0.00000 -0.00000 0.00000 0.00000 -0.00002 153 11 H 1S 0.00000 0.00000 0.00001 0.00000 0.00000 154 2S -0.00000 -0.00000 0.00015 -0.00002 0.00001 155 12 H 1S 0.00000 0.00000 0.00008 0.00002 0.00008 156 2S 0.00010 0.00037 0.00105 0.00019 0.00080 157 13 H 1S -0.00048 -0.00009 -0.00405 -0.00037 -0.00127 158 2S -0.00650 -0.00097 -0.01248 -0.00176 -0.00586 159 14 H 1S 0.00441 0.09253 0.04190 0.00159 0.00215 160 2S 0.00248 0.05462 0.02472 0.00130 0.00163 161 15 H 1S -0.00051 -0.00003 -0.00339 -0.00056 -0.00119 162 2S -0.00701 -0.00053 -0.00995 -0.00220 -0.00649 163 16 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 164 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 165 2PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 166 2PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 167 2PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 168 3S -0.00000 0.00000 -0.00000 0.00001 -0.00001 169 3PX -0.00000 -0.00000 -0.00001 0.00007 -0.00003 170 3PY 0.00000 0.00000 0.00001 0.00001 0.00000 171 3PZ 0.00000 0.00000 0.00000 -0.00002 0.00001 172 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 173 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 174 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 175 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 176 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 177 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 178 17 C 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 179 2S 0.00000 0.00000 -0.00000 -0.00001 0.00000 180 2PX 0.00000 0.00000 -0.00000 -0.00003 0.00000 181 2PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 182 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 183 3S 0.00000 0.00000 -0.00003 -0.00020 0.00001 184 3PX 0.00001 0.00000 0.00002 -0.00115 0.00011 185 3PY -0.00000 0.00000 0.00001 -0.00001 -0.00000 186 3PZ -0.00000 -0.00000 -0.00000 0.00003 -0.00000 187 4XX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 188 4YY -0.00000 -0.00000 0.00000 0.00000 -0.00000 189 4ZZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 190 4XY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 191 4XZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 192 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 193 18 C 1S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 194 2S 0.00000 -0.00000 0.00000 0.00000 0.00000 195 2PX 0.00000 -0.00000 -0.00000 0.00000 0.00000 196 2PY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 197 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 198 3S -0.00000 0.00000 0.00000 -0.00002 -0.00000 199 3PX 0.00000 -0.00000 -0.00000 -0.00001 -0.00000 200 3PY 0.00000 0.00000 0.00000 -0.00000 0.00000 201 3PZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 202 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 203 4YY -0.00000 0.00000 0.00000 0.00000 -0.00000 204 4ZZ 0.00000 -0.00000 0.00000 0.00000 0.00000 205 4XY 0.00000 0.00000 -0.00000 -0.00000 0.00000 206 4XZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 207 4YZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 209 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 210 2PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 211 2PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 212 2PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 213 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 214 3PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 215 3PY -0.00000 0.00000 0.00000 -0.00000 -0.00000 216 3PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 217 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 218 4YY 0.00000 -0.00000 0.00000 0.00000 -0.00000 219 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 220 4XY -0.00000 -0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 222 4YZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 223 20 C 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 224 2S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 225 2PX 0.00000 -0.00000 -0.00000 0.00000 0.00000 226 2PY 0.00000 0.00000 0.00000 -0.00000 0.00000 227 2PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 228 3S 0.00000 0.00000 0.00000 -0.00000 0.00000 229 3PX 0.00000 0.00000 0.00000 -0.00000 0.00000 230 3PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 231 3PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 232 4XX 0.00000 0.00000 0.00000 -0.00000 0.00000 233 4YY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 234 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 235 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 236 4XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 237 4YZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 240 2PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 241 2PY 0.00000 0.00000 0.00000 0.00000 0.00000 242 2PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 243 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 244 3PX 0.00000 0.00000 0.00000 0.00000 0.00000 245 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 246 3PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 247 4XX 0.00000 0.00000 0.00000 -0.00000 0.00000 248 4YY -0.00000 0.00000 -0.00000 0.00000 -0.00000 249 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 250 4XY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 251 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 252 4YZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 253 22 H 1S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 254 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 255 23 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 256 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 257 24 H 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 258 2S 0.00000 -0.00000 -0.00000 0.00000 0.00000 259 25 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 260 2S 0.00000 0.00000 0.00000 0.00000 -0.00000 261 26 H 1S 0.00000 0.00000 -0.00002 -0.00010 -0.00000 262 2S -0.00003 -0.00004 -0.00016 0.00271 -0.00016 263 27 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 264 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 101 102 103 104 105 101 3PZ 0.04585 102 4XX 0.00000 0.00105 103 4YY 0.00000 0.00007 0.00122 104 4ZZ 0.00000 -0.00009 -0.00023 0.00170 105 4XY 0.00000 0.00000 0.00000 -0.00000 0.00054 106 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 107 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 108 8 C 1S -0.00052 0.00001 -0.00002 -0.00004 -0.00002 109 2S 0.01246 -0.00032 0.00010 0.00053 0.00022 110 2PX 0.00218 0.00003 0.00003 0.00044 0.00025 111 2PY 0.00800 -0.00033 -0.00075 0.00151 -0.00004 112 2PZ -0.00028 -0.00027 0.00058 -0.00122 0.00044 113 3S 0.01340 -0.00022 0.00070 -0.00017 0.00010 114 3PX 0.00080 -0.00039 0.00039 0.00009 0.00024 115 3PY 0.00345 0.00014 -0.00089 0.00053 -0.00001 116 3PZ -0.00103 -0.00011 0.00033 -0.00058 0.00003 117 4XX -0.00025 0.00001 0.00002 -0.00005 0.00000 118 4YY 0.00032 0.00002 0.00003 -0.00019 0.00002 119 4ZZ -0.00079 -0.00003 -0.00015 0.00011 -0.00004 120 4XY 0.00005 -0.00000 0.00002 -0.00008 -0.00001 121 4XZ 0.00000 -0.00000 -0.00006 -0.00001 -0.00001 122 4YZ 0.00000 -0.00007 -0.00001 -0.00001 -0.00000 123 9 C 1S -0.00005 0.00000 0.00000 -0.00000 0.00000 124 2S -0.00104 -0.00000 -0.00000 0.00004 -0.00000 125 2PX -0.00006 0.00000 0.00000 -0.00000 0.00000 126 2PY -0.00070 0.00000 -0.00000 -0.00001 -0.00000 127 2PZ -0.00063 -0.00000 -0.00001 0.00023 -0.00000 128 3S -0.00362 -0.00004 -0.00012 0.00040 -0.00000 129 3PX 0.00031 -0.00003 0.00005 -0.00002 0.00002 130 3PY 0.00021 0.00006 -0.00004 -0.00006 -0.00001 131 3PZ -0.00267 -0.00008 -0.00017 0.00079 -0.00001 132 4XX -0.00004 0.00000 0.00000 -0.00000 -0.00000 133 4YY -0.00013 0.00000 0.00000 -0.00000 -0.00000 134 4ZZ 0.00050 -0.00000 -0.00000 0.00000 -0.00000 135 4XY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 136 4XZ 0.00001 0.00000 0.00000 -0.00000 0.00000 137 4YZ 0.00007 -0.00000 0.00000 -0.00000 -0.00000 138 10 C 1S 0.00010 -0.00000 -0.00000 0.00000 0.00000 139 2S -0.00115 0.00000 0.00000 -0.00000 0.00000 140 2PX -0.00022 0.00000 -0.00000 -0.00000 -0.00000 141 2PY -0.00016 0.00000 0.00000 -0.00000 -0.00000 142 2PZ -0.00072 0.00000 0.00000 0.00000 -0.00000 143 3S -0.00540 0.00001 0.00002 0.00003 -0.00000 144 3PX -0.00052 0.00000 0.00000 -0.00001 -0.00000 145 3PY -0.00013 0.00000 0.00001 -0.00002 -0.00000 146 3PZ -0.00143 0.00001 -0.00001 0.00014 -0.00000 147 4XX 0.00000 0.00000 -0.00000 -0.00000 -0.00000 148 4YY 0.00001 -0.00000 0.00000 -0.00000 -0.00000 149 4ZZ 0.00004 -0.00000 -0.00000 0.00000 -0.00000 150 4XY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 151 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 152 4YZ -0.00001 0.00000 -0.00000 0.00000 -0.00000 153 11 H 1S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 154 2S 0.00012 -0.00000 -0.00000 0.00000 -0.00000 155 12 H 1S 0.00011 0.00000 0.00000 -0.00000 0.00000 156 2S 0.00133 -0.00000 0.00000 -0.00002 0.00000 157 13 H 1S -0.00061 0.00001 0.00007 -0.00002 0.00004 158 2S -0.00159 0.00024 0.00064 -0.00051 0.00014 159 14 H 1S 0.04428 -0.00083 -0.00112 0.00620 -0.00003 160 2S 0.03764 -0.00110 -0.00219 0.00524 -0.00001 161 15 H 1S 0.00001 0.00001 0.00005 -0.00001 0.00002 162 2S -0.00025 0.00010 0.00019 -0.00007 0.00002 163 16 C 1S -0.00000 0.00000 0.00000 -0.00000 -0.00000 164 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 165 2PX -0.00000 -0.00000 -0.00000 0.00000 0.00000 166 2PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 167 2PZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 168 3S 0.00000 -0.00000 0.00000 0.00000 -0.00000 169 3PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 170 3PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 171 3PZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 172 4XX -0.00000 -0.00000 0.00000 0.00000 -0.00000 173 4YY 0.00000 0.00000 -0.00000 -0.00000 0.00000 174 4ZZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 175 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 176 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 177 4YZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 178 17 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 179 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 180 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 181 2PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 182 2PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 183 3S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 184 3PX 0.00002 -0.00000 0.00000 0.00000 -0.00000 185 3PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 186 3PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 187 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 188 4YY 0.00000 -0.00000 0.00000 0.00000 -0.00000 189 4ZZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 190 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 191 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 192 4YZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 193 18 C 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 194 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 195 2PX 0.00000 0.00000 -0.00000 0.00000 -0.00000 196 2PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 197 2PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 198 3S 0.00000 0.00000 -0.00000 0.00000 -0.00000 199 3PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 200 3PY -0.00000 0.00000 -0.00000 0.00000 0.00000 201 3PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 202 4XX -0.00000 -0.00000 0.00000 -0.00000 0.00000 203 4YY -0.00000 0.00000 -0.00000 0.00000 0.00000 204 4ZZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 205 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 206 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 207 4YZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 210 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 211 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 212 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 213 3S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 214 3PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 215 3PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 216 3PZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 217 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 219 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 222 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 224 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 225 2PX -0.00000 0.00000 -0.00000 -0.00000 0.00000 226 2PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 227 2PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 228 3S 0.00000 0.00000 -0.00000 -0.00000 0.00000 229 3PX 0.00000 0.00000 -0.00000 0.00000 0.00000 230 3PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 231 3PZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 232 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 233 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 234 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 235 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 236 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 237 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 238 21 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 239 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 240 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 241 2PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 242 2PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 243 3S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 244 3PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 245 3PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 246 3PZ 0.00000 0.00000 -0.00000 0.00000 0.00000 247 4XX 0.00000 0.00000 -0.00000 -0.00000 0.00000 248 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 249 4ZZ -0.00000 0.00000 -0.00000 0.00000 0.00000 250 4XY 0.00000 -0.00000 0.00000 0.00000 -0.00000 251 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 252 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 254 2S -0.00000 0.00000 0.00000 0.00000 0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 256 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 257 24 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 258 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 259 25 H 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 260 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 261 26 H 1S -0.00001 -0.00000 0.00000 -0.00000 -0.00000 262 2S -0.00013 0.00001 -0.00000 -0.00000 -0.00000 263 27 H 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 264 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 106 107 108 109 110 106 4XZ 0.00058 107 4YZ 0.00000 0.00097 108 8 C 1S -0.00005 -0.00015 2.05297 109 2S 0.00051 0.00168 -0.01405 0.33123 110 2PX 0.00028 0.00078 0.00000 0.00000 0.34916 111 2PY 0.00077 0.00032 0.00000 0.00000 0.00000 112 2PZ 0.00031 0.00098 0.00000 0.00000 0.00000 113 3S 0.00022 0.00068 -0.03146 0.21348 0.00000 114 3PX 0.00036 0.00014 0.00000 0.00000 0.10834 115 3PY 0.00014 0.00001 0.00000 0.00000 -0.00000 116 3PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 117 4XX 0.00001 -0.00003 -0.00109 -0.00773 0.00000 118 4YY 0.00002 -0.00002 -0.00143 -0.00162 0.00000 119 4ZZ -0.00002 -0.00003 -0.00131 -0.00291 0.00000 120 4XY -0.00000 0.00002 -0.00000 0.00000 0.00000 121 4XZ -0.00000 0.00002 -0.00000 0.00000 0.00000 122 4YZ 0.00001 0.00002 0.00000 -0.00000 0.00000 123 9 C 1S 0.00000 -0.00000 0.00000 -0.00052 -0.00009 124 2S -0.00000 0.00000 -0.00052 0.01067 0.00119 125 2PX 0.00001 0.00000 -0.00008 0.00127 0.01325 126 2PY 0.00000 0.00000 -0.00013 0.00220 0.00159 127 2PZ 0.00000 0.00001 -0.00256 0.03856 0.00412 128 3S -0.00000 0.00001 0.00033 0.00784 0.00188 129 3PX 0.00008 0.00001 -0.00006 0.00020 0.02313 130 3PY 0.00001 -0.00001 -0.00011 0.00020 0.00086 131 3PZ -0.00000 0.00001 -0.00106 0.01931 0.00140 132 4XX 0.00000 -0.00000 0.00000 -0.00040 0.00004 133 4YY -0.00000 0.00000 0.00001 -0.00052 -0.00006 134 4ZZ 0.00000 0.00000 -0.00022 0.00303 0.00046 135 4XY 0.00000 0.00000 0.00000 -0.00001 0.00008 136 4XZ 0.00000 0.00000 -0.00002 0.00023 0.00143 137 4YZ 0.00000 -0.00000 -0.00004 0.00040 0.00003 138 10 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 139 2S -0.00000 -0.00000 0.00000 -0.00009 -0.00004 140 2PX 0.00000 0.00000 0.00000 -0.00006 -0.00001 141 2PY 0.00000 -0.00000 0.00000 -0.00017 -0.00010 142 2PZ -0.00000 -0.00000 0.00000 -0.00015 -0.00005 143 3S -0.00000 0.00000 -0.00004 -0.00043 -0.00093 144 3PX -0.00001 0.00000 0.00003 -0.00059 -0.00001 145 3PY 0.00000 -0.00002 0.00007 -0.00158 -0.00136 146 3PZ -0.00000 -0.00000 -0.00011 0.00023 -0.00032 147 4XX 0.00000 0.00000 0.00000 -0.00000 -0.00001 148 4YY 0.00000 -0.00000 0.00000 -0.00000 0.00003 149 4ZZ 0.00000 0.00000 -0.00000 0.00001 0.00001 150 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00001 151 4XZ 0.00000 0.00000 -0.00000 0.00001 0.00000 152 4YZ 0.00000 -0.00000 -0.00000 0.00002 0.00001 153 11 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 154 2S 0.00000 0.00000 -0.00000 0.00013 0.00003 155 12 H 1S 0.00000 0.00000 0.00000 -0.00019 -0.00000 156 2S 0.00000 0.00000 0.00020 -0.00280 -0.00006 157 13 H 1S 0.00000 0.00000 -0.00204 0.03210 0.02613 158 2S -0.00001 -0.00006 -0.00123 0.01206 0.01556 159 14 H 1S 0.00052 0.00075 0.00000 -0.00019 -0.00001 160 2S 0.00010 0.00015 0.00020 -0.00278 -0.00011 161 15 H 1S 0.00001 0.00003 -0.00000 0.00000 0.00000 162 2S 0.00005 0.00013 -0.00000 0.00012 0.00007 163 16 C 1S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 164 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 165 2PX 0.00000 0.00000 0.00000 -0.00000 -0.00000 166 2PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 167 2PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 168 3S 0.00000 0.00000 -0.00000 0.00000 0.00000 169 3PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 170 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 171 3PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 172 4XX 0.00000 0.00000 0.00000 -0.00000 0.00000 173 4YY -0.00000 -0.00000 0.00000 0.00000 -0.00000 174 4ZZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 175 4XY -0.00000 0.00000 0.00000 -0.00000 -0.00000 176 4XZ -0.00000 -0.00000 0.00000 0.00000 0.00000 177 4YZ -0.00000 0.00000 0.00000 0.00000 -0.00000 178 17 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 179 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 180 2PX -0.00000 0.00000 0.00000 -0.00000 0.00000 181 2PY 0.00000 0.00000 0.00000 -0.00000 0.00000 182 2PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 183 3S -0.00000 -0.00000 0.00000 -0.00000 0.00000 184 3PX -0.00000 0.00000 -0.00000 0.00000 -0.00001 185 3PY 0.00000 0.00000 -0.00000 0.00000 0.00000 186 3PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 187 4XX 0.00000 0.00000 0.00000 -0.00000 0.00000 188 4YY 0.00000 0.00000 0.00000 -0.00000 0.00000 189 4ZZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 190 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 191 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 192 4YZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 193 18 C 1S -0.00000 0.00000 0.00000 -0.00000 0.00000 194 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 195 2PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 196 2PY -0.00000 0.00000 -0.00000 0.00000 0.00000 197 2PZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 198 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 199 3PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 200 3PY -0.00000 0.00000 0.00000 -0.00000 0.00000 201 3PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 202 4XX -0.00000 -0.00000 0.00000 -0.00000 0.00000 203 4YY -0.00000 0.00000 0.00000 0.00000 -0.00000 204 4ZZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 205 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 206 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 207 4YZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 210 2PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 211 2PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 212 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 213 3S 0.00000 -0.00000 0.00000 -0.00000 0.00000 214 3PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 215 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 216 3PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 217 4XX 0.00000 0.00000 0.00000 -0.00000 -0.00000 218 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 219 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 220 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00000 222 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 224 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 225 2PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 226 2PY -0.00000 0.00000 0.00000 -0.00000 0.00000 227 2PZ 0.00000 -0.00000 0.00000 0.00000 0.00000 228 3S -0.00000 0.00000 -0.00000 0.00000 -0.00000 229 3PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 230 3PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 231 3PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 232 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 233 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 234 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 235 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 236 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 237 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S 0.00000 0.00000 0.00000 0.00000 0.00000 240 2PX 0.00000 0.00000 0.00000 -0.00000 0.00000 241 2PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 242 2PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 243 3S 0.00000 -0.00000 0.00000 -0.00000 0.00000 244 3PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 245 3PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 246 3PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 247 4XX -0.00000 0.00000 0.00000 -0.00000 -0.00000 248 4YY 0.00000 -0.00000 0.00000 0.00000 0.00000 249 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 250 4XY 0.00000 -0.00000 0.00000 -0.00000 0.00000 251 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 252 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 254 2S 0.00000 -0.00000 0.00000 -0.00000 0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 256 2S -0.00000 -0.00000 -0.00000 0.00000 0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 259 25 H 1S -0.00000 0.00000 -0.00000 0.00000 -0.00000 260 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 261 26 H 1S -0.00000 0.00000 0.00000 -0.00000 0.00000 262 2S 0.00001 -0.00000 0.00000 -0.00001 0.00007 263 27 H 1S -0.00000 -0.00000 0.00000 0.00000 -0.00000 264 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 111 112 113 114 115 111 2PY 0.40063 112 2PZ -0.00000 0.42268 113 3S 0.00000 0.00000 0.23318 114 3PX -0.00000 -0.00000 0.00000 0.11495 115 3PY 0.08765 -0.00000 0.00000 -0.00000 0.07118 116 3PZ -0.00000 0.07438 0.00000 -0.00000 -0.00000 117 4XX 0.00000 0.00000 -0.00436 0.00000 0.00000 118 4YY 0.00000 0.00000 0.00051 0.00000 0.00000 119 4ZZ 0.00000 0.00000 -0.00316 0.00000 0.00000 120 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 121 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 122 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 123 9 C 1S -0.00014 -0.00255 0.00037 -0.00001 -0.00000 124 2S 0.00192 0.03909 0.00662 0.00088 0.00160 125 2PX 0.00158 0.00427 0.00049 0.02259 0.00085 126 2PY 0.00414 0.00620 0.00043 0.00085 0.01080 127 2PZ 0.00579 0.08302 0.03168 0.00094 0.00070 128 3S 0.00321 0.02872 -0.00674 0.00156 0.00264 129 3PX 0.00086 0.00213 -0.00028 0.03755 0.00090 130 3PY 0.01085 0.00328 -0.00112 0.00089 0.01734 131 3PZ 0.00143 0.01193 0.01707 0.00068 0.00012 132 4XX -0.00007 -0.00085 -0.00064 -0.00011 0.00001 133 4YY 0.00006 -0.00124 -0.00106 0.00004 -0.00012 134 4ZZ 0.00080 0.00101 0.00261 0.00010 0.00008 135 4XY 0.00005 -0.00005 -0.00001 0.00004 0.00000 136 4XZ 0.00003 0.00042 0.00013 0.00091 0.00002 137 4YZ 0.00125 0.00072 0.00024 0.00002 0.00061 138 10 C 1S 0.00000 0.00000 -0.00004 -0.00003 -0.00006 139 2S -0.00012 -0.00022 -0.00043 0.00006 -0.00001 140 2PX -0.00008 -0.00011 -0.00028 -0.00008 -0.00006 141 2PY -0.00012 -0.00028 -0.00063 -0.00020 0.00049 142 2PZ -0.00010 -0.00024 -0.00256 -0.00002 0.00032 143 3S -0.00236 0.00042 0.00197 -0.00101 -0.00240 144 3PX -0.00124 -0.00092 -0.00096 -0.00104 -0.00162 145 3PY -0.00093 -0.00239 -0.00238 -0.00175 0.00006 146 3PZ 0.00008 0.00115 -0.00225 -0.00064 0.00074 147 4XX 0.00002 0.00000 -0.00001 -0.00016 0.00024 148 4YY -0.00002 -0.00000 -0.00007 0.00033 -0.00019 149 4ZZ 0.00001 0.00004 0.00015 -0.00001 -0.00002 150 4XY 0.00001 0.00001 -0.00001 0.00001 0.00004 151 4XZ 0.00001 0.00003 0.00005 -0.00000 0.00001 152 4YZ 0.00002 0.00007 0.00013 0.00002 0.00004 153 11 H 1S 0.00000 0.00000 0.00009 0.00000 -0.00001 154 2S 0.00008 0.00036 0.00113 -0.00003 0.00006 155 12 H 1S -0.00002 -0.00071 -0.00357 0.00001 -0.00000 156 2S -0.00035 -0.00948 -0.01069 -0.00003 -0.00021 157 13 H 1S 0.06837 0.00580 0.04332 0.01224 0.03182 158 2S 0.04046 0.00345 0.02641 0.01046 0.02666 159 14 H 1S -0.00006 -0.00066 -0.00357 -0.00008 -0.00031 160 2S -0.00064 -0.00913 -0.01056 -0.00017 -0.00087 161 15 H 1S 0.00000 0.00000 0.00010 0.00003 0.00009 162 2S 0.00027 0.00013 0.00108 0.00018 0.00111 163 16 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 164 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 165 2PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 166 2PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 167 2PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 168 3S -0.00000 -0.00000 -0.00000 0.00001 -0.00000 169 3PX -0.00000 -0.00000 -0.00000 0.00002 -0.00001 170 3PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 171 3PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 172 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 173 4YY 0.00000 -0.00000 0.00000 -0.00000 0.00000 174 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 175 4XY -0.00000 0.00000 -0.00000 0.00000 -0.00000 176 4XZ -0.00000 0.00000 0.00000 0.00000 -0.00000 177 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 178 17 C 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 179 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 180 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 181 2PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 182 2PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 183 3S -0.00000 0.00000 0.00000 0.00004 -0.00001 184 3PX 0.00000 0.00000 0.00002 -0.00024 0.00007 185 3PY -0.00000 0.00000 -0.00000 0.00005 -0.00000 186 3PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 187 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 188 4YY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 189 4ZZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 190 4XY -0.00000 0.00000 0.00000 0.00000 -0.00000 191 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 192 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 193 18 C 1S -0.00000 0.00000 0.00000 0.00000 -0.00000 194 2S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 195 2PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 196 2PY -0.00000 0.00000 -0.00000 0.00000 0.00000 197 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 198 3S 0.00000 -0.00000 0.00000 -0.00001 0.00000 199 3PX 0.00000 -0.00000 -0.00000 -0.00001 0.00000 200 3PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 201 3PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 202 4XX -0.00000 0.00000 0.00000 0.00000 -0.00000 203 4YY 0.00000 -0.00000 0.00000 -0.00000 0.00000 204 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 205 4XY -0.00000 0.00000 -0.00000 0.00000 0.00000 206 4XZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 207 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 208 19 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 209 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 210 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 211 2PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 212 2PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 213 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 214 3PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 215 3PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 216 3PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 217 4XX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 218 4YY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 219 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 220 4XY -0.00000 0.00000 -0.00000 0.00000 -0.00000 221 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 222 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 223 20 C 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 224 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 225 2PX 0.00000 0.00000 0.00000 -0.00000 0.00000 226 2PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 227 2PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 228 3S 0.00000 0.00000 0.00000 -0.00000 0.00000 229 3PX 0.00000 0.00000 0.00000 -0.00000 0.00000 230 3PY 0.00000 0.00000 0.00000 -0.00000 0.00000 231 3PZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 232 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 233 4YY 0.00000 0.00000 -0.00000 -0.00000 0.00000 234 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 235 4XY 0.00000 0.00000 -0.00000 0.00000 -0.00000 236 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 237 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 238 21 C 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 239 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 240 2PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 241 2PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 242 2PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 243 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 244 3PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 245 3PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 246 3PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 247 4XX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 248 4YY -0.00000 -0.00000 0.00000 0.00000 -0.00000 249 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 250 4XY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 251 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 252 4YZ -0.00000 0.00000 0.00000 0.00000 -0.00000 253 22 H 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 254 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 255 23 H 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 256 2S 0.00000 0.00000 0.00000 0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 258 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 259 25 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 260 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 261 26 H 1S -0.00000 0.00000 0.00000 0.00001 -0.00000 262 2S -0.00002 -0.00000 -0.00005 0.00069 -0.00017 263 27 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 264 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 116 117 118 119 120 116 3PZ 0.04670 117 4XX 0.00000 0.00074 118 4YY 0.00000 0.00010 0.00113 119 4ZZ 0.00000 -0.00000 -0.00019 0.00121 120 4XY 0.00000 -0.00000 0.00000 -0.00000 0.00082 121 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 122 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 123 9 C 1S -0.00118 0.00000 0.00001 -0.00023 0.00000 124 2S 0.01693 -0.00039 -0.00052 0.00302 -0.00001 125 2PX 0.00197 0.00004 -0.00003 0.00038 0.00010 126 2PY 0.00319 -0.00003 0.00006 0.00063 0.00006 127 2PZ 0.01373 -0.00084 -0.00112 0.00075 -0.00002 128 3S 0.01182 -0.00086 -0.00163 0.00352 -0.00002 129 3PX 0.00126 -0.00009 0.00001 0.00020 0.00005 130 3PY 0.00198 0.00003 -0.00015 0.00031 0.00002 131 3PZ 0.00095 -0.00065 -0.00107 0.00023 -0.00001 132 4XX -0.00062 0.00001 0.00001 -0.00006 -0.00000 133 4YY -0.00127 0.00001 0.00002 -0.00004 -0.00000 134 4ZZ 0.00061 -0.00006 -0.00007 0.00007 -0.00000 135 4XY -0.00001 -0.00000 -0.00000 0.00000 0.00000 136 4XZ 0.00004 0.00001 0.00001 -0.00003 -0.00001 137 4YZ 0.00005 0.00001 -0.00000 -0.00008 -0.00002 138 10 C 1S 0.00007 -0.00000 -0.00000 0.00000 -0.00000 139 2S -0.00178 0.00000 0.00001 -0.00000 0.00001 140 2PX -0.00092 0.00000 0.00001 0.00000 0.00000 141 2PY -0.00182 0.00001 0.00002 -0.00001 0.00001 142 2PZ -0.00223 0.00000 0.00001 0.00000 0.00001 143 3S -0.00046 0.00003 0.00008 -0.00007 0.00002 144 3PX -0.00159 0.00002 0.00005 -0.00001 -0.00000 145 3PY -0.00292 0.00007 0.00018 -0.00013 0.00002 146 3PZ -0.00048 -0.00004 -0.00007 0.00009 -0.00001 147 4XX 0.00000 -0.00000 0.00000 0.00000 -0.00000 148 4YY -0.00010 0.00000 -0.00000 0.00000 0.00000 149 4ZZ 0.00030 -0.00000 -0.00000 0.00000 -0.00000 150 4XY -0.00001 -0.00000 0.00000 0.00000 0.00000 151 4XZ 0.00004 -0.00000 -0.00000 0.00000 -0.00000 152 4YZ 0.00011 -0.00000 -0.00000 0.00000 0.00000 153 11 H 1S 0.00024 -0.00000 -0.00000 -0.00000 -0.00000 154 2S 0.00236 -0.00000 -0.00001 0.00000 -0.00000 155 12 H 1S -0.00253 -0.00000 -0.00000 0.00009 -0.00000 156 2S -0.00989 0.00001 -0.00005 0.00032 -0.00000 157 13 H 1S 0.00270 -0.00004 0.00316 -0.00126 0.00269 158 2S 0.00229 0.00080 0.00352 -0.00271 0.00045 159 14 H 1S -0.00216 -0.00000 -0.00001 0.00012 -0.00000 160 2S -0.00907 -0.00006 -0.00034 0.00092 -0.00001 161 15 H 1S 0.00012 -0.00000 -0.00000 0.00000 -0.00000 162 2S 0.00109 -0.00000 -0.00001 0.00000 -0.00000 163 16 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 164 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 165 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 166 2PY 0.00000 0.00000 -0.00000 0.00000 0.00000 167 2PZ -0.00000 -0.00000 0.00000 0.00000 0.00000 168 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 169 3PX -0.00000 0.00000 -0.00000 0.00000 0.00000 170 3PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 171 3PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 172 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 173 4YY 0.00000 0.00000 0.00000 -0.00000 0.00000 174 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 175 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 176 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 177 4YZ -0.00000 0.00000 0.00000 -0.00000 0.00000 178 17 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 179 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 180 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 181 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 182 2PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 183 3S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 184 3PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 185 3PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 186 3PZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 187 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 188 4YY -0.00000 0.00000 -0.00000 0.00000 0.00000 189 4ZZ 0.00000 0.00000 -0.00000 0.00000 0.00000 190 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 191 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 192 4YZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 193 18 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 194 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 195 2PX 0.00000 0.00000 -0.00000 0.00000 0.00000 196 2PY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 197 2PZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 198 3S -0.00000 -0.00000 0.00000 0.00000 -0.00000 199 3PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 200 3PY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 201 3PZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 202 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 203 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 204 4ZZ 0.00000 0.00000 -0.00000 0.00000 0.00000 205 4XY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 206 4XZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 207 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 210 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 211 2PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 212 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 213 3S -0.00000 0.00000 -0.00000 -0.00000 0.00000 214 3PX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 215 3PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 216 3PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 219 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 222 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 223 20 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 224 2S 0.00000 0.00000 0.00000 0.00000 0.00000 225 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 226 2PY -0.00000 0.00000 0.00000 0.00000 0.00000 227 2PZ -0.00000 0.00000 0.00000 0.00000 0.00000 228 3S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 229 3PX 0.00000 -0.00000 0.00000 0.00000 -0.00000 230 3PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 231 3PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 232 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 233 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 234 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 235 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 236 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 237 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 240 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 241 2PY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 242 2PZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 243 3S -0.00000 0.00000 -0.00000 -0.00000 0.00000 244 3PX -0.00000 0.00000 0.00000 -0.00000 0.00000 245 3PY -0.00000 0.00000 -0.00000 -0.00000 0.00000 246 3PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 247 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 248 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 249 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 250 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 251 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 252 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 254 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 255 23 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 256 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 259 25 H 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 260 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 261 26 H 1S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 262 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 263 27 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 264 2S 0.00000 -0.00000 0.00000 -0.00000 0.00000 121 122 123 124 125 121 4XZ 0.00081 122 4YZ 0.00000 0.00108 123 9 C 1S -0.00002 -0.00003 2.05285 124 2S 0.00024 0.00041 -0.01394 0.32995 125 2PX 0.00143 0.00004 0.00000 0.00000 0.35044 126 2PY 0.00003 0.00121 0.00000 0.00000 0.00000 127 2PZ 0.00056 0.00102 0.00000 0.00000 0.00000 128 3S 0.00005 0.00009 -0.03141 0.21289 0.00000 129 3PX 0.00089 0.00003 0.00000 0.00000 0.11023 130 3PY 0.00003 0.00046 0.00000 0.00000 -0.00000 131 3PZ 0.00004 0.00006 0.00000 0.00000 -0.00000 132 4XX -0.00000 -0.00001 -0.00104 -0.00855 0.00000 133 4YY -0.00001 -0.00001 -0.00131 -0.00336 0.00000 134 4ZZ -0.00003 -0.00007 -0.00148 -0.00024 0.00000 135 4XY -0.00002 -0.00000 -0.00000 0.00000 0.00000 136 4XZ -0.00006 0.00002 0.00000 -0.00000 0.00000 137 4YZ 0.00002 -0.00013 -0.00000 0.00000 0.00000 138 10 C 1S -0.00000 -0.00000 0.00000 -0.00053 -0.00071 139 2S 0.00001 0.00002 -0.00053 0.01086 0.01075 140 2PX -0.00001 0.00005 -0.00069 0.01053 -0.00038 141 2PY 0.00005 0.00003 -0.00190 0.02874 0.03969 142 2PZ 0.00001 0.00003 -0.00017 0.00239 0.00219 143 3S 0.00006 0.00014 0.00056 0.00543 0.00778 144 3PX 0.00002 0.00018 -0.00037 0.00514 0.00962 145 3PY 0.00018 0.00000 -0.00107 0.01397 0.01817 146 3PZ 0.00004 0.00005 0.00005 0.00159 0.00015 147 4XX -0.00000 0.00000 -0.00000 -0.00003 -0.00027 148 4YY 0.00000 -0.00000 -0.00011 0.00156 0.00171 149 4ZZ -0.00000 -0.00000 0.00001 -0.00057 -0.00035 150 4XY -0.00000 0.00000 -0.00012 0.00122 -0.00009 151 4XZ 0.00000 0.00000 -0.00001 0.00013 0.00000 152 4YZ 0.00000 0.00000 -0.00003 0.00036 0.00043 153 11 H 1S -0.00000 -0.00000 0.00000 -0.00019 -0.00012 154 2S -0.00000 -0.00000 0.00020 -0.00285 -0.00154 155 12 H 1S 0.00000 0.00002 -0.00205 0.03223 0.01138 156 2S 0.00003 0.00012 -0.00128 0.01257 0.00665 157 13 H 1S 0.00027 0.00074 0.00000 -0.00019 -0.00010 158 2S 0.00005 0.00015 0.00021 -0.00289 -0.00137 159 14 H 1S -0.00000 0.00000 -0.00000 0.00000 -0.00000 160 2S -0.00002 -0.00006 -0.00000 0.00013 -0.00000 161 15 H 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 162 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 163 16 C 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 164 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 165 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 166 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 167 2PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 168 3S -0.00000 -0.00000 -0.00000 0.00000 0.00000 169 3PX -0.00000 -0.00000 0.00000 -0.00000 0.00000 170 3PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 171 3PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 172 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 173 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 174 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 175 4XY 0.00000 -0.00000 0.00000 -0.00000 0.00000 176 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 177 4YZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 178 17 C 1S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 179 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 180 2PX -0.00000 0.00000 0.00000 -0.00000 0.00000 181 2PY -0.00000 0.00000 0.00000 -0.00000 0.00000 182 2PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 183 3S -0.00000 0.00000 0.00000 -0.00000 0.00000 184 3PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 185 3PY -0.00000 0.00000 -0.00000 0.00000 0.00000 186 3PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 187 4XX -0.00000 0.00000 0.00000 -0.00000 0.00000 188 4YY -0.00000 -0.00000 0.00000 -0.00000 0.00000 189 4ZZ -0.00000 0.00000 0.00000 -0.00000 0.00000 190 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 191 4XZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 192 4YZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 193 18 C 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 194 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 195 2PX 0.00000 -0.00000 -0.00000 0.00000 -0.00000 196 2PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 197 2PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 198 3S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 199 3PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 200 3PY 0.00000 0.00000 0.00000 -0.00000 0.00000 201 3PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 202 4XX -0.00000 0.00000 0.00000 -0.00000 0.00000 203 4YY 0.00000 -0.00000 0.00000 0.00000 -0.00000 204 4ZZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 205 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 206 4XZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 207 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 210 2PX -0.00000 0.00000 0.00000 -0.00000 0.00000 211 2PY -0.00000 -0.00000 0.00000 0.00000 0.00000 212 2PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 213 3S -0.00000 0.00000 0.00000 -0.00000 0.00000 214 3PX -0.00000 0.00000 0.00000 -0.00000 0.00000 215 3PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 216 3PZ 0.00000 0.00000 0.00000 0.00000 0.00000 217 4XX 0.00000 0.00000 0.00000 -0.00000 -0.00000 218 4YY 0.00000 0.00000 0.00000 0.00000 -0.00000 219 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00000 222 4YZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 224 2S 0.00000 0.00000 0.00000 0.00000 0.00000 225 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 226 2PY 0.00000 0.00000 0.00000 -0.00000 0.00000 227 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 228 3S 0.00000 0.00000 -0.00000 0.00000 -0.00000 229 3PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 230 3PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 231 3PZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 232 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 233 4YY 0.00000 0.00000 0.00000 0.00000 0.00000 234 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 235 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 236 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 237 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 238 21 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 239 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 240 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 241 2PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 242 2PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 243 3S 0.00000 -0.00000 0.00000 -0.00000 0.00000 244 3PX 0.00000 0.00000 -0.00000 0.00000 0.00000 245 3PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 246 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 247 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 248 4YY 0.00000 0.00000 0.00000 -0.00000 0.00000 249 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 250 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 251 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 252 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 254 2S -0.00000 0.00000 0.00000 0.00000 0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 256 2S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 259 25 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 260 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 261 26 H 1S -0.00000 0.00000 0.00000 -0.00000 -0.00000 262 2S 0.00000 -0.00000 0.00000 -0.00001 0.00001 263 27 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 264 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 126 127 128 129 130 126 2PY 0.39692 127 2PZ 0.00000 0.42722 128 3S 0.00000 0.00000 0.23546 129 3PX -0.00000 -0.00000 0.00000 0.11945 130 3PY 0.08671 0.00000 0.00000 -0.00000 0.07220 131 3PZ 0.00000 0.07213 0.00000 -0.00000 0.00000 132 4XX 0.00000 0.00000 -0.00549 0.00000 0.00000 133 4YY 0.00000 0.00000 -0.00199 0.00000 0.00000 134 4ZZ 0.00000 0.00000 0.00057 0.00000 0.00000 135 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 136 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 137 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 138 10 C 1S -0.00194 -0.00015 0.00026 -0.00033 -0.00096 139 2S 0.02983 0.00263 0.00867 0.00547 0.01626 140 2PX 0.03934 0.00233 0.00785 0.00962 0.01669 141 2PY 0.03004 0.00546 0.02112 0.01713 0.00142 142 2PZ 0.00538 -0.00025 0.00285 0.00037 0.00072 143 3S 0.02053 -0.00091 -0.00986 0.00387 0.00955 144 3PX 0.01803 0.00146 0.00351 0.02381 0.01349 145 3PY 0.00195 0.00349 0.00871 0.01369 0.00074 146 3PZ -0.00021 0.00585 0.00189 -0.00010 -0.00092 147 4XX 0.00030 0.00006 0.00029 -0.00088 0.00100 148 4YY -0.00101 0.00039 0.00218 0.00152 -0.00103 149 4ZZ -0.00092 0.00006 -0.00185 -0.00033 -0.00085 150 4XY 0.00121 0.00023 0.00046 0.00020 0.00008 151 4XZ 0.00041 0.00032 0.00003 0.00000 0.00006 152 4YZ 0.00056 0.00086 0.00009 0.00007 0.00002 153 11 H 1S -0.00030 -0.00030 -0.00309 -0.00026 -0.00069 154 2S -0.00400 -0.00428 -0.00989 -0.00146 -0.00404 155 12 H 1S 0.03611 0.05267 0.04205 0.00547 0.01723 156 2S 0.02104 0.03131 0.02535 0.00455 0.01410 157 13 H 1S -0.00023 -0.00040 -0.00403 -0.00017 -0.00035 158 2S -0.00325 -0.00507 -0.01243 -0.00105 -0.00238 159 14 H 1S -0.00000 0.00000 0.00009 -0.00000 -0.00001 160 2S -0.00001 0.00050 0.00106 -0.00001 -0.00013 161 15 H 1S 0.00000 0.00000 0.00001 0.00000 0.00000 162 2S 0.00000 -0.00000 0.00015 -0.00003 0.00008 163 16 C 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 164 2S -0.00000 -0.00000 0.00000 0.00000 0.00000 165 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 166 2PY 0.00000 0.00000 -0.00000 -0.00000 0.00000 167 2PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 168 3S -0.00000 0.00000 0.00000 0.00001 -0.00000 169 3PX -0.00000 -0.00000 -0.00000 0.00003 -0.00001 170 3PY 0.00000 -0.00000 0.00000 -0.00002 0.00001 171 3PZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 172 4XX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 173 4YY 0.00000 -0.00000 0.00000 0.00000 0.00000 174 4ZZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 175 4XY -0.00000 0.00000 -0.00000 0.00000 -0.00000 176 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 177 4YZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 178 17 C 1S 0.00000 -0.00000 0.00000 -0.00000 0.00000 179 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 180 2PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 181 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 182 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 183 3S -0.00000 -0.00000 -0.00001 0.00009 -0.00002 184 3PX 0.00000 0.00000 0.00001 -0.00008 0.00003 185 3PY -0.00000 0.00000 0.00000 0.00004 0.00000 186 3PZ -0.00000 -0.00000 -0.00000 0.00001 -0.00000 187 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 188 4YY -0.00000 0.00000 -0.00000 0.00000 -0.00000 189 4ZZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 190 4XY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 191 4XZ -0.00000 0.00000 0.00000 0.00000 -0.00000 192 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 193 18 C 1S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 194 2S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 195 2PX 0.00000 0.00000 0.00000 -0.00000 0.00000 196 2PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 197 2PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 198 3S 0.00000 0.00000 0.00000 -0.00000 0.00000 199 3PX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 200 3PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 201 3PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 202 4XX -0.00000 0.00000 -0.00000 0.00000 -0.00000 203 4YY -0.00000 0.00000 -0.00000 -0.00000 0.00000 204 4ZZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 205 4XY 0.00000 -0.00000 0.00000 0.00000 0.00000 206 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 207 4YZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 209 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 210 2PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 211 2PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 212 2PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 213 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 214 3PX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 215 3PY -0.00000 0.00000 0.00000 -0.00000 -0.00000 216 3PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 217 4XX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 218 4YY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 219 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 220 4XY -0.00000 -0.00000 -0.00000 0.00000 0.00000 221 4XZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 222 4YZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 223 20 C 1S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 224 2S -0.00000 -0.00000 0.00000 0.00000 0.00000 225 2PX 0.00000 -0.00000 -0.00000 0.00000 0.00000 226 2PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 227 2PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 228 3S 0.00000 0.00000 0.00000 -0.00000 0.00000 229 3PX 0.00000 0.00000 0.00000 -0.00000 0.00000 230 3PY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 231 3PZ -0.00000 0.00000 0.00000 0.00000 -0.00000 232 4XX 0.00000 0.00000 -0.00000 0.00000 -0.00000 233 4YY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 234 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 235 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 236 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00000 237 4YZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 238 21 C 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 239 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 240 2PX -0.00000 0.00000 0.00000 0.00000 -0.00000 241 2PY -0.00000 -0.00000 0.00000 0.00000 0.00000 242 2PZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 243 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 244 3PX 0.00000 -0.00000 0.00000 0.00000 -0.00000 245 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 246 3PZ -0.00000 -0.00000 0.00000 0.00000 0.00000 247 4XX 0.00000 -0.00000 0.00000 0.00000 0.00000 248 4YY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 249 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 250 4XY -0.00000 0.00000 -0.00000 -0.00000 -0.00000 251 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 252 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 253 22 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 254 2S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 256 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 257 24 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 258 2S 0.00000 -0.00000 0.00000 -0.00000 0.00000 259 25 H 1S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 260 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 261 26 H 1S -0.00000 -0.00000 -0.00000 0.00001 -0.00000 262 2S -0.00001 -0.00000 -0.00003 0.00002 -0.00003 263 27 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 264 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 131 132 133 134 135 131 3PZ 0.04174 132 4XX 0.00000 0.00090 133 4YY 0.00000 0.00006 0.00098 134 4ZZ 0.00000 -0.00003 -0.00012 0.00113 135 4XY 0.00000 0.00000 0.00000 -0.00000 0.00056 136 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 137 4YZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 138 10 C 1S -0.00018 -0.00000 -0.00011 0.00001 -0.00012 139 2S 0.00057 -0.00005 0.00165 -0.00061 0.00127 140 2PX 0.00089 -0.00026 0.00194 -0.00041 -0.00006 141 2PY 0.00233 0.00043 -0.00072 -0.00111 0.00145 142 2PZ 0.00354 0.00002 0.00049 0.00007 0.00037 143 3S -0.00202 0.00026 0.00163 -0.00134 0.00038 144 3PX 0.00066 -0.00084 0.00171 -0.00046 0.00016 145 3PY 0.00175 0.00115 -0.00061 -0.00133 0.00009 146 3PZ 0.00736 0.00001 -0.00000 -0.00010 0.00002 147 4XX 0.00009 0.00000 -0.00005 0.00001 -0.00001 148 4YY 0.00021 -0.00006 -0.00001 -0.00001 0.00002 149 4ZZ -0.00015 0.00001 -0.00003 0.00003 -0.00003 150 4XY 0.00004 -0.00001 0.00002 -0.00002 0.00002 151 4XZ 0.00008 -0.00000 0.00000 -0.00000 -0.00000 152 4YZ 0.00022 -0.00001 -0.00005 -0.00000 0.00000 153 11 H 1S -0.00038 0.00000 -0.00001 0.00003 -0.00001 154 2S -0.00323 -0.00001 -0.00032 0.00051 -0.00008 155 12 H 1S 0.02502 -0.00067 0.00005 0.00109 0.00046 156 2S 0.02140 -0.00047 0.00042 0.00128 0.00005 157 13 H 1S -0.00176 0.00001 0.00002 -0.00002 0.00001 158 2S -0.00584 0.00020 0.00040 -0.00052 0.00006 159 14 H 1S 0.00022 -0.00000 -0.00000 -0.00000 -0.00000 160 2S 0.00244 -0.00000 -0.00000 -0.00001 -0.00000 161 15 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 162 2S 0.00007 0.00000 0.00000 0.00000 0.00000 163 16 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 164 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 165 2PX -0.00000 0.00000 -0.00000 0.00000 0.00000 166 2PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 167 2PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 168 3S 0.00000 -0.00000 0.00000 0.00000 -0.00000 169 3PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 170 3PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 171 3PZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 172 4XX 0.00000 -0.00000 0.00000 0.00000 -0.00000 173 4YY -0.00000 0.00000 -0.00000 -0.00000 0.00000 174 4ZZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 175 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 176 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 177 4YZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 178 17 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 179 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 180 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 181 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 182 2PZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 183 3S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 184 3PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 185 3PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 186 3PZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 187 4XX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 188 4YY -0.00000 0.00000 -0.00000 0.00000 -0.00000 189 4ZZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 190 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 191 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 192 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 193 18 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 194 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 195 2PX 0.00000 0.00000 -0.00000 0.00000 0.00000 196 2PY -0.00000 -0.00000 -0.00000 0.00000 0.00000 197 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 198 3S 0.00000 0.00000 -0.00000 0.00000 0.00000 199 3PX -0.00000 0.00000 -0.00000 0.00000 0.00000 200 3PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 201 3PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 202 4XX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 203 4YY -0.00000 0.00000 -0.00000 0.00000 -0.00000 204 4ZZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 205 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 206 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 207 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 208 19 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 209 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 210 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 211 2PY -0.00000 0.00000 -0.00000 -0.00000 0.00000 212 2PZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 213 3S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 214 3PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 215 3PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 216 3PZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 219 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 221 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 222 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 224 2S -0.00000 0.00000 0.00000 0.00000 0.00000 225 2PX -0.00000 0.00000 0.00000 0.00000 0.00000 226 2PY 0.00000 0.00000 0.00000 0.00000 0.00000 227 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 228 3S -0.00000 0.00000 -0.00000 -0.00000 0.00000 229 3PX -0.00000 0.00000 -0.00000 0.00000 0.00000 230 3PY 0.00000 0.00000 -0.00000 0.00000 0.00000 231 3PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 232 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 233 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 234 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 235 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 236 4XZ -0.00000 0.00000 0.00000 0.00000 0.00000 237 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 238 21 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 239 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 240 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 241 2PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 242 2PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 243 3S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 244 3PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 245 3PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 246 3PZ -0.00000 -0.00000 0.00000 0.00000 0.00000 247 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 248 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 249 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 250 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 251 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 252 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 253 22 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 254 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 256 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 259 25 H 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 260 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 261 26 H 1S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 262 2S 0.00001 -0.00000 0.00000 -0.00000 -0.00000 263 27 H 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 264 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 136 137 138 139 140 136 4XZ 0.00077 137 4YZ 0.00000 0.00139 138 10 C 1S -0.00001 -0.00003 2.05302 139 2S 0.00012 0.00037 -0.01397 0.33034 140 2PX -0.00000 0.00031 0.00000 0.00000 0.35021 141 2PY 0.00031 0.00036 0.00000 0.00000 0.00000 142 2PZ 0.00032 0.00086 0.00000 0.00000 0.00000 143 3S 0.00008 0.00023 -0.03195 0.21449 0.00000 144 3PX 0.00003 0.00006 0.00000 0.00000 0.11492 145 3PY 0.00005 0.00001 0.00000 0.00000 -0.00000 146 3PZ 0.00010 0.00034 0.00000 0.00000 -0.00000 147 4XX 0.00000 -0.00004 -0.00101 -0.00895 0.00000 148 4YY -0.00006 -0.00002 -0.00122 -0.00476 0.00000 149 4ZZ -0.00000 -0.00001 -0.00161 0.00166 0.00000 150 4XY 0.00000 -0.00002 -0.00000 0.00000 0.00000 151 4XZ -0.00000 -0.00005 -0.00000 0.00000 0.00000 152 4YZ -0.00005 -0.00009 0.00000 -0.00000 0.00000 153 11 H 1S 0.00003 0.00007 -0.00203 0.03183 0.00267 154 2S 0.00010 0.00022 -0.00112 0.01039 0.00179 155 12 H 1S 0.00111 0.00345 0.00000 -0.00021 -0.00018 156 2S 0.00023 0.00069 0.00022 -0.00305 -0.00223 157 13 H 1S 0.00003 0.00007 -0.00000 0.00000 0.00000 158 2S 0.00008 0.00022 -0.00000 0.00013 0.00010 159 14 H 1S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 160 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 161 15 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 162 2S 0.00000 0.00000 -0.00000 0.00012 0.00003 163 16 C 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 164 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 165 2PX -0.00000 0.00000 0.00000 -0.00000 0.00000 166 2PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 167 2PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 168 3S 0.00000 -0.00000 -0.00000 0.00000 -0.00001 169 3PX 0.00000 -0.00000 -0.00000 0.00001 -0.00001 170 3PY -0.00000 0.00000 -0.00000 0.00000 -0.00001 171 3PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 172 4XX 0.00000 -0.00000 -0.00000 0.00000 -0.00000 173 4YY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 174 4ZZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 175 4XY -0.00000 0.00000 0.00000 -0.00000 -0.00000 176 4XZ -0.00000 0.00000 0.00000 -0.00000 0.00000 177 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 178 17 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 179 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 180 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 181 2PY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 182 2PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 183 3S 0.00000 -0.00000 0.00000 -0.00000 -0.00001 184 3PX -0.00000 0.00000 -0.00000 -0.00000 -0.00001 185 3PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 186 3PZ -0.00000 0.00000 0.00000 -0.00001 0.00003 187 4XX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 188 4YY 0.00000 -0.00000 0.00000 -0.00000 0.00000 189 4ZZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 190 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 191 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 192 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 193 18 C 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 194 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 195 2PX -0.00000 0.00000 -0.00000 0.00000 0.00000 196 2PY 0.00000 0.00000 -0.00000 0.00000 0.00000 197 2PZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 198 3S -0.00000 0.00000 0.00000 -0.00000 0.00000 199 3PX -0.00000 0.00000 0.00000 -0.00000 0.00000 200 3PY 0.00000 0.00000 -0.00000 0.00000 0.00000 201 3PZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 202 4XX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 203 4YY -0.00000 -0.00000 0.00000 0.00000 0.00000 204 4ZZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 205 4XY 0.00000 0.00000 0.00000 -0.00000 0.00000 206 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 207 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 210 2PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 211 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 212 2PZ -0.00000 0.00000 0.00000 -0.00000 0.00000 213 3S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 214 3PX 0.00000 -0.00000 0.00000 -0.00000 -0.00000 215 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 216 3PZ -0.00000 0.00000 0.00000 0.00000 0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY 0.00000 0.00000 0.00000 -0.00000 -0.00000 219 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 222 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 223 20 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 224 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 225 2PX 0.00000 0.00000 0.00000 -0.00000 0.00000 226 2PY 0.00000 0.00000 0.00000 0.00000 0.00000 227 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 228 3S -0.00000 0.00000 0.00000 -0.00000 -0.00000 229 3PX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 230 3PY -0.00000 0.00000 0.00000 0.00000 0.00000 231 3PZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 232 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 233 4YY 0.00000 0.00000 0.00000 -0.00000 0.00000 234 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 235 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 236 4XZ 0.00000 0.00000 0.00000 0.00000 -0.00000 237 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 238 21 C 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 239 2S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 240 2PX 0.00000 -0.00000 -0.00000 0.00000 -0.00000 241 2PY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 242 2PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 243 3S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 244 3PX 0.00000 -0.00000 -0.00000 0.00000 -0.00000 245 3PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 246 3PZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 247 4XX 0.00000 0.00000 0.00000 -0.00000 0.00000 248 4YY 0.00000 0.00000 0.00000 0.00000 -0.00000 249 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 250 4XY 0.00000 0.00000 0.00000 0.00000 -0.00000 251 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 252 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 254 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 255 23 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 256 2S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 258 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 259 25 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 260 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 261 26 H 1S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 262 2S 0.00000 -0.00000 0.00000 -0.00006 -0.00001 263 27 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 264 2S 0.00000 -0.00000 0.00000 -0.00000 0.00000 141 142 143 144 145 141 2PY 0.39966 142 2PZ -0.00000 0.42474 143 3S 0.00000 0.00000 0.25364 144 3PX -0.00000 0.00000 0.00000 0.12994 145 3PY 0.09301 -0.00000 0.00000 -0.00000 0.08227 146 3PZ 0.00000 0.07796 0.00000 -0.00000 -0.00000 147 4XX 0.00000 0.00000 -0.00626 0.00000 0.00000 148 4YY 0.00000 0.00000 -0.00428 0.00000 0.00000 149 4ZZ 0.00000 0.00000 0.00365 0.00000 0.00000 150 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 151 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 152 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 153 11 H 1S 0.00492 0.09229 0.04360 0.00190 0.00357 154 2S 0.00279 0.05351 0.02725 0.00184 0.00261 155 12 H 1S -0.00051 -0.00003 -0.00399 -0.00040 -0.00126 156 2S -0.00657 -0.00047 -0.01206 -0.00192 -0.00597 157 13 H 1S 0.00000 0.00000 0.00010 0.00007 0.00019 158 2S 0.00027 0.00010 0.00115 0.00070 0.00192 159 14 H 1S 0.00000 0.00000 0.00001 -0.00000 0.00000 160 2S 0.00000 0.00001 0.00027 -0.00000 0.00001 161 15 H 1S 0.00000 0.00000 0.00009 0.00002 0.00007 162 2S 0.00010 0.00038 0.00121 0.00022 0.00073 163 16 C 1S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 164 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 165 2PX -0.00000 0.00000 -0.00000 0.00001 0.00000 166 2PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 167 2PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 168 3S 0.00000 0.00000 0.00003 -0.00021 0.00008 169 3PX 0.00000 -0.00000 0.00008 -0.00020 0.00005 170 3PY 0.00000 0.00000 0.00001 -0.00006 -0.00000 171 3PZ 0.00000 0.00000 -0.00001 -0.00004 0.00002 172 4XX 0.00000 0.00000 0.00000 -0.00000 0.00000 173 4YY -0.00000 -0.00000 0.00000 0.00000 -0.00000 174 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 175 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 176 4XZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 177 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 178 17 C 1S -0.00000 0.00000 -0.00000 0.00000 -0.00000 179 2S 0.00000 -0.00000 0.00000 -0.00001 0.00000 180 2PX 0.00000 -0.00000 0.00000 -0.00005 0.00000 181 2PY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 182 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 183 3S 0.00000 0.00000 0.00008 -0.00006 0.00000 184 3PX -0.00000 0.00000 -0.00002 0.00009 -0.00000 185 3PY -0.00001 0.00000 0.00000 -0.00000 -0.00006 186 3PZ -0.00000 -0.00000 0.00002 0.00041 -0.00000 187 4XX 0.00000 -0.00000 0.00000 -0.00000 0.00000 188 4YY 0.00000 -0.00000 -0.00000 0.00000 0.00000 189 4ZZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 190 4XY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 191 4XZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 192 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 193 18 C 1S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 194 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 195 2PX 0.00000 0.00000 -0.00000 0.00000 0.00000 196 2PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 197 2PZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 198 3S 0.00000 -0.00000 -0.00000 0.00002 0.00000 199 3PX 0.00000 -0.00000 -0.00001 0.00002 0.00000 200 3PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 201 3PZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 202 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 203 4YY 0.00000 0.00000 -0.00000 0.00000 0.00000 204 4ZZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 205 4XY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 206 4XZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 207 4YZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 208 19 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 209 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 210 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 211 2PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 212 2PZ 0.00000 -0.00000 0.00000 0.00000 0.00000 213 3S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 214 3PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 215 3PY 0.00000 0.00000 -0.00000 -0.00000 0.00000 216 3PZ 0.00000 0.00000 0.00000 0.00000 0.00000 217 4XX 0.00000 0.00000 -0.00000 0.00000 0.00000 218 4YY -0.00000 -0.00000 0.00000 0.00000 -0.00000 219 4ZZ 0.00000 0.00000 -0.00000 0.00000 0.00000 220 4XY -0.00000 0.00000 -0.00000 0.00000 -0.00000 221 4XZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 222 4YZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 223 20 C 1S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 224 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 225 2PX -0.00000 -0.00000 0.00000 0.00000 0.00000 226 2PY 0.00000 0.00000 -0.00000 -0.00000 0.00000 227 2PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 228 3S -0.00000 0.00000 -0.00000 0.00000 0.00000 229 3PX -0.00000 0.00000 0.00000 0.00000 0.00000 230 3PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 231 3PZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 232 4XX 0.00000 -0.00000 0.00000 -0.00000 0.00000 233 4YY -0.00000 -0.00000 0.00000 0.00000 -0.00000 234 4ZZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 235 4XY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 236 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 237 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 238 21 C 1S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 239 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 240 2PX 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 241 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 242 2PZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 243 3S 0.00000 -0.00000 0.00000 -0.00000 0.00000 244 3PX 0.00000 -0.00000 -0.00000 -0.00001 0.00000 245 3PY -0.00000 -0.00000 0.00000 -0.00000 -0.00000 246 3PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 247 4XX -0.00000 -0.00000 -0.00000 0.00000 -0.00000 248 4YY 0.00000 0.00000 0.00000 -0.00000 0.00000 249 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 250 4XY 0.00000 -0.00000 0.00000 -0.00000 0.00000 251 4XZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 252 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 -0.00000 -0.00000 254 2S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 255 23 H 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 256 2S 0.00000 0.00000 -0.00000 -0.00000 0.00000 257 24 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 259 25 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 260 2S 0.00000 0.00000 0.00000 -0.00000 -0.00000 261 26 H 1S -0.00000 -0.00000 0.00001 -0.00012 -0.00001 262 2S -0.00000 -0.00006 -0.00003 -0.00050 -0.00003 263 27 H 1S -0.00000 0.00000 -0.00000 0.00000 -0.00000 264 2S -0.00001 0.00000 -0.00003 0.00009 -0.00009 146 147 148 149 150 146 3PZ 0.05373 147 4XX 0.00000 0.00108 148 4YY 0.00000 0.00005 0.00118 149 4ZZ 0.00000 -0.00008 -0.00021 0.00165 150 4XY 0.00000 0.00000 -0.00000 -0.00000 0.00054 151 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 152 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 153 11 H 1S 0.04284 -0.00081 -0.00105 0.00612 -0.00002 154 2S 0.03321 -0.00106 -0.00211 0.00528 -0.00001 155 12 H 1S 0.00001 0.00001 0.00005 -0.00001 0.00002 156 2S -0.00031 0.00011 0.00025 -0.00010 0.00003 157 13 H 1S -0.00001 -0.00000 -0.00000 -0.00000 -0.00000 158 2S -0.00002 -0.00000 0.00000 -0.00001 0.00000 159 14 H 1S 0.00002 -0.00000 -0.00000 0.00000 -0.00000 160 2S 0.00045 -0.00000 -0.00000 0.00000 -0.00000 161 15 H 1S 0.00017 0.00000 0.00000 -0.00000 0.00000 162 2S 0.00193 0.00000 0.00000 -0.00002 0.00000 163 16 C 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 164 2S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 165 2PX 0.00000 -0.00000 0.00000 0.00000 -0.00000 166 2PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 167 2PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 168 3S 0.00000 -0.00000 0.00000 0.00000 -0.00000 169 3PX -0.00000 -0.00000 0.00000 0.00000 -0.00000 170 3PY -0.00000 0.00000 -0.00000 -0.00000 0.00000 171 3PZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 172 4XX 0.00000 -0.00000 -0.00000 0.00000 -0.00000 173 4YY -0.00000 -0.00000 0.00000 -0.00000 0.00000 174 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 175 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 176 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 177 4YZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 178 17 C 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 179 2S 0.00000 -0.00000 0.00000 -0.00000 -0.00000 180 2PX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 181 2PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 182 2PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 183 3S 0.00006 -0.00000 0.00000 -0.00000 -0.00000 184 3PX -0.00002 0.00000 -0.00000 -0.00000 0.00000 185 3PY -0.00000 -0.00000 0.00000 -0.00000 0.00000 186 3PZ 0.00001 0.00000 -0.00000 -0.00000 -0.00000 187 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 188 4YY 0.00000 -0.00000 0.00000 0.00000 0.00000 189 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 190 4XY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 191 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 192 4YZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 193 18 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 194 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 195 2PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 196 2PY 0.00000 0.00000 -0.00000 0.00000 -0.00000 197 2PZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 198 3S -0.00000 0.00000 -0.00000 0.00000 -0.00000 199 3PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 200 3PY -0.00000 0.00000 -0.00000 0.00000 0.00000 201 3PZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 202 4XX -0.00000 -0.00000 0.00000 -0.00000 0.00000 203 4YY 0.00000 0.00000 -0.00000 0.00000 -0.00000 204 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 205 4XY 0.00000 0.00000 -0.00000 0.00000 -0.00000 206 4XZ -0.00000 -0.00000 -0.00000 -0.00000 0.00000 207 4YZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 208 19 C 1S 0.00000 0.00000 0.00000 0.00000 0.00000 209 2S 0.00000 -0.00000 0.00000 -0.00000 0.00000 210 2PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 211 2PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 212 2PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 213 3S -0.00000 -0.00000 0.00000 -0.00000 0.00000 214 3PX 0.00000 -0.00000 0.00000 0.00000 0.00000 215 3PY -0.00000 -0.00000 0.00000 0.00000 -0.00000 216 3PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 217 4XX -0.00000 0.00000 -0.00000 0.00000 -0.00000 218 4YY 0.00000 0.00000 -0.00000 -0.00000 0.00000 219 4ZZ -0.00000 -0.00000 0.00000 0.00000 0.00000 220 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 222 4YZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 223 20 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 224 2S 0.00000 -0.00000 0.00000 -0.00000 0.00000 225 2PX 0.00000 -0.00000 0.00000 -0.00000 0.00000 226 2PY -0.00000 0.00000 0.00000 0.00000 -0.00000 227 2PZ -0.00000 -0.00000 0.00000 0.00000 0.00000 228 3S -0.00000 0.00000 0.00000 -0.00000 0.00000 229 3PX 0.00000 0.00000 0.00000 -0.00000 0.00000 230 3PY -0.00000 0.00000 -0.00000 0.00000 0.00000 231 3PZ 0.00000 -0.00000 0.00000 0.00000 0.00000 232 4XX -0.00000 0.00000 0.00000 -0.00000 -0.00000 233 4YY 0.00000 0.00000 -0.00000 -0.00000 0.00000 234 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 235 4XY -0.00000 0.00000 -0.00000 0.00000 -0.00000 236 4XZ -0.00000 -0.00000 0.00000 0.00000 -0.00000 237 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 238 21 C 1S -0.00000 0.00000 0.00000 0.00000 0.00000 239 2S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 240 2PX -0.00000 0.00000 -0.00000 0.00000 -0.00000 241 2PY 0.00000 -0.00000 0.00000 0.00000 -0.00000 242 2PZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 243 3S -0.00000 -0.00000 -0.00000 0.00000 -0.00000 244 3PX -0.00000 -0.00000 0.00000 -0.00000 0.00000 245 3PY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 246 3PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 247 4XX -0.00000 0.00000 0.00000 -0.00000 0.00000 248 4YY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 249 4ZZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 250 4XY -0.00000 -0.00000 -0.00000 0.00000 -0.00000 251 4XZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 252 4YZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 253 22 H 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 254 2S 0.00000 -0.00000 -0.00000 0.00000 0.00000 255 23 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 256 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 257 24 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 258 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 259 25 H 1S -0.00000 0.00000 -0.00000 0.00000 -0.00000 260 2S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 261 26 H 1S -0.00000 -0.00000 0.00000 -0.00000 0.00000 262 2S -0.00011 0.00000 -0.00000 0.00000 0.00000 263 27 H 1S -0.00000 0.00000 0.00000 -0.00000 0.00000 264 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 151 152 153 154 155 151 4XZ 0.00060 152 4YZ 0.00000 0.00104 153 11 H 1S 0.00048 0.00088 0.21498 154 2S 0.00009 0.00018 0.10109 0.12994 155 12 H 1S 0.00001 0.00003 -0.00001 -0.00077 0.21525 156 2S 0.00005 0.00014 -0.00081 -0.00340 0.10263 157 13 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00001 158 2S -0.00000 -0.00000 -0.00000 -0.00015 -0.00076 159 14 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 160 2S 0.00000 0.00000 0.00000 0.00001 -0.00000 161 15 H 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 162 2S 0.00000 0.00000 -0.00000 -0.00014 0.00000 163 16 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 164 2S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 165 2PX -0.00000 0.00000 -0.00000 0.00000 0.00000 166 2PY -0.00000 0.00000 -0.00000 0.00000 -0.00000 167 2PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 168 3S -0.00000 0.00000 0.00000 0.00002 0.00000 169 3PX -0.00000 -0.00000 0.00000 0.00006 -0.00000 170 3PY -0.00000 0.00000 -0.00000 -0.00001 0.00000 171 3PZ -0.00000 0.00000 0.00000 0.00002 0.00000 172 4XX -0.00000 0.00000 0.00000 0.00000 0.00000 173 4YY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 174 4ZZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 175 4XY -0.00000 0.00000 -0.00000 -0.00000 0.00000 176 4XZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 177 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 178 17 C 1S 0.00000 -0.00000 0.00000 -0.00000 0.00000 179 2S -0.00000 0.00000 -0.00000 0.00000 -0.00000 180 2PX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 181 2PY -0.00000 -0.00000 -0.00000 0.00000 0.00000 182 2PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 183 3S -0.00000 0.00000 -0.00000 -0.00001 -0.00000 184 3PX -0.00000 0.00000 -0.00000 -0.00002 -0.00000 185 3PY -0.00000 -0.00000 0.00000 0.00000 0.00000 186 3PZ 0.00000 -0.00000 0.00000 0.00002 -0.00000 187 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 188 4YY -0.00000 0.00000 -0.00000 -0.00000 0.00000 189 4ZZ -0.00000 0.00000 -0.00000 0.00000 0.00000 190 4XY -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 191 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 192 4YZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 193 18 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 194 2S 0.00000 0.00000 0.00000 0.00000 0.00000 195 2PX 0.00000 0.00000 0.00000 0.00000 0.00000 196 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 197 2PZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 198 3S 0.00000 0.00000 0.00000 0.00000 -0.00000 199 3PX 0.00000 0.00000 0.00000 0.00000 0.00000 200 3PY 0.00000 -0.00000 0.00000 0.00000 0.00000 201 3PZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 202 4XX -0.00000 -0.00000 0.00000 0.00000 -0.00000 203 4YY 0.00000 0.00000 0.00000 0.00000 -0.00000 204 4ZZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 205 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 206 4XZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 207 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 209 2S -0.00000 -0.00000 -0.00000 0.00000 0.00000 210 2PX -0.00000 -0.00000 -0.00000 0.00000 0.00000 211 2PY -0.00000 0.00000 0.00000 0.00000 0.00000 212 2PZ 0.00000 0.00000 0.00000 -0.00000 0.00000 213 3S -0.00000 -0.00000 0.00000 0.00000 0.00000 214 3PX -0.00000 -0.00000 0.00000 0.00000 0.00000 215 3PY -0.00000 0.00000 0.00000 0.00000 -0.00000 216 3PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY -0.00000 0.00000 -0.00000 0.00000 0.00000 219 4ZZ 0.00000 0.00000 0.00000 -0.00000 0.00000 220 4XY 0.00000 -0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 222 4YZ -0.00000 0.00000 0.00000 -0.00000 0.00000 223 20 C 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 224 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 225 2PX -0.00000 0.00000 -0.00000 0.00000 0.00000 226 2PY 0.00000 -0.00000 0.00000 -0.00000 0.00000 227 2PZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 228 3S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 229 3PX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 230 3PY 0.00000 0.00000 0.00000 0.00000 0.00000 231 3PZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 232 4XX -0.00000 0.00000 -0.00000 -0.00000 0.00000 233 4YY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 234 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 235 4XY -0.00000 0.00000 0.00000 -0.00000 0.00000 236 4XZ -0.00000 0.00000 0.00000 -0.00000 0.00000 237 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 238 21 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 239 2S -0.00000 0.00000 0.00000 0.00000 0.00000 240 2PX -0.00000 -0.00000 0.00000 -0.00000 0.00000 241 2PY -0.00000 0.00000 -0.00000 0.00000 0.00000 242 2PZ -0.00000 0.00000 0.00000 -0.00000 0.00000 243 3S -0.00000 -0.00000 0.00000 0.00000 0.00000 244 3PX -0.00000 0.00000 -0.00000 -0.00000 -0.00000 245 3PY -0.00000 -0.00000 0.00000 0.00000 0.00000 246 3PZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 247 4XX 0.00000 -0.00000 -0.00000 -0.00000 0.00000 248 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 249 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 250 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 251 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 252 4YZ -0.00000 0.00000 -0.00000 -0.00000 0.00000 253 22 H 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 254 2S -0.00000 -0.00000 0.00000 0.00000 -0.00000 255 23 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 256 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 0.00000 -0.00000 0.00000 258 2S 0.00000 0.00000 0.00000 0.00000 0.00000 259 25 H 1S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 260 2S 0.00000 0.00000 -0.00000 -0.00000 -0.00000 261 26 H 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 262 2S 0.00001 0.00000 0.00000 0.00005 0.00000 263 27 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 264 2S -0.00000 0.00000 -0.00000 -0.00005 -0.00000 156 157 158 159 160 156 2S 0.12993 157 13 H 1S -0.00078 0.21544 158 2S -0.00344 0.10315 0.13125 159 14 H 1S -0.00000 -0.00001 -0.00076 0.21526 160 2S -0.00015 -0.00078 -0.00342 0.10254 0.12943 161 15 H 1S 0.00000 -0.00000 -0.00000 -0.00001 -0.00081 162 2S 0.00001 -0.00000 -0.00014 -0.00075 -0.00323 163 16 C 1S -0.00000 0.00000 0.00000 0.00000 -0.00000 164 2S 0.00000 0.00000 0.00000 0.00000 0.00000 165 2PX 0.00000 0.00000 -0.00000 0.00000 0.00000 166 2PY -0.00000 0.00000 0.00000 -0.00000 -0.00000 167 2PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 168 3S 0.00000 -0.00000 -0.00000 0.00000 0.00000 169 3PX -0.00000 -0.00000 -0.00000 -0.00000 0.00000 170 3PY 0.00000 0.00000 0.00000 -0.00000 -0.00000 171 3PZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 172 4XX 0.00000 -0.00000 -0.00000 0.00000 0.00000 173 4YY -0.00000 0.00000 0.00000 -0.00000 -0.00000 174 4ZZ -0.00000 0.00000 0.00000 0.00000 -0.00000 175 4XY -0.00000 0.00000 0.00000 0.00000 0.00000 176 4XZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 177 4YZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 178 17 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 179 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 180 2PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 181 2PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 182 2PZ 0.00000 0.00000 0.00000 0.00000 -0.00000 183 3S -0.00000 0.00000 0.00000 -0.00000 -0.00000 184 3PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00001 185 3PY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 186 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 187 4XX 0.00000 0.00000 0.00000 0.00000 -0.00000 188 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 189 4ZZ 0.00000 0.00000 0.00000 0.00000 0.00000 190 4XY -0.00000 0.00000 0.00000 -0.00000 -0.00000 191 4XZ 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 192 4YZ -0.00000 0.00000 0.00000 0.00000 0.00000 193 18 C 1S -0.00000 0.00000 0.00000 -0.00000 -0.00000 194 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 195 2PX 0.00000 -0.00000 -0.00000 0.00000 0.00000 196 2PY -0.00000 -0.00000 -0.00000 -0.00000 0.00000 197 2PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 198 3S -0.00000 -0.00000 -0.00000 0.00000 0.00000 199 3PX -0.00000 0.00000 0.00000 0.00000 0.00000 200 3PY 0.00000 0.00000 0.00000 0.00000 0.00000 201 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 202 4XX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 203 4YY -0.00000 0.00000 0.00000 -0.00000 -0.00000 204 4ZZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 205 4XY 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 206 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 207 4YZ 0.00000 0.00000 0.00000 -0.00000 0.00000 208 19 C 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 209 2S 0.00000 0.00000 -0.00000 0.00000 -0.00000 210 2PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 211 2PY -0.00000 0.00000 0.00000 0.00000 0.00000 212 2PZ -0.00000 0.00000 -0.00000 -0.00000 -0.00000 213 3S 0.00000 0.00000 0.00000 0.00000 0.00000 214 3PX 0.00000 0.00000 0.00000 0.00000 0.00000 215 3PY -0.00000 -0.00000 -0.00000 0.00000 0.00000 216 3PZ -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 217 4XX 0.00000 0.00000 0.00000 0.00000 0.00000 218 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 219 4ZZ 0.00000 0.00000 0.00000 0.00000 -0.00000 220 4XY -0.00000 0.00000 -0.00000 0.00000 0.00000 221 4XZ -0.00000 0.00000 0.00000 0.00000 -0.00000 222 4YZ -0.00000 0.00000 0.00000 0.00000 -0.00000 223 20 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 224 2S -0.00000 0.00000 0.00000 0.00000 -0.00000 225 2PX -0.00000 0.00000 0.00000 0.00000 0.00000 226 2PY 0.00000 0.00000 0.00000 0.00000 -0.00000 227 2PZ -0.00000 0.00000 -0.00000 0.00000 0.00000 228 3S -0.00000 0.00000 0.00000 -0.00000 -0.00000 229 3PX -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 230 3PY 0.00000 -0.00000 -0.00000 0.00000 0.00000 231 3PZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 232 4XX 0.00000 0.00000 -0.00000 0.00000 -0.00000 233 4YY -0.00000 0.00000 0.00000 0.00000 0.00000 234 4ZZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 235 4XY 0.00000 0.00000 -0.00000 0.00000 -0.00000 236 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 237 4YZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 238 21 C 1S -0.00000 0.00000 0.00000 0.00000 -0.00000 239 2S 0.00000 0.00000 -0.00000 0.00000 0.00000 240 2PX 0.00000 0.00000 -0.00000 -0.00000 0.00000 241 2PY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 242 2PZ 0.00000 0.00000 0.00000 0.00000 0.00000 243 3S 0.00000 -0.00000 0.00000 -0.00000 0.00000 244 3PX -0.00000 0.00000 0.00000 -0.00000 -0.00000 245 3PY 0.00000 -0.00000 -0.00000 -0.00000 0.00000 246 3PZ 0.00000 0.00000 0.00000 0.00000 0.00000 247 4XX -0.00000 0.00000 -0.00000 0.00000 -0.00000 248 4YY 0.00000 0.00000 0.00000 0.00000 -0.00000 249 4ZZ -0.00000 0.00000 0.00000 0.00000 0.00000 250 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 251 4XZ -0.00000 0.00000 0.00000 0.00000 -0.00000 252 4YZ 0.00000 0.00000 0.00000 0.00000 0.00000 253 22 H 1S 0.00000 0.00000 0.00000 0.00000 0.00000 254 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 255 23 H 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 256 2S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 257 24 H 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 0.00000 -0.00000 0.00000 259 25 H 1S -0.00000 0.00000 -0.00000 -0.00000 -0.00000 260 2S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 261 26 H 1S -0.00000 0.00000 0.00000 -0.00000 -0.00000 262 2S 0.00000 0.00000 0.00000 0.00000 0.00005 263 27 H 1S -0.00000 0.00000 0.00000 -0.00000 -0.00000 264 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 161 162 163 164 165 161 15 H 1S 0.21453 162 2S 0.09916 0.12817 163 16 C 1S -0.00000 -0.00000 2.05171 164 2S -0.00000 -0.00000 -0.01402 0.33704 165 2PX 0.00000 0.00000 0.00000 0.00000 0.42206 166 2PY 0.00000 -0.00000 0.00000 0.00000 0.00000 167 2PZ -0.00000 0.00001 0.00000 0.00000 0.00000 168 3S 0.00000 0.00008 -0.03056 0.20818 0.00000 169 3PX 0.00000 0.00006 0.00000 0.00000 0.03187 170 3PY 0.00000 -0.00000 0.00000 0.00000 0.00000 171 3PZ -0.00000 0.00005 0.00000 0.00000 0.00000 172 4XX -0.00000 0.00000 -0.00135 -0.00233 0.00000 173 4YY -0.00000 -0.00000 -0.00125 -0.00403 0.00000 174 4ZZ -0.00000 -0.00000 -0.00102 -0.00885 0.00000 175 4XY -0.00000 -0.00000 0.00000 -0.00000 0.00000 176 4XZ -0.00000 0.00000 0.00000 -0.00000 0.00000 177 4YZ -0.00000 0.00000 0.00000 -0.00000 0.00000 178 17 C 1S 0.00000 0.00000 0.00000 -0.00040 -0.00006 179 2S -0.00000 -0.00001 -0.00041 0.00908 0.00110 180 2PX -0.00000 -0.00001 -0.00006 0.00090 0.00031 181 2PY -0.00000 0.00001 -0.00176 0.02897 0.00278 182 2PZ -0.00000 0.00001 -0.00051 0.00830 0.00071 183 3S -0.00000 0.00004 0.00044 0.00312 0.00019 184 3PX 0.00000 0.00004 0.00004 0.00045 0.00941 185 3PY -0.00001 0.00003 -0.00075 0.01223 0.00201 186 3PZ 0.00001 0.00017 -0.00022 0.00351 0.00057 187 4XX -0.00000 -0.00000 0.00000 -0.00051 0.00004 188 4YY -0.00000 -0.00000 -0.00013 0.00201 0.00024 189 4ZZ -0.00000 -0.00000 -0.00000 -0.00006 0.00002 190 4XY 0.00000 0.00000 -0.00001 0.00017 0.00107 191 4XZ 0.00000 0.00000 -0.00000 0.00005 0.00030 192 4YZ 0.00000 0.00000 -0.00010 0.00118 0.00012 193 18 C 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 194 2S 0.00000 0.00000 0.00000 -0.00008 -0.00002 195 2PX 0.00000 -0.00000 0.00000 -0.00006 -0.00001 196 2PY -0.00000 0.00000 0.00000 -0.00022 -0.00002 197 2PZ -0.00000 0.00000 0.00000 -0.00007 -0.00001 198 3S -0.00000 -0.00000 -0.00003 -0.00032 -0.00124 199 3PX -0.00000 -0.00001 0.00005 -0.00075 0.00029 200 3PY -0.00000 0.00000 -0.00002 -0.00088 -0.00068 201 3PZ -0.00000 0.00000 -0.00000 -0.00027 -0.00024 202 4XX -0.00000 -0.00000 0.00000 -0.00000 0.00000 203 4YY 0.00000 0.00000 -0.00000 0.00002 -0.00001 204 4ZZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 205 4XY -0.00000 0.00000 -0.00000 0.00000 0.00000 206 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 207 4YZ -0.00000 0.00000 -0.00000 0.00001 -0.00000 208 19 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 209 2S -0.00000 0.00000 0.00000 -0.00001 -0.00002 210 2PX -0.00000 0.00000 0.00000 -0.00002 -0.00001 211 2PY 0.00000 -0.00000 0.00000 -0.00001 -0.00005 212 2PZ 0.00000 -0.00000 0.00000 -0.00000 -0.00002 213 3S -0.00000 -0.00000 0.00005 -0.00077 -0.00060 214 3PX -0.00000 0.00000 0.00006 -0.00072 0.00035 215 3PY 0.00000 0.00000 0.00003 -0.00033 -0.00030 216 3PZ -0.00000 -0.00000 0.00001 -0.00011 -0.00011 217 4XX 0.00000 0.00000 -0.00000 -0.00000 0.00000 218 4YY 0.00000 -0.00000 -0.00000 0.00000 -0.00000 219 4ZZ -0.00000 0.00000 -0.00000 0.00000 -0.00000 220 4XY -0.00000 0.00000 0.00000 -0.00000 -0.00000 221 4XZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 222 4YZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 223 20 C 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 224 2S -0.00000 0.00000 0.00000 -0.00007 -0.00031 225 2PX -0.00000 0.00000 0.00000 -0.00031 -0.00100 226 2PY 0.00000 -0.00000 0.00000 -0.00001 -0.00004 227 2PZ 0.00000 -0.00000 0.00000 -0.00001 -0.00002 228 3S -0.00000 -0.00000 -0.00003 -0.00033 -0.00417 229 3PX -0.00000 -0.00000 0.00000 -0.00161 -0.00545 230 3PY 0.00000 -0.00000 0.00002 -0.00020 -0.00051 231 3PZ 0.00000 -0.00000 0.00001 -0.00008 -0.00022 232 4XX -0.00000 -0.00000 -0.00000 0.00003 0.00020 233 4YY 0.00000 0.00000 0.00000 -0.00000 -0.00001 234 4ZZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 235 4XY 0.00000 -0.00000 0.00000 -0.00000 -0.00000 236 4XZ -0.00000 -0.00000 0.00000 -0.00000 -0.00000 237 4YZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 238 21 C 1S -0.00000 0.00000 0.00000 -0.00039 -0.00197 239 2S 0.00000 0.00000 -0.00039 0.00898 0.03187 240 2PX -0.00000 -0.00000 -0.00196 0.03321 0.07379 241 2PY -0.00000 0.00000 -0.00022 0.00345 0.01090 242 2PZ 0.00000 -0.00000 -0.00005 0.00082 0.00243 243 3S 0.00000 0.00000 0.00044 0.00340 0.04105 244 3PX -0.00000 -0.00000 -0.00101 0.01403 0.01511 245 3PY 0.00000 0.00000 -0.00000 0.00170 0.00691 246 3PZ 0.00000 -0.00000 0.00000 0.00042 0.00163 247 4XX -0.00000 -0.00000 -0.00018 0.00271 0.00109 248 4YY 0.00000 0.00000 0.00001 -0.00039 -0.00096 249 4ZZ 0.00000 -0.00000 0.00000 -0.00032 -0.00078 250 4XY 0.00000 -0.00000 -0.00005 0.00071 0.00149 251 4XZ -0.00000 0.00000 -0.00001 0.00018 0.00036 252 4YZ 0.00000 0.00000 0.00000 -0.00001 -0.00001 253 22 H 1S 0.00000 0.00000 0.00000 -0.00017 -0.00038 254 2S -0.00000 0.00000 0.00018 -0.00266 -0.00348 255 23 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 256 2S -0.00000 -0.00000 -0.00000 0.00010 0.00037 257 24 H 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 0.00000 -0.00000 0.00001 259 25 H 1S 0.00000 -0.00000 -0.00000 0.00000 -0.00000 260 2S 0.00000 0.00000 -0.00000 0.00011 -0.00001 261 26 H 1S -0.00000 -0.00002 0.00000 -0.00017 -0.00019 262 2S -0.00012 -0.00026 0.00019 -0.00273 -0.00356 263 27 H 1S -0.00000 -0.00000 0.00000 -0.00026 -0.00010 264 2S -0.00000 -0.00002 0.00019 -0.00302 -0.00026 166 167 168 169 170 166 2PY 0.40701 167 2PZ -0.00000 0.36647 168 3S 0.00000 0.00000 0.25976 169 3PX 0.00000 0.00000 0.00000 0.02586 170 3PY 0.04637 0.00000 0.00000 0.00000 0.04771 171 3PZ 0.00000 0.09571 0.00000 0.00000 0.00000 172 4XX 0.00000 0.00000 -0.00121 0.00000 0.00000 173 4YY 0.00000 0.00000 -0.00307 0.00000 0.00000 174 4ZZ 0.00000 0.00000 -0.00545 0.00000 0.00000 175 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 176 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 177 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 178 17 C 1S -0.00168 -0.00049 0.00028 -0.00004 -0.00043 179 2S 0.02689 0.00785 0.00579 -0.00032 0.01252 180 2PX 0.00226 0.00055 0.00158 0.00611 0.00247 181 2PY 0.04326 0.03160 0.02855 0.00204 -0.00014 182 2PZ 0.03094 0.00023 0.00832 0.00058 0.00754 183 3S 0.03331 0.01017 -0.00432 0.00035 0.00498 184 3PX 0.00181 0.00045 0.00199 0.00329 0.00082 185 3PY 0.00702 0.01499 0.00970 0.00127 0.00029 186 3PZ 0.01433 0.00548 0.00284 0.00034 0.00583 187 4XX -0.00106 -0.00031 -0.00210 -0.00009 -0.00101 188 4YY 0.00002 0.00207 0.00278 0.00018 -0.00057 189 4ZZ 0.00019 -0.00018 0.00036 0.00005 0.00086 190 4XY 0.00027 0.00014 0.00005 0.00002 -0.00002 191 4XZ 0.00014 0.00000 0.00002 -0.00001 -0.00001 192 4YZ 0.00186 -0.00004 0.00049 0.00002 0.00013 193 18 C 1S 0.00000 0.00000 -0.00000 -0.00007 -0.00013 194 2S -0.00024 -0.00007 -0.00095 0.00090 0.00082 195 2PX -0.00014 -0.00005 -0.00004 -0.00004 0.00268 196 2PY -0.00046 -0.00021 -0.00386 0.00272 -0.00001 197 2PZ -0.00020 -0.00001 -0.00124 0.00070 -0.00075 198 3S -0.00260 -0.00079 -0.00108 0.00096 0.00164 199 3PX -0.00126 -0.00042 -0.00158 0.00014 0.00234 200 3PY -0.00139 -0.00139 -0.00605 0.00268 0.00097 201 3PZ -0.00138 0.00005 -0.00210 0.00055 -0.00200 202 4XX -0.00002 -0.00001 -0.00018 0.00003 -0.00022 203 4YY 0.00007 0.00004 0.00030 -0.00015 0.00023 204 4ZZ 0.00002 -0.00000 0.00008 -0.00005 0.00009 205 4XY 0.00001 0.00002 0.00003 -0.00001 0.00001 206 4XZ 0.00002 -0.00001 0.00001 -0.00000 0.00007 207 4YZ 0.00005 0.00000 0.00007 -0.00003 0.00011 208 19 C 1S 0.00000 0.00000 0.00005 0.00006 0.00003 209 2S -0.00001 -0.00000 -0.00104 -0.00061 -0.00022 210 2PX -0.00005 -0.00002 -0.00120 0.00130 -0.00121 211 2PY 0.00003 -0.00003 -0.00071 -0.00093 0.00094 212 2PZ -0.00002 0.00001 -0.00027 -0.00039 -0.00017 213 3S -0.00031 -0.00011 -0.00600 -0.00197 -0.00082 214 3PX -0.00027 -0.00014 -0.00304 0.00167 -0.00169 215 3PY 0.00038 -0.00044 -0.00189 -0.00093 0.00102 216 3PZ -0.00042 -0.00021 -0.00083 -0.00057 -0.00099 217 4XX -0.00000 -0.00000 0.00002 0.00013 -0.00006 218 4YY 0.00000 0.00000 0.00002 -0.00007 0.00004 219 4ZZ 0.00000 0.00000 0.00002 -0.00001 0.00001 220 4XY -0.00000 0.00000 -0.00001 0.00002 0.00002 221 4XZ 0.00000 -0.00000 -0.00000 0.00001 0.00001 222 4YZ 0.00000 0.00000 -0.00000 -0.00001 0.00001 223 20 C 1S -0.00000 -0.00000 -0.00003 -0.00014 -0.00001 224 2S 0.00000 -0.00000 -0.00056 0.00045 0.00019 225 2PX 0.00001 0.00000 -0.00432 0.00002 0.00088 226 2PY -0.00000 -0.00000 0.00023 0.00082 0.00069 227 2PZ -0.00000 -0.00002 0.00009 0.00030 -0.00005 228 3S -0.00032 -0.00012 0.00020 0.00031 0.00001 229 3PX -0.00029 -0.00012 -0.00793 -0.00018 0.00073 230 3PY 0.00024 -0.00004 -0.00018 0.00080 0.00059 231 3PZ -0.00005 -0.00058 -0.00006 0.00026 -0.00010 232 4XX -0.00001 -0.00000 0.00045 0.00065 -0.00008 233 4YY 0.00000 0.00000 -0.00013 -0.00022 -0.00000 234 4ZZ 0.00000 0.00000 -0.00002 -0.00008 0.00002 235 4XY 0.00000 0.00000 -0.00000 -0.00000 -0.00002 236 4XZ 0.00000 0.00001 0.00000 0.00000 0.00000 237 4YZ -0.00000 0.00000 -0.00000 -0.00000 -0.00001 238 21 C 1S -0.00020 -0.00005 0.00063 -0.00055 -0.00006 239 2S 0.00361 0.00089 0.00239 0.01612 -0.00050 240 2PX 0.01086 0.00242 0.02580 0.00470 0.00266 241 2PY 0.00073 0.00131 0.00603 0.00501 0.00326 242 2PZ 0.00129 0.00930 0.00128 0.00112 0.00074 243 3S 0.00186 0.00040 -0.01256 0.00916 -0.00053 244 3PX 0.00680 0.00136 0.00336 0.00044 0.00146 245 3PY 0.00769 0.00047 0.00567 0.00185 0.00543 246 3PZ 0.00046 0.01658 0.00109 0.00030 0.00071 247 4XX 0.00122 0.00029 0.00327 0.00087 0.00037 248 4YY 0.00003 -0.00004 -0.00143 -0.00120 -0.00020 249 4ZZ -0.00008 0.00002 -0.00065 -0.00075 0.00002 250 4XY 0.00053 0.00008 0.00028 0.00001 0.00018 251 4XZ 0.00008 0.00135 0.00007 -0.00000 0.00004 252 4YZ 0.00003 0.00014 -0.00003 -0.00001 0.00002 253 22 H 1S -0.00025 -0.00007 -0.00435 -0.00290 -0.00122 254 2S -0.00409 -0.00120 -0.01137 -0.00767 -0.00316 255 23 H 1S 0.00000 -0.00000 0.00010 0.00014 0.00000 256 2S 0.00000 -0.00000 0.00118 0.00126 0.00001 257 24 H 1S 0.00000 0.00000 0.00001 -0.00000 -0.00000 258 2S 0.00000 0.00000 0.00021 0.00014 0.00004 259 25 H 1S 0.00000 0.00000 0.00011 -0.00006 0.00013 260 2S 0.00030 0.00009 0.00130 -0.00044 0.00113 261 26 H 1S -0.00038 -0.00010 -0.00366 0.00000 -0.00294 262 2S -0.00386 -0.00109 -0.01097 -0.00068 -0.00789 263 27 H 1S -0.00056 -0.00022 -0.00441 0.00039 -0.00167 264 2S -0.00639 -0.00229 -0.01136 0.00066 -0.00390 171 172 173 174 175 171 3PZ 0.10054 172 4XX 0.00000 0.00130 173 4YY 0.00000 -0.00017 0.00126 174 4ZZ 0.00000 0.00000 0.00006 0.00097 175 4XY 0.00000 0.00000 0.00000 -0.00000 0.00122 176 4XZ 0.00000 0.00000 -0.00000 0.00000 -0.00000 177 4YZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 178 17 C 1S -0.00014 0.00000 -0.00013 -0.00000 -0.00001 179 2S 0.00379 -0.00047 0.00198 -0.00005 0.00015 180 2PX 0.00069 0.00004 0.00027 0.00001 0.00123 181 2PY 0.00849 -0.00096 -0.00029 0.00004 0.00012 182 2PZ 0.00891 -0.00028 0.00142 -0.00014 0.00022 183 3S 0.00203 -0.00145 0.00267 0.00028 0.00013 184 3PX 0.00016 -0.00006 0.00008 -0.00000 0.00027 185 3PY 0.00709 -0.00134 -0.00021 0.00076 0.00000 186 3PZ 0.01679 -0.00041 0.00125 -0.00053 0.00005 187 4XX -0.00029 0.00003 -0.00001 0.00001 -0.00001 188 4YY 0.00131 -0.00002 0.00001 -0.00011 -0.00001 189 4ZZ -0.00066 0.00001 -0.00011 0.00001 -0.00001 190 4XY -0.00001 -0.00000 -0.00002 0.00000 -0.00012 191 4XZ 0.00001 -0.00000 0.00001 -0.00000 -0.00004 192 4YZ 0.00021 -0.00002 -0.00002 -0.00000 0.00000 193 18 C 1S -0.00004 0.00000 -0.00000 -0.00000 -0.00000 194 2S 0.00027 -0.00000 0.00001 0.00000 0.00001 195 2PX 0.00082 -0.00000 0.00002 0.00000 0.00001 196 2PY -0.00028 -0.00000 -0.00001 0.00003 0.00004 197 2PZ 0.00002 -0.00000 0.00007 -0.00001 0.00001 198 3S 0.00067 -0.00006 0.00006 0.00002 0.00008 199 3PX 0.00071 0.00001 0.00002 0.00002 -0.00002 200 3PY -0.00096 -0.00004 -0.00023 0.00035 0.00008 201 3PZ -0.00043 -0.00002 0.00053 -0.00020 0.00001 202 4XX -0.00006 0.00000 -0.00000 0.00000 -0.00000 203 4YY 0.00021 -0.00000 -0.00000 0.00000 -0.00000 204 4ZZ -0.00005 -0.00000 0.00000 -0.00000 -0.00000 205 4XY 0.00008 -0.00000 0.00000 0.00000 0.00000 206 4XZ -0.00001 -0.00000 0.00000 -0.00000 -0.00000 207 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 208 19 C 1S 0.00001 0.00000 -0.00000 -0.00000 0.00000 209 2S -0.00008 -0.00000 0.00000 0.00000 -0.00000 210 2PX -0.00041 0.00000 -0.00000 -0.00000 -0.00000 211 2PY -0.00007 -0.00000 -0.00000 0.00000 -0.00000 212 2PZ -0.00022 -0.00000 0.00000 -0.00000 0.00000 213 3S -0.00027 0.00001 0.00001 0.00001 -0.00002 214 3PX -0.00066 0.00010 -0.00006 -0.00001 -0.00002 215 3PY -0.00077 -0.00007 0.00000 0.00005 -0.00001 216 3PZ -0.00188 -0.00002 0.00006 -0.00002 0.00003 217 4XX -0.00002 -0.00000 0.00000 0.00000 0.00000 218 4YY 0.00001 0.00000 0.00000 -0.00000 -0.00000 219 4ZZ 0.00000 0.00000 -0.00000 0.00000 0.00000 220 4XY 0.00001 0.00000 -0.00000 0.00000 0.00000 221 4XZ -0.00000 0.00000 0.00000 -0.00000 0.00000 222 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 223 20 C 1S -0.00001 -0.00000 0.00000 0.00000 -0.00000 224 2S 0.00007 0.00002 -0.00000 -0.00000 0.00000 225 2PX 0.00034 0.00014 -0.00001 -0.00000 0.00002 226 2PY -0.00005 0.00001 -0.00000 -0.00000 -0.00000 227 2PZ -0.00023 0.00001 -0.00000 -0.00000 0.00000 228 3S 0.00003 0.00009 -0.00003 -0.00001 0.00003 229 3PX 0.00027 0.00033 -0.00003 -0.00001 0.00005 230 3PY -0.00009 0.00001 0.00001 -0.00001 -0.00000 231 3PZ -0.00236 0.00001 -0.00002 0.00001 0.00001 232 4XX -0.00003 0.00000 -0.00000 -0.00000 -0.00000 233 4YY 0.00003 -0.00000 0.00000 -0.00000 0.00000 234 4ZZ -0.00001 -0.00000 -0.00000 0.00000 -0.00000 235 4XY 0.00000 0.00000 -0.00000 -0.00000 -0.00000 236 4XZ 0.00005 0.00000 -0.00000 -0.00000 0.00000 237 4YZ 0.00001 -0.00000 0.00000 -0.00000 0.00000 238 21 C 1S -0.00002 -0.00018 0.00001 0.00000 -0.00006 239 2S -0.00014 0.00282 -0.00042 -0.00032 0.00074 240 2PX 0.00057 0.00049 -0.00085 -0.00066 0.00144 241 2PY 0.00071 0.00116 0.00004 -0.00001 0.00054 242 2PZ 0.01379 0.00028 0.00006 0.00005 -0.00000 243 3S -0.00018 0.00323 -0.00100 -0.00055 0.00049 244 3PX 0.00003 0.00034 -0.00058 -0.00051 0.00013 245 3PY 0.00065 0.00036 -0.00035 0.00018 0.00021 246 3PZ 0.02085 0.00007 0.00020 -0.00016 0.00002 247 4XX 0.00007 0.00003 -0.00006 -0.00005 -0.00007 248 4YY 0.00000 -0.00006 0.00001 0.00001 -0.00000 249 4ZZ -0.00003 -0.00005 0.00001 0.00001 -0.00000 250 4XY 0.00004 -0.00005 -0.00000 -0.00001 -0.00007 251 4XZ 0.00080 -0.00001 0.00000 0.00000 0.00001 252 4YZ 0.00008 0.00000 -0.00000 0.00000 -0.00001 253 22 H 1S -0.00033 -0.00001 0.00003 0.00000 0.00006 254 2S -0.00101 -0.00039 0.00039 0.00014 0.00017 255 23 H 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 256 2S -0.00002 -0.00001 -0.00000 -0.00000 0.00000 257 24 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 258 2S 0.00002 0.00000 0.00000 0.00000 0.00000 259 25 H 1S 0.00004 -0.00000 -0.00000 -0.00000 -0.00000 260 2S 0.00033 -0.00000 -0.00000 -0.00000 -0.00000 261 26 H 1S -0.00084 0.00002 0.00000 0.00000 0.00006 262 2S -0.00231 0.00032 -0.00016 -0.00000 0.00023 263 27 H 1S -0.00076 -0.00002 0.00009 0.00002 0.00001 264 2S -0.00161 -0.00043 0.00062 0.00023 -0.00002 176 177 178 179 180 176 4XZ 0.00072 177 4YZ 0.00000 0.00063 178 17 C 1S -0.00000 -0.00010 2.05361 179 2S 0.00005 0.00115 -0.01465 0.34030 180 2PX 0.00037 0.00016 0.00000 0.00000 0.45773 181 2PY 0.00021 0.00137 0.00000 0.00000 0.00000 182 2PZ -0.00001 -0.00004 0.00000 0.00000 -0.00000 183 3S 0.00004 0.00043 -0.03264 0.22414 0.00000 184 3PX 0.00010 0.00001 0.00000 0.00000 0.08376 185 3PY 0.00005 0.00013 0.00000 0.00000 -0.00000 186 3PZ 0.00004 0.00019 0.00000 0.00000 -0.00000 187 4XX -0.00000 -0.00002 -0.00163 0.00236 0.00000 188 4YY -0.00000 -0.00002 -0.00125 -0.00437 0.00000 189 4ZZ -0.00000 -0.00000 -0.00099 -0.00952 0.00000 190 4XY -0.00005 0.00001 -0.00000 0.00000 0.00000 191 4XZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 192 4YZ -0.00000 0.00002 0.00000 -0.00000 0.00000 193 18 C 1S -0.00000 -0.00000 0.00000 -0.00060 -0.00189 194 2S 0.00000 0.00001 -0.00059 0.01179 0.02704 195 2PX 0.00000 0.00001 -0.00182 0.02799 0.02981 196 2PY 0.00001 0.00006 -0.00092 0.01337 0.02571 197 2PZ 0.00001 -0.00002 -0.00030 0.00443 0.00938 198 3S 0.00002 0.00002 0.00039 0.00716 0.02259 199 3PX -0.00001 0.00001 -0.00095 0.01112 0.00081 200 3PY -0.00000 0.00015 -0.00030 0.00780 0.00667 201 3PZ 0.00001 -0.00002 -0.00010 0.00250 0.00273 202 4XX -0.00000 -0.00000 -0.00008 0.00097 -0.00171 203 4YY -0.00000 0.00000 0.00000 -0.00021 0.00056 204 4ZZ 0.00000 -0.00000 0.00001 -0.00035 -0.00037 205 4XY -0.00000 0.00000 -0.00015 0.00167 0.00169 206 4XZ 0.00000 0.00000 -0.00005 0.00055 0.00052 207 4YZ 0.00000 0.00000 -0.00002 0.00015 0.00059 208 19 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 209 2S -0.00000 -0.00000 0.00000 -0.00009 -0.00039 210 2PX -0.00000 -0.00000 0.00000 -0.00040 -0.00116 211 2PY 0.00000 0.00000 0.00000 0.00000 0.00001 212 2PZ -0.00000 -0.00000 0.00000 -0.00000 0.00001 213 3S -0.00001 -0.00000 -0.00004 -0.00038 -0.00387 214 3PX -0.00000 -0.00002 0.00002 -0.00208 -0.00588 215 3PY 0.00003 0.00001 -0.00002 0.00016 0.00073 216 3PZ 0.00001 0.00000 -0.00001 0.00006 0.00032 217 4XX 0.00000 0.00000 -0.00000 0.00003 0.00019 218 4YY 0.00000 -0.00000 0.00000 -0.00000 -0.00001 219 4ZZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 220 4XY 0.00000 0.00000 -0.00000 0.00000 0.00002 221 4XZ 0.00000 -0.00000 -0.00000 0.00000 0.00001 222 4YZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 223 20 C 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 224 2S 0.00000 -0.00000 0.00000 -0.00001 -0.00002 225 2PX 0.00001 -0.00000 0.00000 -0.00002 -0.00005 226 2PY 0.00000 0.00000 0.00000 -0.00000 -0.00002 227 2PZ 0.00002 -0.00000 0.00000 -0.00000 -0.00000 228 3S 0.00001 -0.00000 0.00004 -0.00062 -0.00128 229 3PX 0.00002 -0.00000 0.00007 -0.00080 -0.00067 230 3PY 0.00001 0.00000 0.00001 -0.00013 -0.00044 231 3PZ 0.00018 -0.00001 0.00000 -0.00003 -0.00007 232 4XX -0.00000 -0.00000 0.00000 -0.00000 -0.00000 233 4YY -0.00000 0.00000 -0.00000 0.00000 0.00000 234 4ZZ 0.00000 -0.00000 -0.00000 0.00000 0.00000 235 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 236 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 237 4YZ 0.00000 0.00000 0.00000 0.00000 -0.00000 238 21 C 1S -0.00001 0.00000 -0.00000 0.00000 0.00000 239 2S 0.00018 -0.00001 0.00000 -0.00006 -0.00010 240 2PX 0.00037 -0.00003 0.00000 -0.00014 -0.00017 241 2PY 0.00001 0.00000 0.00000 -0.00011 -0.00011 242 2PZ 0.00103 0.00022 0.00000 -0.00003 -0.00001 243 3S 0.00012 -0.00001 -0.00001 -0.00068 -0.00184 244 3PX 0.00003 -0.00001 0.00009 -0.00155 -0.00147 245 3PY 0.00003 -0.00001 -0.00005 -0.00029 -0.00085 246 3PZ 0.00064 0.00016 -0.00001 -0.00007 -0.00009 247 4XX -0.00002 0.00000 0.00000 -0.00000 0.00000 248 4YY 0.00001 -0.00000 -0.00000 0.00001 0.00001 249 4ZZ 0.00001 0.00000 -0.00000 0.00000 0.00000 250 4XY 0.00001 -0.00000 -0.00000 0.00001 0.00001 251 4XZ -0.00009 -0.00001 -0.00000 0.00000 0.00000 252 4YZ -0.00000 0.00000 -0.00000 0.00000 0.00000 253 22 H 1S 0.00002 0.00001 -0.00000 0.00000 0.00000 254 2S 0.00005 0.00004 -0.00000 0.00008 0.00004 255 23 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 256 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 257 24 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 258 2S 0.00000 0.00000 -0.00000 0.00013 0.00040 259 25 H 1S -0.00000 -0.00000 0.00000 -0.00022 -0.00014 260 2S -0.00000 -0.00000 0.00021 -0.00301 -0.00130 261 26 H 1S 0.00002 -0.00000 -0.00215 0.03395 0.08985 262 2S 0.00006 -0.00006 -0.00073 0.00781 0.04561 263 27 H 1S 0.00001 0.00006 -0.00000 0.00000 0.00000 264 2S -0.00001 0.00014 -0.00000 0.00009 0.00000 181 182 183 184 185 181 2PY 0.39444 182 2PZ -0.00000 0.32263 183 3S 0.00000 0.00000 0.27885 184 3PX 0.00000 0.00000 0.00000 0.06578 185 3PY 0.09049 0.00000 0.00000 0.00000 0.07860 186 3PZ 0.00000 0.10185 0.00000 0.00000 0.00000 187 4XX 0.00000 0.00000 0.00298 0.00000 0.00000 188 4YY 0.00000 0.00000 -0.00302 0.00000 0.00000 189 4ZZ 0.00000 0.00000 -0.00652 0.00000 0.00000 190 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 191 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 192 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 193 18 C 1S -0.00087 -0.00029 0.00087 -0.00038 -0.00067 194 2S 0.01283 0.00428 0.00227 0.01198 0.00589 195 2PX 0.02548 0.00921 0.00929 0.00075 0.01369 196 2PY 0.00062 0.01105 0.00997 0.00405 0.00141 197 2PZ 0.01099 0.01031 0.00356 0.00259 0.00528 198 3S 0.00855 0.00331 -0.02108 0.00721 0.00247 199 3PX 0.00856 0.00318 -0.00152 -0.00024 0.00594 200 3PY 0.00105 0.00584 0.00539 -0.00022 0.00590 201 3PZ 0.00556 0.02126 0.00218 0.00122 0.00465 202 4XX 0.00145 0.00045 0.00189 -0.00107 0.00053 203 4YY -0.00046 0.00010 -0.00082 0.00043 -0.00068 204 4ZZ -0.00014 0.00005 -0.00044 -0.00003 0.00020 205 4XY 0.00010 0.00054 0.00057 0.00003 -0.00006 206 4XZ 0.00052 0.00025 0.00019 0.00001 0.00013 207 4YZ -0.00002 0.00028 -0.00001 0.00007 -0.00001 208 19 C 1S 0.00000 0.00000 -0.00004 -0.00002 0.00002 209 2S -0.00001 -0.00001 -0.00057 -0.00196 -0.00022 210 2PX -0.00004 -0.00002 -0.00224 -0.00391 -0.00099 211 2PY 0.00002 0.00000 -0.00049 -0.00047 0.00010 212 2PZ 0.00000 0.00007 -0.00018 -0.00013 0.00001 213 3S 0.00010 0.00001 0.00207 -0.00527 -0.00011 214 3PX 0.00000 -0.00003 -0.00278 -0.00542 -0.00075 215 3PY 0.00010 0.00002 -0.00055 0.00025 0.00003 216 3PZ 0.00002 0.00065 -0.00015 0.00021 0.00002 217 4XX 0.00001 0.00001 0.00030 0.00059 0.00003 218 4YY -0.00000 -0.00000 -0.00008 -0.00008 0.00002 219 4ZZ -0.00000 -0.00000 -0.00002 -0.00006 -0.00002 220 4XY -0.00000 0.00000 0.00003 0.00003 -0.00003 221 4XZ 0.00000 0.00002 0.00001 0.00002 0.00001 222 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 223 20 C 1S 0.00000 0.00000 0.00003 0.00009 0.00000 224 2S -0.00000 -0.00000 -0.00061 -0.00123 -0.00006 225 2PX -0.00002 -0.00000 -0.00114 -0.00135 -0.00023 226 2PY 0.00001 -0.00001 -0.00042 -0.00037 -0.00006 227 2PZ -0.00001 -0.00001 -0.00011 -0.00001 -0.00018 228 3S -0.00013 -0.00004 -0.00400 -0.00581 -0.00014 229 3PX -0.00020 -0.00003 -0.00355 -0.00256 -0.00006 230 3PY -0.00010 -0.00014 -0.00093 -0.00060 -0.00075 231 3PZ -0.00014 -0.00080 -0.00026 0.00012 -0.00057 232 4XX -0.00000 -0.00000 0.00002 0.00009 -0.00003 233 4YY -0.00000 0.00000 0.00001 -0.00001 0.00000 234 4ZZ 0.00000 0.00000 0.00001 0.00000 0.00001 235 4XY 0.00000 0.00000 -0.00001 -0.00002 -0.00000 236 4XZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 237 4YZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 238 21 C 1S 0.00000 0.00000 -0.00001 -0.00008 0.00008 239 2S -0.00017 -0.00005 -0.00079 0.00000 -0.00181 240 2PX -0.00027 -0.00006 -0.00166 0.00073 -0.00271 241 2PY -0.00006 -0.00022 -0.00167 0.00001 -0.00074 242 2PZ -0.00021 0.00004 -0.00042 0.00025 -0.00183 243 3S -0.00174 -0.00047 -0.00006 0.00029 -0.00479 244 3PX -0.00282 -0.00073 -0.00423 -0.00031 -0.00437 245 3PY 0.00135 -0.00106 -0.00054 0.00107 0.00086 246 3PZ -0.00099 -0.00051 0.00004 0.00093 -0.00320 247 4XX -0.00001 -0.00000 -0.00012 0.00001 -0.00018 248 4YY 0.00003 0.00001 0.00011 -0.00000 0.00023 249 4ZZ 0.00000 0.00000 0.00003 -0.00001 0.00005 250 4XY 0.00003 0.00003 0.00009 0.00008 0.00001 251 4XZ 0.00003 -0.00001 0.00003 0.00002 0.00011 252 4YZ 0.00001 0.00000 0.00002 0.00000 0.00003 253 22 H 1S 0.00000 0.00000 0.00006 -0.00000 0.00016 254 2S 0.00028 0.00008 0.00088 0.00015 0.00175 255 23 H 1S 0.00000 0.00000 0.00001 0.00001 0.00000 256 2S 0.00000 0.00000 0.00017 0.00022 0.00003 257 24 H 1S 0.00000 0.00000 0.00010 0.00020 0.00006 258 2S 0.00005 0.00002 0.00108 0.00183 0.00046 259 25 H 1S -0.00046 -0.00014 -0.00363 -0.00005 -0.00122 260 2S -0.00547 -0.00157 -0.00948 -0.00045 -0.00546 261 26 H 1S 0.01112 0.00213 0.04753 0.04652 0.00410 262 2S 0.00532 0.00082 0.02254 0.02858 0.00218 263 27 H 1S 0.00000 0.00000 0.00010 -0.00001 0.00016 264 2S 0.00033 0.00009 0.00131 -0.00005 0.00203 186 187 188 189 190 186 3PZ 0.10914 187 4XX 0.00000 0.00163 188 4YY 0.00000 -0.00024 0.00125 189 4ZZ 0.00000 -0.00009 0.00008 0.00103 190 4XY 0.00000 0.00000 -0.00000 -0.00000 0.00109 191 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 192 4YZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 193 18 C 1S -0.00021 -0.00007 0.00000 0.00001 -0.00015 194 2S 0.00192 0.00096 -0.00021 -0.00033 0.00161 195 2PX 0.00473 -0.00129 -0.00010 -0.00035 0.00137 196 2PY 0.00543 0.00199 -0.00052 -0.00029 0.00001 197 2PZ 0.02214 0.00067 -0.00009 0.00004 0.00068 198 3S 0.00138 0.00040 0.00011 -0.00026 0.00070 199 3PX 0.00220 -0.00044 -0.00011 -0.00012 0.00003 200 3PY 0.00511 0.00075 -0.00088 0.00005 0.00005 201 3PZ 0.03751 0.00029 0.00021 -0.00037 0.00014 202 4XX 0.00017 0.00015 -0.00015 -0.00005 -0.00008 203 4YY 0.00035 -0.00021 0.00003 0.00003 -0.00000 204 4ZZ -0.00035 -0.00005 0.00002 0.00001 -0.00001 205 4XY 0.00013 -0.00005 -0.00000 -0.00005 0.00002 206 4XZ 0.00027 -0.00001 -0.00003 0.00000 0.00002 207 4YZ 0.00021 -0.00006 0.00001 0.00000 0.00002 208 19 C 1S 0.00001 -0.00000 0.00000 0.00000 0.00000 209 2S -0.00010 0.00004 -0.00000 -0.00000 -0.00000 210 2PX -0.00040 0.00025 -0.00001 -0.00000 -0.00000 211 2PY 0.00002 -0.00001 0.00000 0.00000 0.00000 212 2PZ 0.00067 -0.00000 0.00000 0.00000 0.00000 213 3S -0.00011 0.00041 -0.00011 -0.00003 -0.00001 214 3PX -0.00035 0.00085 -0.00018 -0.00006 -0.00002 215 3PY 0.00003 -0.00004 -0.00001 0.00002 -0.00001 216 3PZ 0.00146 -0.00001 0.00003 -0.00002 0.00001 217 4XX 0.00002 0.00001 -0.00000 -0.00000 0.00000 218 4YY -0.00003 -0.00000 0.00000 0.00000 0.00000 219 4ZZ 0.00002 -0.00000 0.00000 0.00000 -0.00000 220 4XY 0.00001 -0.00000 0.00000 0.00000 0.00000 221 4XZ 0.00016 -0.00000 0.00000 0.00000 0.00000 222 4YZ -0.00001 -0.00000 -0.00000 -0.00000 0.00000 223 20 C 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 224 2S -0.00001 -0.00000 0.00000 0.00000 -0.00000 225 2PX -0.00003 -0.00000 0.00000 0.00000 -0.00000 226 2PY -0.00019 -0.00000 0.00000 0.00000 0.00000 227 2PZ -0.00076 -0.00000 0.00000 -0.00000 0.00000 228 3S -0.00005 0.00000 0.00002 0.00001 -0.00001 229 3PX 0.00006 0.00004 -0.00001 0.00001 -0.00002 230 3PY -0.00059 -0.00004 0.00001 0.00000 -0.00000 231 3PZ -0.00411 -0.00001 0.00000 0.00000 0.00000 232 4XX -0.00001 0.00000 -0.00000 -0.00000 0.00000 233 4YY 0.00002 -0.00000 0.00000 -0.00000 -0.00000 234 4ZZ -0.00001 -0.00000 -0.00000 0.00000 0.00000 235 4XY -0.00000 0.00000 -0.00000 0.00000 0.00000 236 4XZ -0.00002 0.00000 0.00000 0.00000 0.00000 237 4YZ 0.00000 -0.00000 -0.00000 -0.00000 0.00000 238 21 C 1S 0.00002 -0.00000 0.00000 0.00000 -0.00000 239 2S -0.00051 0.00001 -0.00000 0.00000 0.00001 240 2PX -0.00070 0.00002 0.00000 -0.00000 0.00005 241 2PY -0.00205 0.00001 -0.00001 0.00001 0.00003 242 2PZ -0.00041 0.00000 0.00002 -0.00000 0.00000 243 3S -0.00140 0.00009 -0.00003 0.00000 0.00013 244 3PX -0.00113 0.00021 -0.00008 -0.00001 0.00010 245 3PY -0.00365 -0.00002 -0.00010 0.00013 0.00012 246 3PZ -0.00358 -0.00000 0.00020 -0.00009 0.00001 247 4XX -0.00006 0.00000 0.00000 0.00000 0.00000 248 4YY 0.00005 -0.00000 0.00000 0.00000 -0.00000 249 4ZZ 0.00003 -0.00000 0.00000 -0.00000 -0.00000 250 4XY 0.00010 -0.00000 0.00000 0.00000 0.00000 251 4XZ 0.00002 -0.00000 0.00000 -0.00000 0.00000 252 4YZ -0.00001 -0.00000 0.00000 -0.00000 0.00000 253 22 H 1S 0.00004 -0.00000 -0.00000 -0.00000 -0.00000 254 2S 0.00050 -0.00001 0.00000 -0.00000 -0.00000 255 23 H 1S 0.00000 0.00000 -0.00000 -0.00000 0.00000 256 2S 0.00001 0.00000 -0.00000 -0.00000 0.00000 257 24 H 1S 0.00002 -0.00000 0.00000 -0.00000 0.00000 258 2S 0.00016 -0.00002 0.00000 -0.00000 0.00000 259 25 H 1S -0.00032 -0.00003 0.00008 0.00001 0.00002 260 2S -0.00135 -0.00054 0.00069 0.00020 0.00001 261 26 H 1S 0.00072 0.00543 -0.00107 -0.00083 0.00165 262 2S 0.00018 0.00408 -0.00159 -0.00088 0.00029 263 27 H 1S 0.00004 -0.00000 -0.00000 -0.00000 -0.00000 264 2S 0.00053 -0.00000 -0.00000 -0.00000 -0.00000 191 192 193 194 195 191 4XZ 0.00057 192 4YZ -0.00000 0.00059 193 18 C 1S -0.00005 -0.00002 2.05285 194 2S 0.00052 0.00014 -0.01400 0.33169 195 2PX 0.00044 0.00028 0.00000 0.00000 0.41799 196 2PY 0.00068 -0.00005 0.00000 0.00000 0.00000 197 2PZ 0.00052 0.00027 0.00000 0.00000 -0.00000 198 3S 0.00023 0.00005 -0.03164 0.21481 0.00000 199 3PX 0.00001 0.00002 0.00000 0.00000 0.06299 200 3PY 0.00014 0.00001 0.00000 0.00000 -0.00000 201 3PZ 0.00051 0.00022 0.00000 0.00000 0.00000 202 4XX -0.00002 -0.00004 -0.00130 -0.00307 0.00000 203 4YY 0.00003 0.00001 -0.00150 -0.00036 0.00000 204 4ZZ 0.00001 0.00000 -0.00107 -0.00814 0.00000 205 4XY 0.00002 0.00000 -0.00000 0.00000 0.00000 206 4XZ -0.00000 -0.00001 -0.00000 0.00000 0.00000 207 4YZ 0.00000 -0.00001 0.00000 -0.00000 0.00000 208 19 C 1S 0.00000 0.00000 0.00000 -0.00048 -0.00227 209 2S -0.00000 -0.00000 -0.00048 0.01011 0.03610 210 2PX 0.00000 -0.00000 -0.00229 0.03535 0.07291 211 2PY 0.00000 -0.00000 -0.00026 0.00433 0.01295 212 2PZ 0.00001 0.00000 -0.00006 0.00098 0.00265 213 3S -0.00000 -0.00000 0.00050 0.00497 0.02734 214 3PX -0.00001 -0.00000 -0.00093 0.01779 0.01197 215 3PY 0.00001 -0.00000 -0.00015 0.00056 0.00611 216 3PZ 0.00011 0.00001 -0.00003 0.00009 0.00128 217 4XX 0.00000 -0.00000 -0.00019 0.00263 0.00045 218 4YY -0.00000 -0.00000 0.00001 -0.00045 -0.00109 219 4ZZ -0.00000 -0.00000 0.00000 -0.00036 -0.00076 220 4XY 0.00000 -0.00000 -0.00007 0.00082 0.00142 221 4XZ 0.00000 0.00000 -0.00002 0.00019 0.00032 222 4YZ -0.00000 0.00000 -0.00000 -0.00001 -0.00004 223 20 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 224 2S -0.00000 0.00000 0.00000 -0.00007 -0.00016 225 2PX -0.00000 -0.00000 0.00000 -0.00011 -0.00017 226 2PY 0.00000 0.00000 0.00000 -0.00017 -0.00028 227 2PZ 0.00000 -0.00000 0.00000 -0.00005 -0.00008 228 3S -0.00000 -0.00000 -0.00004 -0.00026 -0.00015 229 3PX -0.00001 -0.00000 -0.00007 -0.00000 0.00050 230 3PY 0.00000 -0.00000 0.00006 -0.00148 -0.00098 231 3PZ -0.00000 -0.00000 0.00002 -0.00041 -0.00028 232 4XX 0.00000 -0.00000 -0.00000 0.00001 0.00002 233 4YY 0.00000 -0.00000 0.00000 -0.00000 0.00001 234 4ZZ 0.00000 -0.00000 0.00000 0.00000 -0.00000 235 4XY 0.00000 -0.00000 -0.00000 0.00002 0.00006 236 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00002 237 4YZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 238 21 C 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 239 2S 0.00000 -0.00000 0.00000 -0.00001 -0.00000 240 2PX 0.00001 -0.00000 0.00000 -0.00000 -0.00000 241 2PY 0.00000 0.00001 0.00000 -0.00002 -0.00001 242 2PZ 0.00000 -0.00000 0.00000 -0.00001 -0.00000 243 3S 0.00004 -0.00001 0.00004 -0.00069 -0.00017 244 3PX 0.00003 -0.00004 0.00000 -0.00001 -0.00012 245 3PY 0.00002 0.00004 0.00008 -0.00114 -0.00004 246 3PZ -0.00001 0.00001 0.00002 -0.00034 0.00001 247 4XX 0.00000 0.00000 -0.00000 0.00000 0.00000 248 4YY -0.00000 0.00000 0.00000 -0.00000 -0.00000 249 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 250 4XY 0.00000 0.00000 0.00000 -0.00000 -0.00000 251 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 252 4YZ -0.00000 0.00000 0.00000 -0.00000 -0.00000 253 22 H 1S -0.00000 0.00000 -0.00000 0.00000 -0.00000 254 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 255 23 H 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 256 2S 0.00000 -0.00000 -0.00000 0.00010 0.00029 257 24 H 1S 0.00000 0.00000 0.00000 -0.00019 -0.00072 258 2S 0.00000 0.00000 0.00018 -0.00252 -0.00852 259 25 H 1S 0.00001 0.00004 -0.00210 0.03336 0.00228 260 2S -0.00000 0.00012 -0.00131 0.01324 0.00133 261 26 H 1S 0.00033 -0.00002 0.00000 -0.00021 -0.00071 262 2S 0.00007 -0.00001 0.00021 -0.00286 -0.00907 263 27 H 1S -0.00000 -0.00000 0.00000 -0.00000 -0.00000 264 2S -0.00000 0.00000 0.00000 -0.00000 -0.00000 196 197 198 199 200 196 2PY 0.41417 197 2PZ -0.00000 0.35040 198 3S 0.00000 0.00000 0.24721 199 3PX 0.00000 0.00000 0.00000 0.03535 200 3PY 0.09340 0.00000 0.00000 -0.00000 0.07525 201 3PZ 0.00000 0.11056 0.00000 0.00000 0.00000 202 4XX 0.00000 0.00000 -0.00334 0.00000 0.00000 203 4YY 0.00000 0.00000 0.00163 0.00000 0.00000 204 4ZZ 0.00000 0.00000 -0.00477 0.00000 0.00000 205 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 206 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 207 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 208 19 C 1S -0.00029 -0.00006 0.00049 -0.00101 -0.00007 209 2S 0.00436 0.00094 0.00578 0.01407 0.00344 210 2PX 0.01289 0.00259 0.03087 0.01032 0.00338 211 2PY 0.00109 0.00190 0.00068 0.00540 0.00685 212 2PZ 0.00191 0.01283 0.00011 0.00111 0.00097 213 3S 0.00512 0.00129 -0.01274 0.01041 0.00435 214 3PX 0.00332 0.00060 0.01617 0.00045 0.00121 215 3PY 0.00600 0.00093 -0.00172 0.00308 0.01118 216 3PZ 0.00097 0.02052 -0.00043 0.00059 0.00093 217 4XX 0.00150 0.00034 0.00207 0.00049 0.00036 218 4YY 0.00003 -0.00004 -0.00072 -0.00097 -0.00031 219 4ZZ -0.00013 0.00003 -0.00054 -0.00059 -0.00003 220 4XY 0.00058 0.00006 0.00045 0.00010 0.00044 221 4XZ 0.00006 0.00147 0.00011 0.00002 0.00003 222 4YZ 0.00003 0.00019 -0.00001 -0.00001 0.00000 223 20 C 1S 0.00000 0.00000 -0.00004 0.00008 -0.00005 224 2S -0.00014 -0.00004 -0.00023 -0.00161 -0.00029 225 2PX -0.00011 -0.00003 -0.00198 -0.00172 -0.00032 226 2PY -0.00019 -0.00010 -0.00052 -0.00167 0.00062 227 2PZ -0.00010 0.00000 -0.00015 -0.00043 -0.00029 228 3S -0.00195 -0.00059 0.00358 -0.00171 -0.00180 229 3PX 0.00046 0.00011 -0.00143 -0.00064 0.00063 230 3PY -0.00149 -0.00123 -0.00174 -0.00153 -0.00016 231 3PZ -0.00119 -0.00005 -0.00060 -0.00039 -0.00174 232 4XX 0.00001 0.00000 0.00006 0.00020 -0.00002 233 4YY -0.00001 0.00003 -0.00002 -0.00004 -0.00013 234 4ZZ 0.00001 -0.00000 0.00000 -0.00001 0.00019 235 4XY 0.00003 0.00001 0.00013 0.00010 0.00007 236 4XZ 0.00001 0.00000 0.00004 0.00003 0.00001 237 4YZ 0.00001 -0.00001 -0.00001 -0.00002 0.00005 238 21 C 1S 0.00000 0.00000 0.00004 0.00000 0.00007 239 2S -0.00002 -0.00001 -0.00072 -0.00005 -0.00079 240 2PX -0.00001 -0.00000 -0.00006 -0.00030 -0.00003 241 2PY 0.00002 -0.00009 -0.00119 -0.00011 0.00066 242 2PZ -0.00009 0.00005 -0.00037 -0.00002 -0.00178 243 3S -0.00125 -0.00036 -0.00502 -0.00030 -0.00396 244 3PX -0.00011 -0.00001 -0.00009 -0.00055 -0.00010 245 3PY 0.00005 -0.00194 -0.00514 0.00004 0.00179 246 3PZ -0.00202 0.00055 -0.00163 0.00005 -0.00591 247 4XX 0.00000 0.00000 0.00002 0.00000 0.00001 248 4YY -0.00000 0.00000 0.00001 -0.00001 0.00001 249 4ZZ 0.00000 -0.00000 0.00002 -0.00000 0.00002 250 4XY -0.00000 -0.00000 -0.00000 -0.00002 -0.00001 251 4XZ -0.00000 -0.00000 -0.00000 -0.00001 -0.00000 252 4YZ -0.00000 -0.00000 -0.00001 -0.00000 -0.00000 253 22 H 1S 0.00000 0.00000 0.00001 -0.00000 0.00000 254 2S -0.00001 -0.00000 0.00010 0.00001 -0.00001 255 23 H 1S 0.00000 0.00000 0.00007 0.00020 0.00001 256 2S 0.00010 0.00003 0.00082 0.00188 0.00023 257 24 H 1S -0.00000 -0.00000 -0.00402 -0.00230 0.00003 258 2S -0.00008 -0.00005 -0.01101 -0.00783 0.00000 259 25 H 1S 0.07696 0.02173 0.04490 0.00103 0.03899 260 2S 0.04069 0.01162 0.02746 0.00096 0.03005 261 26 H 1S -0.00002 -0.00001 -0.00319 -0.00128 -0.00002 262 2S -0.00030 -0.00006 -0.00966 -0.00744 -0.00049 263 27 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 264 2S -0.00000 -0.00000 -0.00003 -0.00003 -0.00005 201 202 203 204 205 201 3PZ 0.11587 202 4XX 0.00000 0.00129 203 4YY 0.00000 -0.00023 0.00126 204 4ZZ 0.00000 0.00001 0.00006 0.00078 205 4XY 0.00000 -0.00000 0.00000 -0.00000 0.00103 206 4XZ 0.00000 -0.00000 0.00000 -0.00000 -0.00000 207 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 208 19 C 1S -0.00001 -0.00020 0.00001 0.00000 -0.00007 209 2S 0.00079 0.00272 -0.00047 -0.00037 0.00084 210 2PX 0.00058 0.00014 -0.00083 -0.00076 0.00186 211 2PY 0.00094 0.00124 0.00003 -0.00004 0.00045 212 2PZ 0.02106 0.00030 -0.00000 0.00004 0.00001 213 3S 0.00121 0.00342 -0.00145 -0.00075 0.00025 214 3PX 0.00015 0.00000 -0.00067 -0.00063 0.00013 215 3PY 0.00089 0.00060 -0.00032 0.00008 0.00020 216 3PZ 0.03225 0.00014 0.00007 -0.00010 0.00002 217 4XX 0.00006 0.00011 -0.00010 -0.00006 -0.00009 218 4YY 0.00005 -0.00007 0.00002 0.00001 -0.00000 219 4ZZ -0.00009 -0.00005 0.00001 0.00001 -0.00002 220 4XY 0.00003 -0.00012 -0.00000 0.00000 -0.00006 221 4XZ 0.00094 -0.00003 0.00002 0.00001 0.00002 222 4YZ 0.00010 0.00000 -0.00000 0.00000 -0.00000 223 20 C 1S -0.00002 0.00000 -0.00000 -0.00000 -0.00000 224 2S -0.00006 -0.00001 0.00001 0.00000 0.00001 225 2PX -0.00002 0.00000 0.00001 0.00000 0.00002 226 2PY -0.00023 -0.00001 0.00003 0.00000 0.00003 227 2PZ -0.00017 -0.00000 0.00001 0.00000 0.00004 228 3S -0.00059 -0.00010 0.00013 0.00003 0.00011 229 3PX 0.00021 0.00004 -0.00002 -0.00002 0.00005 230 3PY -0.00171 -0.00012 0.00020 0.00006 0.00001 231 3PZ -0.00104 -0.00005 0.00009 0.00001 0.00013 232 4XX -0.00001 0.00000 -0.00000 -0.00000 -0.00000 233 4YY 0.00025 0.00000 -0.00000 0.00000 0.00000 234 4ZZ -0.00011 0.00000 0.00000 -0.00000 -0.00000 235 4XY 0.00001 -0.00000 -0.00000 -0.00000 0.00000 236 4XZ -0.00001 -0.00000 0.00000 -0.00000 0.00000 237 4YZ 0.00002 0.00000 0.00000 -0.00000 0.00000 238 21 C 1S 0.00002 -0.00000 0.00000 -0.00000 0.00000 239 2S -0.00025 0.00000 -0.00000 0.00000 -0.00000 240 2PX -0.00001 0.00000 -0.00000 -0.00000 -0.00000 241 2PY -0.00173 0.00000 -0.00000 -0.00000 -0.00000 242 2PZ 0.00054 -0.00000 -0.00000 0.00000 0.00000 243 3S -0.00117 0.00002 0.00001 0.00001 -0.00000 244 3PX 0.00005 0.00000 -0.00001 -0.00000 -0.00002 245 3PY -0.00553 -0.00000 0.00007 0.00000 -0.00001 246 3PZ 0.00018 -0.00001 -0.00001 0.00002 0.00001 247 4XX 0.00000 0.00000 -0.00000 -0.00000 0.00000 248 4YY 0.00001 -0.00000 0.00000 0.00000 0.00000 249 4ZZ 0.00000 -0.00000 0.00000 -0.00000 0.00000 250 4XY -0.00000 0.00000 0.00000 0.00000 -0.00000 251 4XZ 0.00000 0.00000 0.00000 -0.00000 0.00000 252 4YZ -0.00000 -0.00000 0.00000 0.00000 0.00000 253 22 H 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 254 2S 0.00002 -0.00000 0.00000 0.00000 0.00000 255 23 H 1S 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 256 2S 0.00004 0.00000 -0.00001 -0.00000 -0.00000 257 24 H 1S 0.00001 0.00010 -0.00000 -0.00000 0.00001 258 2S -0.00002 0.00041 -0.00012 0.00002 0.00004 259 25 H 1S 0.01098 -0.00124 0.00404 -0.00024 0.00030 260 2S 0.00861 -0.00266 0.00368 0.00044 0.00005 261 26 H 1S -0.00001 0.00015 -0.00001 -0.00000 -0.00001 262 2S 0.00001 0.00082 -0.00030 -0.00003 -0.00007 263 27 H 1S -0.00000 -0.00000 0.00000 0.00000 0.00000 264 2S -0.00002 -0.00000 0.00000 0.00000 -0.00000 206 207 208 209 210 206 4XZ 0.00061 207 4YZ 0.00000 0.00077 208 19 C 1S -0.00002 0.00000 2.05387 209 2S 0.00019 -0.00001 -0.01513 0.34654 210 2PX 0.00044 0.00000 0.00000 0.00000 0.44605 211 2PY 0.00001 0.00002 0.00000 0.00000 -0.00000 212 2PZ 0.00098 0.00024 0.00000 0.00000 -0.00000 213 3S 0.00005 -0.00002 -0.03227 0.22619 0.00000 214 3PX 0.00003 -0.00000 0.00000 0.00000 0.08203 215 3PY 0.00002 0.00001 0.00000 0.00000 -0.00000 216 3PZ 0.00057 0.00013 0.00000 0.00000 -0.00000 217 4XX -0.00003 -0.00000 -0.00150 0.00020 0.00000 218 4YY -0.00001 -0.00000 -0.00131 -0.00332 0.00000 219 4ZZ -0.00000 -0.00000 -0.00102 -0.00907 0.00000 220 4XY 0.00002 -0.00001 0.00000 -0.00000 0.00000 221 4XZ -0.00005 -0.00000 0.00000 -0.00000 0.00000 222 4YZ -0.00002 0.00000 0.00000 -0.00000 0.00000 223 20 C 1S -0.00000 -0.00000 0.00000 -0.00049 -0.00007 224 2S 0.00000 0.00000 -0.00049 0.01023 0.00136 225 2PX 0.00000 0.00001 -0.00009 0.00122 0.00036 226 2PY 0.00004 0.00002 -0.00199 0.03143 0.00335 227 2PZ -0.00001 0.00000 -0.00058 0.00922 0.00084 228 3S 0.00003 0.00002 0.00050 0.00556 -0.00064 229 3PX 0.00001 -0.00000 0.00001 0.00143 0.00507 230 3PY 0.00013 0.00004 -0.00086 0.01333 0.00157 231 3PZ 0.00003 -0.00000 -0.00026 0.00388 0.00039 232 4XX -0.00000 -0.00000 0.00001 -0.00060 0.00005 233 4YY 0.00000 0.00000 -0.00014 0.00205 0.00029 234 4ZZ -0.00000 -0.00000 -0.00000 -0.00007 0.00003 235 4XY 0.00000 0.00000 -0.00002 0.00022 0.00121 236 4XZ -0.00000 -0.00000 -0.00001 0.00007 0.00035 237 4YZ -0.00000 -0.00000 -0.00011 0.00123 0.00014 238 21 C 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 239 2S -0.00000 -0.00000 0.00000 -0.00010 -0.00003 240 2PX -0.00000 -0.00000 0.00000 -0.00007 -0.00001 241 2PY 0.00000 -0.00000 0.00000 -0.00027 -0.00003 242 2PZ -0.00000 0.00000 0.00000 -0.00009 -0.00001 243 3S -0.00000 -0.00001 -0.00004 -0.00045 -0.00151 244 3PX -0.00001 -0.00000 0.00006 -0.00092 0.00025 245 3PY 0.00001 -0.00000 -0.00004 -0.00099 -0.00098 246 3PZ -0.00000 0.00001 -0.00001 -0.00034 -0.00031 247 4XX 0.00000 -0.00000 0.00000 -0.00001 0.00000 248 4YY 0.00000 0.00000 -0.00000 0.00003 -0.00000 249 4ZZ -0.00000 -0.00000 -0.00000 0.00000 -0.00000 250 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 251 4XZ -0.00000 0.00000 -0.00000 0.00000 0.00000 252 4YZ -0.00000 0.00000 -0.00000 0.00001 -0.00000 253 22 H 1S 0.00000 0.00000 -0.00000 0.00000 -0.00000 254 2S 0.00000 0.00000 -0.00000 0.00012 -0.00001 255 23 H 1S -0.00000 -0.00000 0.00000 -0.00019 -0.00024 256 2S -0.00000 -0.00000 0.00019 -0.00260 -0.00342 257 24 H 1S 0.00000 -0.00000 -0.00206 0.03299 0.06090 258 2S 0.00002 -0.00000 -0.00103 0.01045 0.03188 259 25 H 1S 0.00009 0.00241 0.00000 -0.00019 -0.00034 260 2S 0.00002 0.00036 0.00019 -0.00266 -0.00388 261 26 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 262 2S -0.00002 -0.00001 -0.00000 0.00012 0.00046 263 27 H 1S -0.00000 0.00000 0.00000 -0.00000 -0.00000 264 2S -0.00000 0.00000 -0.00000 0.00000 0.00000 211 212 213 214 215 211 2PY 0.40430 212 2PZ -0.00000 0.31180 213 3S 0.00000 0.00000 0.24819 214 3PX -0.00000 -0.00000 0.00000 0.05137 215 3PY 0.08288 0.00000 0.00000 -0.00000 0.06129 216 3PZ 0.00000 0.09257 0.00000 -0.00000 0.00000 217 4XX 0.00000 0.00000 0.00092 0.00000 0.00000 218 4YY 0.00000 0.00000 -0.00215 0.00000 0.00000 219 4ZZ 0.00000 0.00000 -0.00587 0.00000 0.00000 220 4XY 0.00000 0.00000 -0.00000 0.00000 0.00000 221 4XZ 0.00000 0.00000 -0.00000 0.00000 0.00000 222 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 223 20 C 1S -0.00199 -0.00058 0.00047 -0.00005 -0.00083 224 2S 0.03086 0.00899 0.00537 -0.00030 0.01482 225 2PX 0.00325 0.00081 0.00213 0.00453 0.00048 226 2PY 0.04152 0.03599 0.02403 0.00185 0.00402 227 2PZ 0.03603 0.00068 0.00711 0.00046 0.01562 228 3S 0.02481 0.00724 -0.01165 -0.00154 0.01246 229 3PX 0.00045 0.00004 0.00236 0.00613 0.00002 230 3PY 0.00339 0.01499 0.01039 0.00096 -0.00011 231 3PZ 0.01522 0.01051 0.00319 0.00019 0.01159 232 4XX -0.00109 -0.00033 -0.00188 -0.00011 -0.00112 233 4YY -0.00017 0.00146 0.00261 0.00022 -0.00033 234 4ZZ -0.00004 -0.00013 0.00025 0.00007 0.00051 235 4XY 0.00040 0.00032 0.00002 0.00034 0.00002 236 4XZ 0.00032 -0.00000 0.00001 0.00010 0.00005 237 4YZ 0.00139 -0.00002 0.00045 0.00002 0.00009 238 21 C 1S 0.00000 0.00000 -0.00005 -0.00006 0.00003 239 2S -0.00031 -0.00010 -0.00032 0.00042 -0.00168 240 2PX -0.00018 -0.00005 -0.00003 -0.00010 -0.00055 241 2PY -0.00070 0.00001 -0.00277 0.00131 -0.00363 242 2PZ 0.00000 -0.00015 -0.00079 0.00043 -0.00038 243 3S -0.00107 -0.00035 0.00267 -0.00126 -0.00159 244 3PX -0.00231 -0.00075 -0.00108 0.00029 -0.00205 245 3PY -0.00139 0.00050 -0.00370 0.00053 -0.00280 246 3PZ 0.00029 -0.00009 -0.00100 0.00019 -0.00010 247 4XX -0.00002 -0.00001 -0.00018 0.00001 -0.00021 248 4YY 0.00008 0.00007 0.00027 -0.00006 0.00026 249 4ZZ 0.00003 -0.00000 0.00006 -0.00002 0.00025 250 4XY 0.00001 0.00003 0.00002 -0.00001 -0.00004 251 4XZ 0.00003 -0.00001 0.00000 -0.00000 0.00008 252 4YZ 0.00008 0.00000 0.00008 -0.00001 0.00016 253 22 H 1S 0.00000 0.00000 0.00009 -0.00003 0.00021 254 2S 0.00035 0.00011 0.00099 -0.00018 0.00185 255 23 H 1S -0.00037 -0.00010 -0.00360 -0.00063 -0.00139 256 2S -0.00435 -0.00121 -0.00960 -0.00316 -0.00453 257 24 H 1S 0.03155 0.01030 0.04535 0.03037 0.01566 258 2S 0.01655 0.00538 0.02413 0.02305 0.01188 259 25 H 1S -0.00030 -0.00008 -0.00369 -0.00139 -0.00083 260 2S -0.00400 -0.00109 -0.01001 -0.00423 -0.00371 261 26 H 1S 0.00000 -0.00000 0.00009 0.00024 0.00000 262 2S 0.00000 -0.00000 0.00106 0.00237 0.00003 263 27 H 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 264 2S -0.00000 0.00000 -0.00000 -0.00000 0.00000 216 217 218 219 220 216 3PZ 0.09253 217 4XX 0.00000 0.00122 218 4YY 0.00000 -0.00015 0.00106 219 4ZZ 0.00000 -0.00003 0.00005 0.00093 220 4XY 0.00000 -0.00000 0.00000 0.00000 0.00148 221 4XZ 0.00000 -0.00000 -0.00000 0.00000 -0.00000 222 4YZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 223 20 C 1S -0.00024 0.00001 -0.00014 -0.00000 -0.00002 224 2S 0.00436 -0.00057 0.00198 -0.00008 0.00021 225 2PX 0.00006 0.00005 0.00035 -0.00000 0.00129 226 2PY 0.01552 -0.00122 -0.00050 0.00030 0.00022 227 2PZ 0.00983 -0.00035 0.00206 -0.00018 0.00015 228 3S 0.00359 -0.00145 0.00207 0.00016 0.00016 229 3PX -0.00009 -0.00006 0.00003 -0.00004 0.00043 230 3PY 0.01133 -0.00134 -0.00055 0.00105 0.00001 231 3PZ 0.02237 -0.00039 0.00160 -0.00074 0.00002 232 4XX -0.00035 0.00003 -0.00001 0.00001 -0.00001 233 4YY 0.00104 -0.00001 -0.00003 -0.00006 -0.00001 234 4ZZ -0.00051 0.00001 -0.00006 0.00000 -0.00002 235 4XY 0.00005 0.00000 -0.00003 -0.00000 -0.00014 236 4XZ 0.00003 0.00000 0.00001 -0.00000 -0.00006 237 4YZ 0.00016 -0.00002 0.00002 -0.00000 -0.00002 238 21 C 1S 0.00001 0.00000 -0.00000 -0.00000 -0.00000 239 2S -0.00053 -0.00000 0.00001 0.00000 0.00002 240 2PX -0.00012 -0.00000 0.00002 0.00000 0.00001 241 2PY -0.00036 -0.00000 0.00000 0.00003 0.00005 242 2PZ -0.00014 -0.00000 0.00008 -0.00001 0.00001 243 3S -0.00042 -0.00007 0.00013 0.00003 0.00009 244 3PX -0.00073 0.00004 0.00004 0.00002 -0.00003 245 3PY 0.00022 -0.00008 -0.00013 0.00032 0.00009 246 3PZ 0.00049 -0.00003 0.00051 -0.00018 -0.00002 247 4XX -0.00005 0.00000 -0.00000 0.00000 -0.00000 248 4YY 0.00036 -0.00000 -0.00000 0.00000 -0.00000 249 4ZZ -0.00008 -0.00000 0.00000 -0.00000 -0.00000 250 4XY 0.00008 -0.00000 0.00000 0.00000 0.00000 251 4XZ -0.00001 -0.00000 0.00000 -0.00000 0.00000 252 4YZ -0.00000 -0.00000 0.00000 -0.00000 0.00000 253 22 H 1S 0.00006 -0.00000 -0.00000 -0.00000 -0.00000 254 2S 0.00060 -0.00000 -0.00000 -0.00000 -0.00000 255 23 H 1S -0.00040 0.00002 -0.00000 0.00000 0.00008 256 2S -0.00129 0.00038 -0.00024 -0.00001 0.00026 257 24 H 1S 0.00509 0.00175 -0.00028 -0.00067 0.00343 258 2S 0.00382 0.00171 -0.00008 -0.00039 0.00062 259 25 H 1S -0.00024 -0.00003 0.00004 0.00001 0.00007 260 2S -0.00103 -0.00051 0.00046 0.00015 0.00018 261 26 H 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 262 2S -0.00001 -0.00001 -0.00000 -0.00000 0.00000 263 27 H 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 264 2S 0.00000 -0.00000 0.00000 0.00000 -0.00000 221 222 223 224 225 221 4XZ 0.00079 222 4YZ 0.00000 0.00058 223 20 C 1S -0.00001 -0.00011 2.05282 224 2S 0.00006 0.00120 -0.01395 0.33116 225 2PX 0.00038 0.00021 0.00000 0.00000 0.43813 226 2PY 0.00015 0.00162 0.00000 0.00000 0.00000 227 2PZ -0.00000 -0.00004 0.00000 0.00000 0.00000 228 3S 0.00005 0.00036 -0.03149 0.21292 0.00000 229 3PX 0.00013 0.00001 0.00000 0.00000 0.08245 230 3PY 0.00003 0.00012 0.00000 0.00000 0.00000 231 3PZ 0.00001 0.00025 0.00000 0.00000 0.00000 232 4XX -0.00000 -0.00002 -0.00164 0.00226 0.00000 233 4YY -0.00003 0.00002 -0.00124 -0.00451 0.00000 234 4ZZ 0.00000 -0.00000 -0.00100 -0.00928 0.00000 235 4XY -0.00006 0.00000 -0.00000 0.00000 0.00000 236 4XZ -0.00000 -0.00000 -0.00000 0.00000 0.00000 237 4YZ 0.00000 0.00001 0.00000 -0.00000 0.00000 238 21 C 1S -0.00000 -0.00000 0.00000 -0.00059 -0.00183 239 2S 0.00000 0.00001 -0.00059 0.01174 0.02682 240 2PX 0.00000 0.00001 -0.00179 0.02608 0.02741 241 2PY 0.00000 0.00007 -0.00093 0.01333 0.02601 242 2PZ 0.00001 -0.00002 -0.00031 0.00447 0.00927 243 3S 0.00003 0.00004 0.00081 0.00335 0.01914 244 3PX -0.00001 0.00001 -0.00112 0.01146 0.00075 245 3PY -0.00002 0.00016 -0.00014 0.00642 0.00499 246 3PZ 0.00001 -0.00002 -0.00006 0.00214 0.00207 247 4XX -0.00000 -0.00000 -0.00007 0.00083 -0.00176 248 4YY -0.00000 0.00000 -0.00000 -0.00014 0.00059 249 4ZZ -0.00000 -0.00000 0.00001 -0.00032 -0.00033 250 4XY 0.00000 0.00000 -0.00015 0.00160 0.00149 251 4XZ 0.00000 -0.00000 -0.00005 0.00053 0.00048 252 4YZ -0.00000 0.00000 -0.00002 0.00016 0.00059 253 22 H 1S -0.00000 -0.00000 0.00000 -0.00020 -0.00012 254 2S -0.00000 -0.00000 0.00019 -0.00271 -0.00132 255 23 H 1S 0.00002 -0.00001 -0.00211 0.03342 0.08914 256 2S 0.00007 -0.00006 -0.00131 0.01312 0.04710 257 24 H 1S 0.00110 0.00033 0.00000 -0.00019 -0.00006 258 2S 0.00020 0.00003 0.00018 -0.00252 -0.00086 259 25 H 1S 0.00002 0.00001 -0.00000 0.00000 0.00000 260 2S 0.00005 0.00006 -0.00000 0.00010 0.00006 261 26 H 1S -0.00000 0.00000 -0.00000 0.00000 0.00000 262 2S -0.00000 0.00000 0.00000 -0.00000 -0.00001 263 27 H 1S 0.00000 0.00000 -0.00000 0.00000 0.00000 264 2S -0.00000 0.00000 -0.00000 0.00000 0.00002 226 227 228 229 230 226 2PY 0.39801 227 2PZ -0.00000 0.34775 228 3S 0.00000 0.00000 0.24216 229 3PX 0.00000 0.00000 0.00000 0.05359 230 3PY 0.07808 0.00000 0.00000 0.00000 0.05960 231 3PZ 0.00000 0.10685 0.00000 0.00000 0.00000 232 4XX 0.00000 0.00000 0.00321 0.00000 0.00000 233 4YY 0.00000 0.00000 -0.00353 0.00000 0.00000 234 4ZZ 0.00000 0.00000 -0.00609 0.00000 0.00000 235 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 236 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 237 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 238 21 C 1S -0.00091 -0.00031 0.00049 -0.00048 -0.00057 239 2S 0.01410 0.00474 0.00603 0.01311 0.00537 240 2PX 0.02662 0.00940 0.01965 0.00089 0.00861 241 2PY 0.00087 0.01168 0.01077 0.00585 0.00217 242 2PZ 0.01168 0.00960 0.00359 0.00232 0.00539 243 3S 0.00369 0.00140 -0.02206 0.00778 -0.00203 244 3PX 0.01279 0.00447 0.00779 -0.00264 0.00554 245 3PY 0.00265 0.00528 0.00405 0.00039 0.00956 246 3PZ 0.00534 0.02179 0.00132 0.00050 0.00457 247 4XX 0.00119 0.00040 0.00172 -0.00100 0.00048 248 4YY -0.00051 0.00009 -0.00067 0.00038 -0.00071 249 4ZZ -0.00011 0.00004 -0.00048 -0.00012 0.00029 250 4XY 0.00003 0.00066 0.00064 0.00003 0.00001 251 4XZ 0.00064 0.00042 0.00021 0.00001 0.00015 252 4YZ -0.00004 0.00029 -0.00000 0.00006 -0.00001 253 22 H 1S -0.00047 -0.00015 -0.00304 -0.00020 -0.00102 254 2S -0.00587 -0.00183 -0.00867 -0.00110 -0.00529 255 23 H 1S 0.00954 0.00218 0.04538 0.04485 0.00464 256 2S 0.00526 0.00121 0.02758 0.03460 0.00386 257 24 H 1S -0.00052 -0.00016 -0.00396 -0.00002 -0.00187 258 2S -0.00603 -0.00184 -0.01089 -0.00050 -0.00597 259 25 H 1S 0.00000 0.00000 0.00008 -0.00002 0.00018 260 2S 0.00028 0.00008 0.00086 -0.00003 0.00168 261 26 H 1S 0.00000 0.00000 0.00001 0.00000 0.00000 262 2S -0.00000 0.00000 0.00008 -0.00002 0.00000 263 27 H 1S 0.00000 0.00000 0.00001 0.00002 0.00001 264 2S 0.00000 0.00000 0.00012 0.00022 0.00007 231 232 233 234 235 231 3PZ 0.11262 232 4XX 0.00000 0.00156 233 4YY 0.00000 -0.00022 0.00107 234 4ZZ 0.00000 -0.00008 0.00011 0.00091 235 4XY 0.00000 0.00000 -0.00000 -0.00000 0.00116 236 4XZ 0.00000 0.00000 -0.00000 -0.00000 -0.00000 237 4YZ 0.00000 0.00000 -0.00000 -0.00000 0.00000 238 21 C 1S -0.00019 -0.00007 -0.00000 0.00001 -0.00016 239 2S 0.00186 0.00088 -0.00017 -0.00033 0.00170 240 2PX 0.00318 -0.00110 0.00008 -0.00043 0.00149 241 2PY 0.00529 0.00192 -0.00050 -0.00040 0.00008 242 2PZ 0.02093 0.00064 -0.00024 0.00003 0.00070 243 3S -0.00049 0.00023 0.00037 -0.00016 0.00066 244 3PX 0.00208 -0.00031 -0.00019 -0.00021 0.00004 245 3PY 0.00445 0.00079 -0.00072 -0.00012 0.00005 246 3PZ 0.03739 0.00029 0.00004 -0.00027 0.00012 247 4XX 0.00019 0.00015 -0.00015 -0.00004 -0.00008 248 4YY 0.00037 -0.00021 0.00003 0.00002 -0.00001 249 4ZZ -0.00037 -0.00005 0.00002 0.00001 -0.00002 250 4XY 0.00016 -0.00003 -0.00000 -0.00005 0.00002 251 4XZ 0.00047 -0.00001 -0.00004 -0.00000 0.00002 252 4YZ 0.00022 -0.00007 0.00001 -0.00000 0.00002 253 22 H 1S -0.00033 -0.00003 0.00008 0.00001 0.00002 254 2S -0.00166 -0.00051 0.00064 0.00019 -0.00002 255 23 H 1S 0.00106 0.00535 -0.00102 -0.00080 0.00148 256 2S 0.00090 0.00414 -0.00163 -0.00095 0.00027 257 24 H 1S -0.00056 -0.00000 0.00004 0.00001 0.00004 258 2S -0.00178 -0.00000 0.00008 0.00008 0.00017 259 25 H 1S 0.00005 -0.00000 -0.00000 -0.00000 -0.00000 260 2S 0.00047 -0.00001 0.00000 -0.00000 -0.00000 261 26 H 1S -0.00000 0.00000 -0.00000 -0.00000 0.00000 262 2S 0.00001 0.00000 -0.00000 -0.00000 0.00000 263 27 H 1S 0.00000 -0.00000 -0.00000 -0.00000 0.00000 264 2S 0.00004 -0.00000 0.00000 -0.00000 0.00000 236 237 238 239 240 236 4XZ 0.00060 237 4YZ 0.00000 0.00049 238 21 C 1S -0.00005 -0.00002 2.05385 239 2S 0.00056 0.00016 -0.01489 0.34315 240 2PX 0.00049 0.00039 0.00000 0.00000 0.42862 241 2PY 0.00070 -0.00006 0.00000 0.00000 -0.00000 242 2PZ 0.00041 0.00018 0.00000 0.00000 -0.00000 243 3S 0.00021 0.00006 -0.03292 0.22902 0.00000 244 3PX 0.00001 0.00002 0.00000 0.00000 0.08114 245 3PY 0.00012 0.00002 0.00000 0.00000 0.00000 246 3PZ 0.00045 0.00016 0.00000 0.00000 0.00000 247 4XX -0.00002 -0.00004 -0.00132 -0.00276 0.00000 248 4YY 0.00003 0.00001 -0.00148 -0.00056 0.00000 249 4ZZ 0.00001 -0.00000 -0.00107 -0.00831 0.00000 250 4XY 0.00003 0.00000 -0.00000 0.00000 0.00000 251 4XZ 0.00000 -0.00001 -0.00000 0.00000 0.00000 252 4YZ 0.00000 -0.00001 0.00000 -0.00000 0.00000 253 22 H 1S 0.00000 0.00004 -0.00208 0.03330 0.00238 254 2S -0.00001 0.00011 -0.00101 0.00989 0.00112 255 23 H 1S 0.00035 -0.00002 0.00000 -0.00022 -0.00068 256 2S 0.00006 -0.00001 0.00021 -0.00298 -0.00788 257 24 H 1S 0.00001 0.00002 -0.00000 0.00000 0.00000 258 2S 0.00005 -0.00000 -0.00000 0.00013 0.00015 259 25 H 1S -0.00000 -0.00000 -0.00000 0.00000 0.00000 260 2S -0.00000 0.00000 0.00000 -0.00000 0.00000 261 26 H 1S 0.00000 -0.00000 -0.00000 0.00000 0.00000 262 2S 0.00000 -0.00000 -0.00000 0.00009 0.00029 263 27 H 1S 0.00000 0.00000 0.00000 -0.00003 -0.00007 264 2S 0.00000 0.00000 0.00002 -0.00059 -0.00193 241 242 243 244 245 241 2PY 0.41229 242 2PZ -0.00000 0.32857 243 3S 0.00000 0.00000 0.28467 244 3PX -0.00000 -0.00000 0.00000 0.05785 245 3PY 0.09110 0.00000 0.00000 0.00000 0.07667 246 3PZ 0.00000 0.10299 0.00000 0.00000 0.00000 247 4XX 0.00000 0.00000 -0.00340 0.00000 0.00000 248 4YY 0.00000 0.00000 0.00151 0.00000 0.00000 249 4ZZ 0.00000 0.00000 -0.00501 0.00000 0.00000 250 4XY 0.00000 0.00000 0.00000 0.00000 0.00000 251 4XZ 0.00000 0.00000 0.00000 0.00000 0.00000 252 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 253 22 H 1S 0.07683 0.02249 0.04730 0.00026 0.03941 254 2S 0.03977 0.01146 0.02755 0.00018 0.02807 255 23 H 1S -0.00003 -0.00001 -0.00359 -0.00159 -0.00002 256 2S -0.00027 -0.00013 -0.00945 -0.00700 0.00000 257 24 H 1S 0.00000 0.00000 0.00010 0.00014 0.00010 258 2S 0.00024 0.00008 0.00105 0.00122 0.00093 259 25 H 1S 0.00000 0.00000 0.00001 0.00000 0.00001 260 2S 0.00000 0.00000 0.00017 0.00002 0.00025 261 26 H 1S 0.00000 0.00000 0.00007 0.00019 0.00003 262 2S 0.00008 0.00003 0.00104 0.00193 0.00046 263 27 H 1S -0.00001 -0.00001 -0.00094 0.00077 -0.00014 264 2S 0.00030 0.00005 -0.00259 -0.00085 0.00026 246 247 248 249 250 246 3PZ 0.11020 247 4XX 0.00000 0.00139 248 4YY 0.00000 -0.00024 0.00127 249 4ZZ 0.00000 -0.00001 0.00008 0.00077 250 4XY 0.00000 0.00000 0.00000 0.00000 0.00100 251 4XZ 0.00000 0.00000 0.00000 -0.00000 -0.00000 252 4YZ 0.00000 0.00000 -0.00000 0.00000 0.00000 253 22 H 1S 0.01159 -0.00127 0.00413 -0.00021 0.00029 254 2S 0.00796 -0.00277 0.00373 0.00055 0.00006 255 23 H 1S -0.00001 0.00015 -0.00001 -0.00000 -0.00001 256 2S -0.00003 0.00090 -0.00031 -0.00005 -0.00006 257 24 H 1S 0.00003 0.00000 -0.00000 -0.00000 -0.00000 258 2S 0.00033 0.00000 -0.00002 -0.00000 0.00000 259 25 H 1S 0.00000 -0.00000 0.00000 0.00000 0.00000 260 2S 0.00007 -0.00000 0.00000 0.00000 0.00000 261 26 H 1S 0.00001 0.00000 -0.00000 -0.00000 -0.00000 262 2S 0.00017 0.00001 -0.00001 -0.00000 -0.00000 263 27 H 1S -0.00013 -0.00000 0.00000 0.00000 0.00000 264 2S -0.00008 -0.00012 0.00008 0.00002 0.00001 251 252 253 254 255 251 4XZ 0.00080 252 4YZ -0.00000 0.00080 253 22 H 1S 0.00009 0.00254 0.21370 254 2S 0.00002 0.00037 0.08896 0.10234 255 23 H 1S -0.00000 -0.00000 -0.00001 -0.00070 0.21301 256 2S -0.00002 -0.00001 -0.00074 -0.00280 0.09181 257 24 H 1S -0.00000 -0.00000 -0.00000 -0.00000 -0.00001 258 2S 0.00000 -0.00000 -0.00000 -0.00013 -0.00072 259 25 H 1S 0.00000 0.00000 0.00000 0.00000 -0.00000 260 2S 0.00000 0.00000 0.00000 0.00001 -0.00000 261 26 H 1S -0.00000 -0.00000 -0.00000 -0.00000 0.00000 262 2S -0.00000 -0.00000 -0.00000 -0.00009 0.00000 263 27 H 1S 0.00000 0.00000 -0.00001 0.00068 -0.00000 264 2S -0.00000 0.00001 0.00080 0.00470 -0.00000 256 257 258 259 260 256 2S 0.10478 257 24 H 1S -0.00073 0.21388 258 2S -0.00293 0.09042 0.10288 259 25 H 1S -0.00000 -0.00001 -0.00072 0.21325 260 2S -0.00012 -0.00073 -0.00287 0.09211 0.10542 261 26 H 1S 0.00000 -0.00000 -0.00000 -0.00001 -0.00081 262 2S 0.00001 -0.00000 -0.00012 -0.00070 -0.00284 263 27 H 1S -0.00000 0.00000 0.00000 0.00000 0.00000 264 2S -0.00002 -0.00000 -0.00000 0.00000 0.00000 261 262 263 264 261 26 H 1S 0.21306 262 2S 0.08742 0.11020 263 27 H 1S 0.00000 0.00000 0.21351 264 2S -0.00000 -0.00002 0.08062 0.09032 Gross orbital populations: 1 1 1 C 1S 1.99227 2 2S 0.75133 3 2PX 0.77359 4 2PY 0.68715 5 2PZ 0.49942 6 3S 0.57799 7 3PX 0.18572 8 3PY 0.30213 9 3PZ 0.29341 10 4XX 0.00474 11 4YY -0.00069 12 4ZZ -0.01690 13 4XY 0.01054 14 4XZ 0.00819 15 4YZ 0.00582 16 2 C 1S 1.99261 17 2S 0.70104 18 2PX 0.71807 19 2PY 0.62489 20 2PZ 0.68002 21 3S 0.67069 22 3PX 0.23683 23 3PY 0.28423 24 3PZ 0.34935 25 4XX 0.00285 26 4YY -0.00282 27 4ZZ 0.00213 28 4XY 0.00879 29 4XZ 0.00632 30 4YZ 0.00864 31 3 H 1S 0.51680 32 2S 0.21622 33 4 Br 1S 2.00265 34 2S 2.18467 35 3S 0.74229 36 4S 1.66947 37 5S 1.20151 38 6S 0.81258 39 7PX 1.99733 40 7PY 1.99673 41 7PZ 1.99710 42 8PX 1.99386 43 8PY 1.99215 44 8PZ 1.99307 45 9PX 1.01432 46 9PY 0.85229 47 9PZ 0.93704 48 10PX 0.87327 49 10PY 0.61922 50 10PZ 0.74260 51 11XX 1.05565 52 11YY 1.05544 53 11ZZ 1.05563 54 11XY 1.99076 55 11XZ 1.99086 56 11YZ 1.99060 57 12XX 0.05662 58 12YY 0.08323 59 12ZZ 0.06830 60 12XY 0.01616 61 12XZ 0.01285 62 12YZ 0.02664 63 5 C 1S 1.99207 64 2S 0.70779 65 2PX 0.63641 66 2PY 0.67814 67 2PZ 0.77301 68 3S 0.46551 69 3PX 0.33907 70 3PY 0.17169 71 3PZ 0.09798 72 4XX -0.01664 73 4YY -0.00598 74 4ZZ 0.00215 75 4XY 0.00586 76 4XZ 0.00830 77 4YZ 0.01163 78 6 C 1S 1.99210 79 2S 0.70809 80 2PX 0.61579 81 2PY 0.71493 82 2PZ 0.74964 83 3S 0.54816 84 3PX 0.36603 85 3PY 0.26630 86 3PZ 0.21481 87 4XX -0.01717 88 4YY -0.00249 89 4ZZ 0.00544 90 4XY 0.00481 91 4XZ 0.00670 92 4YZ 0.01182 93 7 C 1S 1.99191 94 2S 0.71174 95 2PX 0.60873 96 2PY 0.70524 97 2PZ 0.76131 98 3S 0.52538 99 3PX 0.35730 100 3PY 0.22982 101 3PZ 0.23452 102 4XX -0.01745 103 4YY -0.00578 104 4ZZ 0.01301 105 4XY 0.00544 106 4XZ 0.00500 107 4YZ 0.00911 108 8 C 1S 1.99191 109 2S 0.71357 110 2PX 0.60434 111 2PY 0.70413 112 2PZ 0.76217 113 3S 0.52587 114 3PX 0.36408 115 3PY 0.28262 116 3PZ 0.17094 117 4XX -0.01580 118 4YY 0.00158 119 4ZZ 0.00052 120 4XY 0.00579 121 4XZ 0.00723 122 4YZ 0.01009 123 9 C 1S 1.99190 124 2S 0.71201 125 2PX 0.60912 126 2PY 0.70400 127 2PZ 0.76261 128 3S 0.52630 129 3PX 0.36132 130 3PY 0.26115 131 3PZ 0.20027 132 4XX -0.01702 133 4YY -0.00297 134 4ZZ 0.00606 135 4XY 0.00493 136 4XZ 0.00660 137 4YZ 0.01177 138 10 C 1S 1.99192 139 2S 0.71222 140 2PX 0.60891 141 2PY 0.71091 142 2PZ 0.75358 143 3S 0.52398 144 3PX 0.36422 145 3PY 0.25272 146 3PZ 0.23795 147 4XX -0.01724 148 4YY -0.00529 149 4ZZ 0.01238 150 4XY 0.00540 151 4XZ 0.00515 152 4YZ 0.00961 153 11 H 1S 0.52847 154 2S 0.29932 155 12 H 1S 0.52917 156 2S 0.30515 157 13 H 1S 0.52948 158 2S 0.30614 159 14 H 1S 0.52924 160 2S 0.30486 161 15 H 1S 0.52761 162 2S 0.29767 163 16 C 1S 1.99187 164 2S 0.71686 165 2PX 0.75224 166 2PY 0.72022 167 2PZ 0.63068 168 3S 0.43972 169 3PX 0.10928 170 3PY 0.14047 171 3PZ 0.32053 172 4XX 0.00235 173 4YY -0.00239 174 4ZZ -0.01713 175 4XY 0.01212 176 4XZ 0.00645 177 4YZ 0.00588 178 17 C 1S 1.99197 179 2S 0.72472 180 2PX 0.79702 181 2PY 0.69963 182 2PZ 0.55621 183 3S 0.53101 184 3PX 0.24592 185 3PY 0.23378 186 3PZ 0.32428 187 4XX 0.01347 188 4YY -0.00362 189 4ZZ -0.01859 190 4XY 0.00962 191 4XZ 0.00478 192 4YZ 0.00548 193 18 C 1S 1.99189 194 2S 0.71458 195 2PX 0.75624 196 2PY 0.72498 197 2PZ 0.60314 198 3S 0.52617 199 3PX 0.14642 200 3PY 0.28956 201 3PZ 0.36683 202 4XX 0.00086 203 4YY 0.00484 204 4ZZ -0.01674 205 4XY 0.00985 206 4XZ 0.00558 207 4YZ 0.00539 208 19 C 1S 1.99200 209 2S 0.73171 210 2PX 0.78201 211 2PY 0.70949 212 2PZ 0.53926 213 3S 0.54384 214 3PX 0.22271 215 3PY 0.23358 216 3PZ 0.31208 217 4XX 0.00729 218 4YY -0.00219 219 4ZZ -0.01787 220 4XY 0.01229 221 4XZ 0.00633 222 4YZ 0.00506 223 20 C 1S 1.99189 224 2S 0.71410 225 2PX 0.77419 226 2PY 0.71072 227 2PZ 0.60262 228 3S 0.52182 229 3PX 0.23829 230 3PY 0.21454 231 3PZ 0.34647 232 4XX 0.01315 233 4YY -0.00492 234 4ZZ -0.01883 235 4XY 0.01043 236 4XZ 0.00503 237 4YZ 0.00487 238 21 C 1S 1.99198 239 2S 0.72779 240 2PX 0.76339 241 2PY 0.71655 242 2PZ 0.56267 243 3S 0.53897 244 3PX 0.18960 245 3PY 0.28557 246 3PZ 0.34067 247 4XX 0.00190 248 4YY 0.00460 249 4ZZ -0.01690 250 4XY 0.00949 251 4XZ 0.00700 252 4YZ 0.00551 253 22 H 1S 0.52479 254 2S 0.26009 255 23 H 1S 0.52450 256 2S 0.27341 257 24 H 1S 0.52509 258 2S 0.26334 259 25 H 1S 0.52495 260 2S 0.27394 261 26 H 1S 0.52422 262 2S 0.26118 263 27 H 1S 0.52243 264 2S 0.22281 Condensed to atoms (all electrons): 1 2 3 4 5 6 1 C 5.144832 0.289462 -0.036490 -0.034893 -0.031252 -0.003119 2 C 0.289462 5.296785 0.362496 0.223356 0.299072 -0.060820 3 H -0.036490 0.362496 0.470173 -0.030492 -0.035922 0.003760 4 Br -0.034893 0.223356 -0.030492 34.911087 -0.043691 -0.007435 5 C -0.031252 0.299072 -0.035922 -0.043691 4.780079 0.532787 6 C -0.003119 -0.060820 0.003760 -0.007435 0.532787 4.986387 7 C -0.000055 0.006626 -0.000108 0.000543 -0.023208 0.518088 8 C 0.000015 0.000346 0.000010 -0.000009 -0.033939 -0.036915 9 C -0.000151 0.005714 0.000141 -0.000095 -0.022504 -0.044254 10 C -0.000610 -0.049345 -0.002969 0.002239 0.529836 -0.040845 11 H 0.000362 -0.007305 0.004730 0.000037 -0.047566 0.004992 12 H 0.000001 -0.000184 -0.000008 0.000002 0.003826 0.000744 13 H 0.000000 0.000006 -0.000000 -0.000000 0.000571 0.004661 14 H 0.000000 -0.000167 0.000002 0.000003 0.003568 -0.038202 15 H 0.000331 -0.011153 0.000136 0.009215 -0.045521 0.363481 16 C 0.473339 -0.026398 0.002704 -0.002610 -0.007500 0.000751 17 C -0.051624 -0.008838 -0.000032 -0.000291 0.000830 -0.006355 18 C 0.007671 0.000166 0.000004 0.000014 0.000390 0.000304 19 C 0.000219 -0.000000 0.000000 0.000003 -0.000007 -0.000005 20 C 0.006385 -0.000222 0.000002 0.000016 0.000003 -0.000000 21 C -0.029161 0.004983 -0.000154 -0.000945 -0.000072 -0.000025 22 H -0.006339 0.000275 -0.000006 -0.000028 0.000000 0.000000 23 H -0.000168 0.000001 -0.000000 -0.000000 -0.000000 -0.000000 24 H -0.000000 -0.000000 0.000000 -0.000000 0.000000 0.000000 25 H -0.000180 0.000001 -0.000000 0.000000 0.000010 0.000013 26 H -0.007376 -0.000090 0.000007 0.000001 0.003507 0.007028 27 H 0.353511 -0.041143 -0.004958 -0.001108 0.003678 -0.000069 7 8 9 10 11 12 1 C -0.000055 0.000015 -0.000151 -0.000610 0.000362 0.000001 2 C 0.006626 0.000346 0.005714 -0.049345 -0.007305 -0.000184 3 H -0.000108 0.000010 0.000141 -0.002969 0.004730 -0.000008 4 Br 0.000543 -0.000009 -0.000095 0.002239 0.000037 0.000002 5 C -0.023208 -0.033939 -0.022504 0.529836 -0.047566 0.003826 6 C 0.518088 -0.036915 -0.044254 -0.040845 0.004992 0.000744 7 C 4.872649 0.539735 -0.026531 -0.044329 0.000262 0.004278 8 C 0.539735 4.858758 0.544663 -0.037791 0.004428 -0.039779 9 C -0.026531 0.544663 4.859209 0.530394 -0.035887 0.363492 10 C -0.044329 -0.037791 0.530394 4.946570 0.361818 -0.038354 11 H 0.000262 0.004428 -0.035887 0.361818 0.547103 -0.004994 12 H 0.004278 -0.039779 0.363492 -0.038354 -0.004994 0.550441 13 H -0.040649 0.364356 -0.040740 0.004698 -0.000152 -0.004997 14 H 0.363618 -0.039637 0.004262 0.000769 0.000014 -0.000159 15 H -0.036875 0.004360 0.000277 0.005042 -0.000142 0.000014 16 C 0.000034 0.000014 0.000010 -0.000252 0.000097 0.000000 17 C -0.001310 -0.000074 0.000078 0.000452 -0.000008 -0.000001 18 C -0.000028 -0.000014 -0.000010 0.000029 0.000001 -0.000000 19 C 0.000000 0.000000 0.000000 -0.000000 0.000000 0.000000 20 C -0.000000 -0.000000 0.000000 0.000000 -0.000000 -0.000000 21 C 0.000000 0.000000 0.000000 -0.000012 -0.000001 -0.000000 22 H 0.000000 0.000000 -0.000000 -0.000000 0.000000 -0.000000 23 H -0.000000 0.000000 -0.000000 -0.000000 -0.000000 0.000000 24 H 0.000000 -0.000000 -0.000000 0.000000 0.000000 0.000000 25 H 0.000002 -0.000002 -0.000001 -0.000000 -0.000000 -0.000000 26 H 0.002523 0.000521 -0.000034 -0.000894 0.000048 0.000002 27 H 0.000001 -0.000000 0.000002 -0.000032 -0.000047 -0.000000 13 14 15 16 17 18 1 C 0.000000 0.000000 0.000331 0.473339 -0.051624 0.007671 2 C 0.000006 -0.000167 -0.011153 -0.026398 -0.008838 0.000166 3 H -0.000000 0.000002 0.000136 0.002704 -0.000032 0.000004 4 Br -0.000000 0.000003 0.009215 -0.002610 -0.000291 0.000014 5 C 0.000571 0.003568 -0.045521 -0.007500 0.000830 0.000390 6 C 0.004661 -0.038202 0.363481 0.000751 -0.006355 0.000304 7 C -0.040649 0.363618 -0.036875 0.000034 -0.001310 -0.000028 8 C 0.364356 -0.039637 0.004360 0.000014 -0.000074 -0.000014 9 C -0.040740 0.004262 0.000277 0.000010 0.000078 -0.000010 10 C 0.004698 0.000769 0.005042 -0.000252 0.000452 0.000029 11 H -0.000152 0.000014 -0.000142 0.000097 -0.000008 0.000001 12 H -0.004997 -0.000159 0.000014 0.000000 -0.000001 -0.000000 13 H 0.552987 -0.004974 -0.000148 -0.000000 -0.000001 -0.000000 14 H -0.004974 0.549764 -0.004796 0.000000 -0.000019 0.000001 15 H -0.000148 -0.004796 0.541010 0.000201 0.000280 -0.000008 16 C -0.000000 0.000000 0.000201 4.642015 0.476491 -0.015291 17 C -0.000001 -0.000019 0.000280 0.476491 4.968705 0.523909 18 C -0.000000 0.000001 -0.000008 -0.015291 0.523909 4.874614 19 C 0.000000 0.000000 -0.000000 -0.028780 -0.032001 0.506683 20 C -0.000000 -0.000000 -0.000000 -0.022998 -0.036067 -0.028529 21 C 0.000000 -0.000000 -0.000003 0.449939 -0.052095 -0.040906 22 H 0.000000 -0.000000 0.000000 -0.043626 0.004021 0.000124 23 H -0.000000 -0.000000 -0.000000 0.003124 0.000453 0.003751 24 H 0.000000 0.000000 0.000000 0.000422 0.004484 -0.036550 25 H -0.000000 -0.000000 0.000001 0.003017 -0.033433 0.368040 26 H 0.000003 0.000048 -0.000401 -0.040715 0.353525 -0.034622 27 H 0.000000 -0.000000 -0.000016 -0.034839 0.004597 -0.000131 19 20 21 22 23 24 1 C 0.000219 0.006385 -0.029161 -0.006339 -0.000168 -0.000000 2 C -0.000000 -0.000222 0.004983 0.000275 0.000001 -0.000000 3 H 0.000000 0.000002 -0.000154 -0.000006 -0.000000 0.000000 4 Br 0.000003 0.000016 -0.000945 -0.000028 -0.000000 -0.000000 5 C -0.000007 0.000003 -0.000072 0.000000 -0.000000 0.000000 6 C -0.000005 -0.000000 -0.000025 0.000000 -0.000000 0.000000 7 C 0.000000 -0.000000 0.000000 0.000000 -0.000000 0.000000 8 C 0.000000 -0.000000 0.000000 0.000000 0.000000 -0.000000 9 C 0.000000 0.000000 0.000000 -0.000000 -0.000000 -0.000000 10 C -0.000000 0.000000 -0.000012 -0.000000 -0.000000 0.000000 11 H 0.000000 -0.000000 -0.000001 0.000000 -0.000000 0.000000 12 H 0.000000 -0.000000 -0.000000 -0.000000 0.000000 0.000000 13 H 0.000000 -0.000000 0.000000 0.000000 -0.000000 0.000000 14 H 0.000000 -0.000000 -0.000000 -0.000000 -0.000000 0.000000 15 H -0.000000 -0.000000 -0.000003 0.000000 -0.000000 0.000000 16 C -0.028780 -0.022998 0.449939 -0.043626 0.003124 0.000422 17 C -0.032001 -0.036067 -0.052095 0.004021 0.000453 0.004484 18 C 0.506683 -0.028529 -0.040906 0.000124 0.003751 -0.036550 19 C 4.848098 0.513887 -0.029670 0.004143 -0.036394 0.364018 20 C 0.513887 4.867336 0.522921 -0.033289 0.367631 -0.037039 21 C -0.029670 0.522921 4.969658 0.363967 -0.033102 0.004481 22 H 0.004143 -0.033289 0.363967 0.493953 -0.004264 -0.000131 23 H -0.036394 0.367631 -0.033102 -0.004264 0.501402 -0.004395 24 H 0.364018 -0.037039 0.004481 -0.000131 -0.004395 0.497603 25 H -0.036970 0.003768 0.000535 0.000012 -0.000121 -0.004339 26 H 0.004346 0.000077 0.004380 -0.000096 0.000012 -0.000130 27 H 0.000000 0.000515 -0.005936 0.006166 -0.000016 -0.000000 25 26 27 1 C -0.000180 -0.007376 0.353511 2 C 0.000001 -0.000090 -0.041143 3 H -0.000000 0.000007 -0.004958 4 Br 0.000000 0.000001 -0.001108 5 C 0.000010 0.003507 0.003678 6 C 0.000013 0.007028 -0.000069 7 C 0.000002 0.002523 0.000001 8 C -0.000002 0.000521 -0.000000 9 C -0.000001 -0.000034 0.000002 10 C -0.000000 -0.000894 -0.000032 11 H -0.000000 0.000048 -0.000047 12 H -0.000000 0.000002 -0.000000 13 H -0.000000 0.000003 0.000000 14 H -0.000000 0.000048 -0.000000 15 H 0.000001 -0.000401 -0.000016 16 C 0.003017 -0.040715 -0.034839 17 C -0.033433 0.353525 0.004597 18 C 0.368040 -0.034622 -0.000131 19 C -0.036970 0.004346 0.000000 20 C 0.003768 0.000077 0.000515 21 C 0.000535 0.004380 -0.005936 22 H 0.000012 -0.000096 0.006166 23 H -0.000121 0.000012 -0.000016 24 H -0.004339 -0.000130 -0.000000 25 H 0.502893 -0.004357 0.000002 26 H -0.004357 0.498099 -0.000014 27 H 0.000002 -0.000014 0.465071 Mulliken charges: 1 1 C -0.074707 2 C -0.283625 3 H 0.266976 4 Br -0.024918 5 C 0.133025 6 C -0.184949 7 C -0.135267 8 C -0.129046 9 C -0.138034 10 C -0.166414 11 H 0.172210 12 H 0.165677 13 H 0.164378 14 H 0.165903 15 H 0.174718 16 C 0.170852 17 C -0.115675 18 C -0.129613 19 C -0.077570 20 C -0.124397 21 C -0.128782 22 H 0.215119 23 H 0.202086 24 H 0.211576 25 H 0.201109 26 H 0.214603 27 H 0.254766 Sum of Mulliken charges = 1.00000 Mulliken charges with hydrogens summed into heavy atoms: 1 1 C 0.180058 2 C -0.016649 4 Br -0.024918 5 C 0.133025 6 C -0.010231 7 C 0.030636 8 C 0.035332 9 C 0.027643 10 C 0.005796 16 C 0.170852 17 C 0.098928 18 C 0.071496 19 C 0.134006 20 C 0.077689 21 C 0.086336 Electronic spatial extent (au): = 4321.4006 Charge= 1.0000 electrons Dipole moment (field-independent basis, Debye): X= 7.2857 Y= -2.3480 Z= 2.1009 Tot= 7.9378 Quadrupole moment (field-independent basis, Debye-Ang): XX= -55.4750 YY= -79.6367 ZZ= -85.7945 XY= 0.7228 XZ= -0.6008 YZ= 7.1801 Traceless Quadrupole moment (field-independent basis, Debye-Ang): XX= 18.1604 YY= -6.0013 ZZ= -12.1591 XY= 0.7228 XZ= -0.6008 YZ= 7.1801 Octapole moment (field-independent basis, Debye-Ang**2): XXX= 137.5849 YYY= 49.3117 ZZZ= -3.0960 XYY= -5.9847 XXY= -23.5694 XXZ= -6.9601 XZZ= -20.5723 YZZ= 22.8963 YYZ= -10.8063 XYZ= 18.5329 Hexadecapole moment (field-independent basis, Debye-Ang**3): XXXX= -2452.7737 YYYY= -1625.8887 ZZZZ= -438.9820 XXXY= -137.1591 XXXZ= -7.7057 YYYX= -41.6890 YYYZ= -11.6073 ZZZX= 6.4621 ZZZY= -16.1234 XXYY= -642.9198 XXZZ= -579.0558 YYZZ= -331.0628 XXYZ= 52.0265 YYXZ= -13.5825 ZZXY= -1.5124 N-N= 1.208477123603D+03 E-N=-9.781296436253D+03 KE= 3.091078359348D+03 Orbital energies and kinetic energies (alpha): 1 2 1 O -482.942591 583.649405 2 O -61.904205 119.571852 3 O -56.424961 117.117756 4 O -56.420903 117.144754 5 O -56.420572 117.143870 6 O -10.307524 15.883970 7 O -10.298695 15.889317 8 O -10.261531 15.880105 9 O -10.255792 15.881210 10 O -10.254160 15.880931 11 O -10.250067 15.880623 12 O -10.234005 15.880179 13 O -10.233623 15.880048 14 O -10.228904 15.882047 15 O -10.212425 15.880137 16 O -10.210190 15.880649 17 O -10.207008 15.874173 18 O -10.206379 15.882181 19 O -10.206051 15.886404 20 O -8.614657 27.618852 21 O -6.568872 26.125862 22 O -6.555934 26.148210 23 O -6.554547 26.148433 24 O -2.684327 21.387241 25 O -2.681104 21.395649 26 O -2.679990 21.397146 27 O -2.669684 21.404692 28 O -2.669654 21.404370 29 O -0.919124 1.523926 30 O -0.890959 1.600491 31 O -0.860602 1.644356 32 O -0.817545 1.988383 33 O -0.797153 1.642606 34 O -0.773332 2.299392 35 O -0.762786 1.626778 36 O -0.742863 2.216672 37 O -0.686249 1.751160 38 O -0.652451 1.443321 39 O -0.632147 1.505328 40 O -0.623715 1.468219 41 O -0.594271 1.420138 42 O -0.558322 1.092842 43 O -0.532602 1.226142 44 O -0.527632 1.193930 45 O -0.507035 1.326599 46 O -0.488959 1.386960 47 O -0.476269 1.413311 48 O -0.469837 1.227642 49 O -0.460001 1.328240 50 O -0.459024 1.420513 51 O -0.438190 1.284501 52 O -0.432834 1.327628 53 O -0.429296 1.351888 54 O -0.408507 1.365463 55 O -0.403732 1.392796 56 O -0.390541 1.320956 57 O -0.371046 1.217491 58 O -0.365755 1.474952 59 O -0.360114 1.411212 60 O -0.333573 1.634712 61 O -0.311799 2.355243 62 O -0.305623 2.105376 63 O -0.300432 1.138437 64 O -0.269156 1.142211 65 O -0.267065 1.269298 66 V -0.165942 1.591869 67 V -0.062981 1.937212 68 V -0.042236 1.374801 69 V -0.023433 1.420959 70 V -0.016499 1.442914 71 V 0.001250 1.725593 72 V 0.065426 1.014650 73 V 0.082469 0.989387 74 V 0.094196 1.026091 75 V 0.115767 1.129615 76 V 0.119512 1.623134 77 V 0.129847 1.645522 78 V 0.136373 1.046816 79 V 0.140495 1.239742 80 V 0.152234 1.157296 81 V 0.153517 1.313516 82 V 0.168303 1.322029 83 V 0.176040 1.342795 84 V 0.180285 1.307597 85 V 0.189397 1.269524 86 V 0.195411 1.778220 87 V 0.213589 1.846172 88 V 0.239426 1.782060 89 V 0.263988 1.534769 90 V 0.270866 1.594305 91 V 0.279402 1.594326 92 V 0.286194 1.659223 93 V 0.291929 1.516637 94 V 0.301614 1.599632 95 V 0.318235 1.714084 96 V 0.331064 1.827114 97 V 0.369339 1.984292 98 V 0.396797 1.919129 99 V 0.399453 1.773137 100 V 0.419512 2.115486 101 V 0.427018 2.251434 102 V 0.439652 2.208752 103 V 0.452162 2.555085 104 V 0.465187 2.475570 105 V 0.472043 2.429660 106 V 0.478753 2.664440 107 V 0.488066 2.377894 108 V 0.495951 2.112537 109 V 0.510951 2.188090 110 V 0.517086 2.093999 111 V 0.520409 2.269842 112 V 0.524723 2.139315 113 V 0.533739 2.111150 114 V 0.542115 2.125698 115 V 0.549068 2.319808 116 V 0.556663 2.299607 117 V 0.563509 2.288577 118 V 0.567735 2.305380 119 V 0.575294 2.115202 120 V 0.577587 2.274836 121 V 0.579938 2.139774 122 V 0.581312 2.125619 123 V 0.588852 2.183719 124 V 0.596340 2.028129 125 V 0.600636 2.171267 126 V 0.603882 2.100746 127 V 0.610855 2.237278 128 V 0.622044 2.191071 129 V 0.641518 2.268653 130 V 0.647048 2.271067 131 V 0.690779 2.225004 132 V 0.694011 2.505728 133 V 0.719775 2.238658 134 V 0.751192 2.481092 135 V 0.761071 2.376170 136 V 0.791223 2.664860 137 V 0.800787 2.560569 138 V 0.804069 2.699615 139 V 0.809817 2.552949 140 V 0.821668 2.681139 141 V 0.826187 2.722687 142 V 0.829936 2.636081 143 V 0.840881 2.594303 144 V 0.842217 2.648678 145 V 0.864763 2.570378 146 V 0.869526 2.506017 147 V 0.872737 2.636970 148 V 0.882081 2.562020 149 V 0.897972 2.566950 150 V 0.908688 2.591337 151 V 0.911262 2.666504 152 V 0.921337 2.659382 153 V 0.941241 2.566623 154 V 0.957794 2.558427 155 V 0.963798 2.474235 156 V 0.997598 2.606136 157 V 1.003516 2.251939 158 V 1.017842 2.248266 159 V 1.071788 2.243215 160 V 1.088879 2.291106 161 V 1.097754 2.310483 162 V 1.114490 2.366589 163 V 1.133805 2.340943 164 V 1.145478 2.594093 165 V 1.153234 2.365083 166 V 1.182394 2.441714 167 V 1.199349 2.416307 168 V 1.204800 2.414584 169 V 1.232191 2.510760 170 V 1.250562 2.519399 171 V 1.274673 2.593964 172 V 1.326454 2.626059 173 V 1.385205 2.574966 174 V 1.386482 2.594337 175 V 1.391392 2.573248 176 V 1.413763 2.592844 177 V 1.424133 2.644005 178 V 1.434895 2.622287 179 V 1.442026 2.696544 180 V 1.446593 2.668395 181 V 1.455588 2.686727 182 V 1.461264 2.661022 183 V 1.464074 2.658360 184 V 1.481798 2.732017 185 V 1.494848 2.727224 186 V 1.531279 2.952419 187 V 1.546035 4.404391 188 V 1.589136 4.137757 189 V 1.678754 2.985640 190 V 1.691641 3.084427 191 V 1.736106 3.294635 192 V 1.755521 3.172088 193 V 1.793376 3.240554 194 V 1.804957 3.232108 195 V 1.819036 3.146782 196 V 1.838179 3.190274 197 V 1.866729 3.207040 198 V 1.871478 3.166682 199 V 1.886566 3.337287 200 V 1.894165 3.242918 201 V 1.915736 3.428581 202 V 1.921480 3.396837 203 V 1.934381 3.443067 204 V 1.959015 3.478795 205 V 1.990760 3.525878 206 V 1.996908 3.557580 207 V 2.021471 3.532219 208 V 2.045839 3.584071 209 V 2.076322 3.541447 210 V 2.091804 3.533266 211 V 2.105958 3.377045 212 V 2.112297 3.541736 213 V 2.119324 3.498637 214 V 2.139374 3.471525 215 V 2.155343 3.531852 216 V 2.176967 3.470795 217 V 2.189750 3.632355 218 V 2.229778 3.657679 219 V 2.241271 3.579048 220 V 2.256151 3.622154 221 V 2.271466 3.572058 222 V 2.287743 3.688645 223 V 2.294118 3.568511 224 V 2.315878 3.706262 225 V 2.390601 3.767218 226 V 2.420390 3.795574 227 V 2.441154 3.908765 228 V 2.516347 4.165279 229 V 2.548420 4.080551 230 V 2.566674 4.100002 231 V 2.570552 4.203237 232 V 2.590484 3.951259 233 V 2.603871 4.247238 234 V 2.636960 3.956251 235 V 2.677270 4.365862 236 V 2.693633 4.437783 237 V 2.706907 4.501981 238 V 2.710313 4.468039 239 V 2.725599 4.530327 240 V 2.738747 4.527008 241 V 2.757173 4.553710 242 V 2.802476 4.528907 243 V 2.840446 4.540812 244 V 2.953302 4.767958 245 V 3.035557 4.960430 246 V 3.109075 5.115938 247 V 3.351843 5.225167 248 V 3.390478 5.249452 249 V 4.021338 10.221584 250 V 4.047685 10.214238 251 V 4.071810 10.183907 252 V 4.086424 10.190771 253 V 4.110177 10.208004 254 V 4.135907 10.240985 255 V 4.212114 10.299024 256 V 4.280345 10.170029 257 V 4.295689 10.255850 258 V 4.323887 10.177683 259 V 4.381503 10.287989 260 V 4.462928 10.301808 261 V 4.664185 10.431296 262 V 4.695675 10.422890 263 V 8.616665 33.383277 264 V 73.512056 338.819009 Total kinetic energy from orbitals= 3.091078359348D+03 Running external command "gaunbo6 R" input file "/scratch/webmo-13362/515500/Gau-19700.EIn" output file "/scratch/webmo-13362/515500/Gau-19700.EOu" message file "/scratch/webmo-13362/515500/Gau-19700.EMs" fchk file "/scratch/webmo-13362/515500/Gau-19700.EFC" mat. el file "/scratch/webmo-13362/515500/Gau-19700.EUF" Writing WrtUnf unformatted file "/scratch/webmo-13362/515500/Gau-19700.EUF" Gaussian matrix elements Version 2 NLab=11 Len12L=8 Len4L=8 Write SHELL TO ATOM MAP from file 0 offset 0 length 92 to matrix element file. Write SHELL TYPES from file 0 offset 0 length 92 to matrix element file. Write NUMBER OF PRIMITIVES PER SHELL from file 0 offset 0 length 92 to matrix element file. Write PRIMITIVE EXPONENTS from file 0 offset 0 length 233 to matrix element file. Write CONTRACTION COEFFICIENTS from file 0 offset 0 length 233 to matrix element file. Write P(S=P) CONTRACTION COEFFICIENTS from file 0 offset 0 length 233 to matrix element file. Write COORDINATES OF EACH SHELL from file 0 offset 0 length 276 to matrix element file. Write BONDS PER ATOM from file 0 offset 0 length 27 to matrix element file. Write BONDED ATOMS from file 0 offset 0 length 58 to matrix element file. Write BOND TYPES from file 0 offset 0 length 58 to matrix element file. Write ONIOM CHARGE/MULT from file 0 offset 0 length 32 to matrix element file. Write ONIOM ATOM LAYERS from file 0 offset 0 length 27 to matrix element file. Write ONIOM ATOM MODIFIERS from file 0 offset 0 length 27 to matrix element file. Write ONIOM ATOM TYPES from file 0 offset 0 length 27 to matrix element file. Write ONIOM LINK ATOMS from file 0 offset 0 length 27 to matrix element file. Write ONIOM LINK CHARGES from file 0 offset 0 length 27 to matrix element file. Write ONIOM LINK DISTANCES from file 0 offset 0 length 108 to matrix element file. Write SYMINF INTS from file 0 offset 0 length 26 to matrix element file. Write ROTTR TO SO from file 0 offset 0 length 12 to matrix element file. Write GAUSSIAN SCALARS from file 501 offset 0 to matrix element file. Write OPTIMIZATION FLAGS from file 0 offset 0 length 27 to matrix element file. Write INTEGER ISO from file 0 offset 0 length 27 to matrix element file. Write INTEGER SPIN from file 0 offset 0 length 27 to matrix element file. Write REAL ZEFFECTIVE from file 0 offset 0 length 27 to matrix element file. Write REAL QUADRUPOLEMOMENT from file 0 offset 0 length 27 to matrix element file. Write REAL GFACTOR from file 0 offset 0 length 27 to matrix element file. Write REAL ZNUCLEAR from file 0 offset 0 length 27 to matrix element file. Write MULLIKEN CHARGES from file 0 offset 0 length 27 to matrix element file. Write NUCLEAR GRADIENT from file 10584 offset 0 length 81 to matrix element file. Array NUCLEAR FORCE CONSTANTS on file 10585 does not exist. Write ELECTRIC DIPOLE MOMENT from file 0 offset 0 length 3 to matrix element file. Write NON-ADIABATIC COUPLING from file 10810 offset 0 length 81 to matrix element file. Write FINITE EM FIELD from file 10521 offset 0 length 35 to matrix element file. Write OVERLAP from file 10514 offset 0 length 34980 to matrix element file. Write CORE HAMILTONIAN ALPHA from file 10515 offset 0 length 34980 to matrix element file. Write CORE HAMILTONIAN BETA from file 10515 offset 34980 length 34980 to matrix element file. Write KINETIC ENERGY from file 10516 offset 0 length 34980 to matrix element file. Write ORTHOGONAL BASIS from file 10685 offset 0 length 69696 to matrix element file. Write DIPOLE INTEGRALS from file 10518 offset 0 length 104940 to matrix element file. Array DIP VEL INTEGRALS on file 10572 does not exist. Array R X DEL INTEGRALS on file 10572 does not exist. Write ALPHA ORBITAL ENERGIES from file 0 offset 0 length 264 to matrix element file. Write ALPHA MO COEFFICIENTS from file 10524 offset 0 length 69696 to matrix element file. Write ALPHA DENSITY MATRIX from file 0 offset 0 length 34980 to matrix element file. Write ALPHA FOCK MATRIX from file 10536 offset 0 length 34980 to matrix element file. Write ENERGY-WEIGHTED DENSITY from file 10571 offset 0 length 34980 to matrix element file. Write ALPHA SCF DENSITY MATRIX from file 0 offset 0 length 34980 to matrix element file. No 2e integrals to process. Perform NBO analysis... *********************************** NBO 7.0 *********************************** N A T U R A L A T O M I C O R B I T A L A N D N A T U R A L B O N D O R B I T A L A N A L Y S I S ***************************** UW-Madison (S101551) **************************** (c) Copyright 1996-2020 Board of Regents of the University of Wisconsin System on behalf of the Theoretical Chemistry Institute. All rights reserved. Cite this program [NBO 7.0.8 (11-Feb-2020)] as: NBO 7.0. E. D. Glendening, J. K. Badenhoop, A. E. Reed, J. E. Carpenter, J. A. Bohmann, C. M. Morales, P. Karafiloglou, C. R. Landis, and F. Weinhold, Theoretical Chemistry Institute, University of Wisconsin, Madison, WI (2018) /NRT / : Natural Resonance Theory Analysis /AOPNAO / : Write the AO to PNAO transformation to lfn32 /AOPNHO / : Write the AO to PNHO transformation to lfn34 /AOPNBO / : Write the AO to PNBO transformation to lfn36 /DMNAO / : Write the NAO density matrix to lfn82 /DMNHO / : Write the NHO density matrix to lfn84 /DMNBO / : Write the NBO density matrix to lfn86 /FNAO / : Write the NAO Fock matrix to lfn92 /FNHO / : Write the NHO Fock matrix to lfn94 /FNBO / : Write the NBO Fock matrix to lfn96 /FILE / : Set to NBODATA Filename set to NBODATA Job title: C14H12Br(+1) cis-stilbene bromonium cation (H2O solvent, C1) NATURAL POPULATIONS: Natural atomic orbital occupancies NAO Atom No lang Type(AO) Occupancy Energy ------------------------------------------------------- 1 C 1 s Cor( 1s) 2.00000 -10.30749 2 C 1 s Val( 2s) 1.00236 -0.20875 3 C 1 s Ryd( 3s) 0.00160 1.02289 4 C 1 s Ryd( 4s) 0.00008 4.20292 5 C 1 px Val( 2p) 1.05375 -0.08432 6 C 1 px Ryd( 3p) 0.00294 0.82769 7 C 1 py Val( 2p) 1.05698 -0.13971 8 C 1 py Ryd( 3p) 0.00466 0.81309 9 C 1 pz Val( 2p) 0.80921 -0.16288 10 C 1 pz Ryd( 3p) 0.00299 0.66766 11 C 1 dxy Ryd( 3d) 0.00098 2.14724 12 C 1 dxz Ryd( 3d) 0.00071 1.97157 13 C 1 dyz Ryd( 3d) 0.00095 2.00359 14 C 1 dx2y2 Ryd( 3d) 0.00102 2.19372 15 C 1 dz2 Ryd( 3d) 0.00051 1.89885 16 C 2 s Cor( 1s) 1.99999 -10.29865 17 C 2 s Val( 2s) 1.04297 -0.25604 18 C 2 s Ryd( 3s) 0.00243 1.31401 19 C 2 s Ryd( 4s) 0.00002 4.26815 20 C 2 px Val( 2p) 1.07065 -0.12863 21 C 2 px Ryd( 3p) 0.00404 0.60923 22 C 2 py Val( 2p) 1.01238 -0.16494 23 C 2 py Ryd( 3p) 0.00447 0.73001 24 C 2 pz Val( 2p) 1.14793 -0.18010 25 C 2 pz Ryd( 3p) 0.00641 0.84967 26 C 2 dxy Ryd( 3d) 0.00079 2.03837 27 C 2 dxz Ryd( 3d) 0.00070 1.94766 28 C 2 dyz Ryd( 3d) 0.00153 2.01068 29 C 2 dx2y2 Ryd( 3d) 0.00139 2.15986 30 C 2 dz2 Ryd( 3d) 0.00113 2.07910 31 H 3 s Val( 1s) 0.67028 0.09818 32 H 3 s Ryd( 2s) 0.00150 0.60881 33 Br 4 s Cor( 1s) 2.00000 -475.22783 34 Br 4 s Cor( 2s) 2.00000 -50.66828 35 Br 4 s Cor( 3s) 1.99988 -27.53388 36 Br 4 s Val( 4s) 1.91077 -0.75369 37 Br 4 s Ryd( 5s) 0.00125 0.53927 38 Br 4 s Ryd( 6s) 0.00004 2.47484 39 Br 4 s Ryd( 8s) 0.00000 47.45694 40 Br 4 s Ryd( 7s) 0.00000 33.63409 41 Br 4 px Cor( 3p) 2.00000 -22.95315 42 Br 4 px Cor( 2p) 1.99999 -40.02417 43 Br 4 px Val( 4p) 1.87745 -0.30980 44 Br 4 px Ryd( 5p) 0.00062 0.55160 45 Br 4 py Cor( 3p) 2.00000 -22.95913 46 Br 4 py Cor( 2p) 1.99997 -40.02673 47 Br 4 py Val( 4p) 1.45319 -0.28342 48 Br 4 py Ryd( 5p) 0.00137 0.63764 49 Br 4 pz Cor( 3p) 2.00000 -22.95595 50 Br 4 pz Cor( 2p) 1.99999 -40.02538 51 Br 4 pz Val( 4p) 1.66904 -0.29487 52 Br 4 pz Ryd( 5p) 0.00122 0.54540 53 Br 4 dxy Cor( 3d) 2.00000 -2.67705 54 Br 4 dxy Ryd( 4d) 0.00123 0.63825 55 Br 4 dxz Cor( 3d) 2.00000 -2.67419 56 Br 4 dxz Ryd( 4d) 0.00070 0.56453 57 Br 4 dyz Cor( 3d) 1.99999 -2.67965 58 Br 4 dyz Ryd( 4d) 0.00309 0.79809 59 Br 4 dx2y2 Cor( 3d) 1.99999 -2.67707 60 Br 4 dx2y2 Ryd( 4d) 0.00140 0.73066 61 Br 4 dz2 Cor( 3d) 2.00000 -2.67681 62 Br 4 dz2 Ryd( 4d) 0.00086 0.65365 63 C 5 s Cor( 1s) 2.00000 -10.22886 64 C 5 s Val( 2s) 0.87995 -0.09098 65 C 5 s Ryd( 3s) 0.00082 1.10034 66 C 5 s Ryd( 4s) 0.00008 4.33310 67 C 5 px Val( 2p) 1.05888 -0.10894 68 C 5 px Ryd( 3p) 0.00385 0.84812 69 C 5 py Val( 2p) 1.04267 -0.07133 70 C 5 py Ryd( 3p) 0.00378 1.02134 71 C 5 pz Val( 2p) 1.10851 -0.04092 72 C 5 pz Ryd( 3p) 0.00451 0.96812 73 C 5 dxy Ryd( 3d) 0.00060 2.19811 74 C 5 dxz Ryd( 3d) 0.00068 2.07064 75 C 5 dyz Ryd( 3d) 0.00077 2.29459 76 C 5 dx2y2 Ryd( 3d) 0.00035 1.97942 77 C 5 dz2 Ryd( 3d) 0.00075 2.39052 78 C 6 s Cor( 1s) 2.00000 -10.21014 79 C 6 s Val( 2s) 0.96081 -0.10261 80 C 6 s Ryd( 3s) 0.00061 1.22837 81 C 6 s Ryd( 4s) 0.00006 4.18441 82 C 6 px Val( 2p) 1.02568 -0.10024 83 C 6 px Ryd( 3p) 0.00179 0.71698 84 C 6 py Val( 2p) 1.10450 -0.06346 85 C 6 py Ryd( 3p) 0.00336 0.87572 86 C 6 pz Val( 2p) 1.12449 -0.03547 87 C 6 pz Ryd( 3p) 0.00435 0.90431 88 C 6 dxy Ryd( 3d) 0.00067 2.18684 89 C 6 dxz Ryd( 3d) 0.00058 2.00616 90 C 6 dyz Ryd( 3d) 0.00091 2.22572 91 C 6 dx2y2 Ryd( 3d) 0.00054 1.95242 92 C 6 dz2 Ryd( 3d) 0.00080 2.35987 93 C 7 s Cor( 1s) 2.00000 -10.20646 94 C 7 s Val( 2s) 0.97110 -0.10742 95 C 7 s Ryd( 3s) 0.00055 1.26472 96 C 7 s Ryd( 4s) 0.00005 3.99169 97 C 7 px Val( 2p) 1.00419 -0.08756 98 C 7 px Ryd( 3p) 0.00157 0.64892 99 C 7 py Val( 2p) 1.03942 -0.03671 100 C 7 py Ryd( 3p) 0.00340 0.68801 101 C 7 pz Val( 2p) 1.19739 -0.05244 102 C 7 pz Ryd( 3p) 0.00532 1.08827 103 C 7 dxy Ryd( 3d) 0.00061 2.25123 104 C 7 dxz Ryd( 3d) 0.00053 1.94478 105 C 7 dyz Ryd( 3d) 0.00073 2.21371 106 C 7 dx2y2 Ryd( 3d) 0.00052 2.02039 107 C 7 dz2 Ryd( 3d) 0.00107 2.24441 108 C 8 s Cor( 1s) 2.00000 -10.20675 109 C 8 s Val( 2s) 0.97621 -0.10966 110 C 8 s Ryd( 3s) 0.00045 1.26929 111 C 8 s Ryd( 4s) 0.00005 3.97440 112 C 8 px Val( 2p) 1.03091 -0.09803 113 C 8 px Ryd( 3p) 0.00179 0.74435 114 C 8 py Val( 2p) 1.13456 -0.06769 115 C 8 py Ryd( 3p) 0.00384 0.95756 116 C 8 pz Val( 2p) 1.06364 -0.00898 117 C 8 pz Ryd( 3p) 0.00410 0.71423 118 C 8 dxy Ryd( 3d) 0.00083 2.09201 119 C 8 dxz Ryd( 3d) 0.00061 2.03786 120 C 8 dyz Ryd( 3d) 0.00078 2.25061 121 C 8 dx2y2 Ryd( 3d) 0.00050 1.87768 122 C 8 dz2 Ryd( 3d) 0.00079 2.39551 123 C 9 s Cor( 1s) 2.00000 -10.20617 124 C 9 s Val( 2s) 0.97186 -0.10756 125 C 9 s Ryd( 3s) 0.00054 1.27328 126 C 9 s Ryd( 4s) 0.00005 3.97192 127 C 9 px Val( 2p) 1.01688 -0.09123 128 C 9 px Ryd( 3p) 0.00164 0.67982 129 C 9 py Val( 2p) 1.08682 -0.05170 130 C 9 py Ryd( 3p) 0.00365 0.82084 131 C 9 pz Val( 2p) 1.13773 -0.03297 132 C 9 pz Ryd( 3p) 0.00489 0.92040 133 C 9 dxy Ryd( 3d) 0.00067 2.18242 134 C 9 dxz Ryd( 3d) 0.00059 1.99087 135 C 9 dyz Ryd( 3d) 0.00089 2.21029 136 C 9 dx2y2 Ryd( 3d) 0.00051 1.95706 137 C 9 dz2 Ryd( 3d) 0.00080 2.33181 138 C 10 s Cor( 1s) 2.00000 -10.21239 139 C 10 s Val( 2s) 0.96070 -0.10398 140 C 10 s Ryd( 3s) 0.00056 1.21347 141 C 10 s Ryd( 4s) 0.00006 4.05677 142 C 10 px Val( 2p) 0.99986 -0.09399 143 C 10 px Ryd( 3p) 0.00146 0.65911 144 C 10 py Val( 2p) 1.04577 -0.04513 145 C 10 py Ryd( 3p) 0.00277 0.72873 146 C 10 pz Val( 2p) 1.18877 -0.05733 147 C 10 pz Ryd( 3p) 0.00495 1.07628 148 C 10 dxy Ryd( 3d) 0.00062 2.25365 149 C 10 dxz Ryd( 3d) 0.00052 1.95152 150 C 10 dyz Ryd( 3d) 0.00075 2.21460 151 C 10 dx2y2 Ryd( 3d) 0.00055 2.01034 152 C 10 dz2 Ryd( 3d) 0.00102 2.27504 153 H 11 s Val( 1s) 0.74235 0.10409 154 H 11 s Ryd( 2s) 0.00088 0.58059 155 H 12 s Val( 1s) 0.74233 0.11270 156 H 12 s Ryd( 2s) 0.00073 0.57207 157 H 13 s Val( 1s) 0.74405 0.11262 158 H 13 s Ryd( 2s) 0.00070 0.57224 159 H 14 s Val( 1s) 0.74220 0.11305 160 H 14 s Ryd( 2s) 0.00072 0.57161 161 H 15 s Val( 1s) 0.73807 0.10640 162 H 15 s Ryd( 2s) 0.00123 0.59857 163 C 16 s Cor( 1s) 2.00000 -10.26149 164 C 16 s Val( 2s) 0.89670 -0.12210 165 C 16 s Ryd( 3s) 0.00046 0.97404 166 C 16 s Ryd( 4s) 0.00009 4.21333 167 C 16 px Val( 2p) 1.09135 -0.07953 168 C 16 px Ryd( 3p) 0.00561 1.08698 169 C 16 py Val( 2p) 1.08857 -0.09452 170 C 16 py Ryd( 3p) 0.00313 1.00130 171 C 16 pz Val( 2p) 1.05133 -0.13963 172 C 16 pz Ryd( 3p) 0.00140 0.76209 173 C 16 dxy Ryd( 3d) 0.00078 2.28600 174 C 16 dxz Ryd( 3d) 0.00051 1.99515 175 C 16 dyz Ryd( 3d) 0.00058 2.18676 176 C 16 dx2y2 Ryd( 3d) 0.00071 2.31767 177 C 16 dz2 Ryd( 3d) 0.00053 2.05175 178 C 17 s Cor( 1s) 2.00000 -10.25004 179 C 17 s Val( 2s) 0.97574 -0.14085 180 C 17 s Ryd( 3s) 0.00054 1.19719 181 C 17 s Ryd( 4s) 0.00005 4.02805 182 C 17 px Val( 2p) 1.20558 -0.08201 183 C 17 px Ryd( 3p) 0.00456 1.09021 184 C 17 py Val( 2p) 1.00800 -0.06265 185 C 17 py Ryd( 3p) 0.00298 0.77821 186 C 17 pz Val( 2p) 0.89605 -0.12099 187 C 17 pz Ryd( 3p) 0.00117 0.64791 188 C 17 dxy Ryd( 3d) 0.00080 2.24286 189 C 17 dxz Ryd( 3d) 0.00056 1.91009 190 C 17 dyz Ryd( 3d) 0.00058 2.17453 191 C 17 dx2y2 Ryd( 3d) 0.00095 2.21706 192 C 17 dz2 Ryd( 3d) 0.00062 2.02581 193 C 18 s Cor( 1s) 2.00000 -10.23399 194 C 18 s Val( 2s) 0.98297 -0.14099 195 C 18 s Ryd( 3s) 0.00060 1.23316 196 C 18 s Ryd( 4s) 0.00005 3.96675 197 C 18 px Val( 2p) 1.05262 -0.03711 198 C 18 px Ryd( 3p) 0.00438 0.68890 199 C 18 py Val( 2p) 1.16407 -0.09666 200 C 18 py Ryd( 3p) 0.00450 0.97747 201 C 18 pz Val( 2p) 1.02636 -0.12827 202 C 18 pz Ryd( 3p) 0.00158 0.70098 203 C 18 dxy Ryd( 3d) 0.00078 2.24373 204 C 18 dxz Ryd( 3d) 0.00045 2.00155 205 C 18 dyz Ryd( 3d) 0.00081 2.03392 206 C 18 dx2y2 Ryd( 3d) 0.00084 2.25152 207 C 18 dz2 Ryd( 3d) 0.00058 2.00331 208 C 19 s Cor( 1s) 2.00000 -10.25576 209 C 19 s Val( 2s) 0.99903 -0.15997 210 C 19 s Ryd( 3s) 0.00043 1.19771 211 C 19 s Ryd( 4s) 0.00005 3.98642 212 C 19 px Val( 2p) 1.14590 -0.06857 213 C 19 px Ryd( 3p) 0.00475 0.92043 214 C 19 py Val( 2p) 1.04358 -0.07731 215 C 19 py Ryd( 3p) 0.00341 0.78429 216 C 19 pz Val( 2p) 0.88022 -0.12503 217 C 19 pz Ryd( 3p) 0.00117 0.64880 218 C 19 dxy Ryd( 3d) 0.00098 2.19372 219 C 19 dxz Ryd( 3d) 0.00063 1.91091 220 C 19 dyz Ryd( 3d) 0.00067 2.11363 221 C 19 dx2y2 Ryd( 3d) 0.00082 2.22123 222 C 19 dz2 Ryd( 3d) 0.00063 1.99210 223 C 20 s Cor( 1s) 2.00000 -10.23360 224 C 20 s Val( 2s) 0.98234 -0.14018 225 C 20 s Ryd( 3s) 0.00062 1.23753 226 C 20 s Ryd( 4s) 0.00005 3.95502 227 C 20 px Val( 2p) 1.20478 -0.07861 228 C 20 px Ryd( 3p) 0.00543 1.04085 229 C 20 py Val( 2p) 1.04871 -0.06658 230 C 20 py Ryd( 3p) 0.00364 0.69568 231 C 20 pz Val( 2p) 0.99692 -0.11883 232 C 20 pz Ryd( 3p) 0.00139 0.61903 233 C 20 dxy Ryd( 3d) 0.00085 2.20509 234 C 20 dxz Ryd( 3d) 0.00061 1.90735 235 C 20 dyz Ryd( 3d) 0.00056 2.17653 236 C 20 dx2y2 Ryd( 3d) 0.00088 2.21584 237 C 20 dz2 Ryd( 3d) 0.00056 2.02408 238 C 21 s Cor( 1s) 2.00000 -10.25413 239 C 21 s Val( 2s) 0.98182 -0.14966 240 C 21 s Ryd( 3s) 0.00059 1.13797 241 C 21 s Ryd( 4s) 0.00006 4.07463 242 C 21 px Val( 2p) 1.03042 -0.04012 243 C 21 px Ryd( 3p) 0.00350 0.73358 244 C 21 py Val( 2p) 1.12935 -0.10548 245 C 21 py Ryd( 3p) 0.00409 0.98838 246 C 21 pz Val( 2p) 0.93434 -0.13545 247 C 21 pz Ryd( 3p) 0.00147 0.70532 248 C 21 dxy Ryd( 3d) 0.00077 2.24952 249 C 21 dxz Ryd( 3d) 0.00060 1.99416 250 C 21 dyz Ryd( 3d) 0.00082 2.03732 251 C 21 dx2y2 Ryd( 3d) 0.00088 2.24444 252 C 21 dz2 Ryd( 3d) 0.00053 1.99302 253 H 22 s Val( 1s) 0.72719 0.09163 254 H 22 s Ryd( 2s) 0.00084 0.57282 255 H 23 s Val( 1s) 0.72187 0.10622 256 H 23 s Ryd( 2s) 0.00064 0.55688 257 H 24 s Val( 1s) 0.72561 0.09923 258 H 24 s Ryd( 2s) 0.00064 0.55409 259 H 25 s Val( 1s) 0.72301 0.10620 260 H 25 s Ryd( 2s) 0.00064 0.55754 261 H 26 s Val( 1s) 0.72675 0.10334 262 H 26 s Ryd( 2s) 0.00130 0.75367 263 H 27 s Val( 1s) 0.71117 0.07516 264 H 27 s Ryd( 2s) 0.00155 0.59784 Summary of Natural Population Analysis: Natural Population Natural --------------------------------------------- Atom No Charge Core Valence Rydberg Total -------------------------------------------------------------------- C 1 0.06125 2.00000 3.92229 0.01646 5.93875 C 2 -0.29683 1.99999 4.27393 0.02291 6.29683 H 3 0.32822 0.00000 0.67028 0.00150 0.67178 Br 4 0.07797 27.99981 6.91045 0.01178 34.92203 C 5 -0.10619 2.00000 4.09000 0.01619 6.10619 C 6 -0.22917 2.00000 4.21549 0.01368 6.22917 C 7 -0.22646 2.00000 4.21210 0.01436 6.22646 C 8 -0.21907 2.00000 4.20532 0.01375 6.21907 C 9 -0.22752 2.00000 4.21329 0.01423 6.22752 C 10 -0.20838 2.00000 4.19511 0.01327 6.20838 H 11 0.25677 0.00000 0.74235 0.00088 0.74323 H 12 0.25694 0.00000 0.74233 0.00073 0.74306 H 13 0.25524 0.00000 0.74405 0.00070 0.74476 H 14 0.25708 0.00000 0.74220 0.00072 0.74292 H 15 0.26070 0.00000 0.73807 0.00123 0.73930 C 16 -0.14174 2.00000 4.12795 0.01379 6.14174 C 17 -0.09818 2.00000 4.08537 0.01282 6.09818 C 18 -0.24058 2.00000 4.22601 0.01457 6.24058 C 19 -0.08226 2.00000 4.06872 0.01354 6.08226 C 20 -0.24735 2.00000 4.23276 0.01459 6.24735 C 21 -0.08924 2.00000 4.07593 0.01331 6.08924 H 22 0.27197 0.00000 0.72719 0.00084 0.72803 H 23 0.27750 0.00000 0.72187 0.00064 0.72250 H 24 0.27374 0.00000 0.72561 0.00064 0.72626 H 25 0.27635 0.00000 0.72301 0.00064 0.72365 H 26 0.27195 0.00000 0.72675 0.00130 0.72805 H 27 0.28728 0.00000 0.71117 0.00155 0.71272 ==================================================================== * Total * 1.00000 55.99975 73.76963 0.23062 130.00000 Natural Population --------------------------------------------------------- Core 55.99975 ( 99.9996% of 56) Valence 73.76963 ( 99.6887% of 74) Natural Minimal Basis 129.76938 ( 99.8226% of 130) Natural Rydberg Basis 0.23062 ( 0.1774% of 130) --------------------------------------------------------- Atom No Natural Electron Configuration ---------------------------------------------------------------------------- C 1 [core]2s( 1.00)2p( 2.92)3p( 0.01) C 2 [core]2s( 1.04)2p( 3.23)3p( 0.01)3d( 0.01) H 3 1s( 0.67) Br 4 [core]4s( 1.91)4p( 5.00)4d( 0.01) C 5 [core]2s( 0.88)2p( 3.21)3p( 0.01) C 6 [core]2s( 0.96)2p( 3.25)3p( 0.01) C 7 [core]2s( 0.97)2p( 3.24)3p( 0.01) C 8 [core]2s( 0.98)2p( 3.23)3p( 0.01) C 9 [core]2s( 0.97)2p( 3.24)3p( 0.01) C 10 [core]2s( 0.96)2p( 3.23)3p( 0.01) H 11 1s( 0.74) H 12 1s( 0.74) H 13 1s( 0.74) H 14 1s( 0.74) H 15 1s( 0.74) C 16 [core]2s( 0.90)2p( 3.23)3p( 0.01) C 17 [core]2s( 0.98)2p( 3.11)3p( 0.01) C 18 [core]2s( 0.98)2p( 3.24)3p( 0.01) C 19 [core]2s( 1.00)2p( 3.07)3p( 0.01) C 20 [core]2s( 0.98)2p( 3.25)3p( 0.01) C 21 [core]2s( 0.98)2p( 3.09)3p( 0.01) H 22 1s( 0.73) H 23 1s( 0.72) H 24 1s( 0.73) H 25 1s( 0.72) H 26 1s( 0.73) H 27 1s( 0.71) NATURAL BOND ORBITAL ANALYSIS: Occupancies Lewis Structure Low High Max Occ ------------------- ----------------- occ occ Cycle Ctr Thresh Lewis non-Lewis CR BD nC LP (L) (NL) ============================================================================ 1 2 1.90 123.26807 6.73193 28 28 0 9 6 7 2 2 1.66 123.87295 6.12705 28 29 0 8 5 7 3 2 1.65 124.53553 5.46447 28 30 0 7 4 7 4 2 1.64 125.87116 4.12884 28 32 0 5 2 7 5 2 1.63 126.53105 3.46895 28 33 0 4 1 7 6 2 1.53 127.03081 2.96919 28 34 0 3 0 7 7 2 1.51 127.03081 2.96919 28 34 0 3 0 7 8 2 1.50 127.03081 2.96919 28 34 0 3 0 7 9 2 1.53 127.03081 2.96919 28 34 0 3 0 7 ---------------------------------------------------------------------------- Structure accepted: No low occupancy Lewis orbitals ------------------------------------------------------- Core 55.99975 (100.000% of 56) Valence Lewis 71.03106 ( 95.988% of 74) ================== ============================= Total Lewis 127.03081 ( 97.716% of 130) ----------------------------------------------------- Valence non-Lewis 2.81614 ( 2.166% of 130) Rydberg non-Lewis 0.15305 ( 0.118% of 130) ================== ============================= Total non-Lewis 2.96919 ( 2.284% of 130) ------------------------------------------------------- (Occupancy) Bond orbital / Coefficients / Hybrids ------------------ Lewis ------------------------------------------------------ 1. (2.00000) CR ( 1) C 1 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 2. (1.99999) CR ( 1) C 2 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 3. (2.00000) CR ( 1)Br 4 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 4. (2.00000) CR ( 2)Br 4 s(100.00%) 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 5. (1.99988) CR ( 3)Br 4 s(100.00%) 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 6. (2.00000) CR ( 4)Br 4 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 7. (1.99999) CR ( 5)Br 4 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 8. (2.00000) CR ( 6)Br 4 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 9. (1.99997) CR ( 7)Br 4 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 10. (2.00000) CR ( 8)Br 4 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 11. (1.99999) CR ( 9)Br 4 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 12. (2.00000) CR (10)Br 4 s( 0.00%)p 0.00( 0.00%)d 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 13. (2.00000) CR (11)Br 4 s( 0.00%)p 0.00( 0.00%)d 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 14. (1.99999) CR (12)Br 4 s( 0.00%)p 0.00( 0.00%)d 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 15. (1.99999) CR (13)Br 4 s( 0.00%)p 0.00( 0.00%)d 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 16. (2.00000) CR (14)Br 4 s( 0.00%)p 0.00( 0.00%)d 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 17. (2.00000) CR ( 1) C 5 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 18. (2.00000) CR ( 1) C 6 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 19. (2.00000) CR ( 1) C 7 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 20. (2.00000) CR ( 1) C 8 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 21. (2.00000) CR ( 1) C 9 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 22. (2.00000) CR ( 1) C 10 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 23. (2.00000) CR ( 1) C 16 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 24. (2.00000) CR ( 1) C 17 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 25. (2.00000) CR ( 1) C 18 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 26. (2.00000) CR ( 1) C 19 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 27. (2.00000) CR ( 1) C 20 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 28. (2.00000) CR ( 1) C 21 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 29. (1.99665) LP ( 1)Br 4 s( 89.27%)p 0.12( 10.73%)d 0.00( 0.00%) 0.0000 0.0000 0.0000 0.9448 0.0052 -0.0001 0.0000 0.0000 0.0000 0.0000 -0.0868 0.0016 0.0000 0.0000 -0.2222 -0.0036 0.0000 0.0000 0.2245 0.0029 0.0000 0.0020 0.0000 -0.0017 0.0000 -0.0014 0.0000 -0.0018 0.0000 0.0013 30. (1.98284) LP ( 2)Br 4 s( 0.31%)p99.99( 99.66%)d 0.08( 0.03%) 0.0000 0.0000 0.0000 0.0560 -0.0013 0.0005 -0.0004 0.0000 0.0000 0.0000 0.1162 -0.0023 0.0000 0.0000 -0.6028 0.0073 0.0000 0.0000 -0.7872 0.0089 0.0000 -0.0050 0.0000 -0.0029 0.0000 0.0047 0.0000 -0.0078 0.0000 -0.0122 31. (1.90219) LP ( 3)Br 4 s( 1.68%)p58.38( 98.28%)d 0.02( 0.04%) 0.0000 0.0000 0.0000 0.1297 -0.0033 0.0004 -0.0001 0.0000 0.0000 0.0000 0.9741 -0.0085 0.0000 0.0000 0.1834 0.0004 0.0000 0.0000 0.0126 -0.0022 0.0000 -0.0133 0.0000 0.0104 0.0000 0.0037 0.0000 0.0092 0.0000 -0.0006 32. (1.98230) BD ( 1) C 1- C 2 ( 49.73%) 0.7052* C 1 s( 34.40%)p 1.91( 65.54%)d 0.00( 0.07%) 0.0000 0.5864 -0.0078 -0.0003 -0.8031 -0.0009 -0.0901 0.0086 -0.0455 0.0123 0.0032 0.0039 0.0017 0.0215 -0.0137 ( 50.27%) 0.7090* C 2 s( 29.31%)p 2.41( 70.61%)d 0.00( 0.08%) 0.0000 0.5410 -0.0216 0.0000 0.8388 0.0290 -0.0364 0.0020 -0.0039 0.0166 0.0017 -0.0015 0.0000 0.0242 -0.0138 33. (1.98242) BD ( 1) C 1- C 16 ( 49.23%) 0.7016* C 1 s( 37.97%)p 1.63( 61.95%)d 0.00( 0.07%) 0.0000 0.6160 -0.0154 -0.0035 0.5234 0.0109 -0.4953 -0.0028 -0.3165 -0.0021 -0.0189 -0.0120 0.0124 0.0018 -0.0071 ( 50.77%) 0.7125* C 16 s( 34.12%)p 1.93( 65.82%)d 0.00( 0.05%) 0.0000 0.5841 -0.0084 -0.0004 -0.6108 -0.0012 0.4646 0.0005 0.2633 0.0012 -0.0164 -0.0096 0.0097 0.0039 -0.0089 34. (1.53394) BD ( 2) C 1- C 16 ( 36.51%) 0.6043* C 1 s( 0.01%)p 1.00( 99.91%)d 0.00( 0.08%) 0.0000 -0.0062 0.0073 -0.0005 -0.0150 0.0053 0.5213 -0.0009 -0.8527 -0.0054 0.0087 -0.0156 0.0096 0.0090 0.0179 ( 63.49%) 0.7968* C 16 s( 0.00%)p 1.00( 99.99%)d 0.00( 0.01%) 0.0000 -0.0042 0.0003 0.0000 -0.0111 -0.0002 0.4860 0.0012 -0.8738 -0.0034 -0.0032 0.0053 -0.0042 -0.0039 -0.0069 35. (1.97790) BD ( 1) C 1- H 27 ( 64.37%) 0.8023* C 1 s( 27.61%)p 2.62( 72.29%)d 0.00( 0.09%) 0.0000 0.5252 0.0182 0.0034 0.2826 -0.0057 0.6879 -0.0108 0.4119 -0.0015 0.0133 0.0081 0.0220 -0.0126 -0.0062 ( 35.63%) 0.5969* H 27 s(100.00%) 1.0000 0.0029 36. (1.96206) BD ( 1) C 2- H 3 ( 66.32%) 0.8144* C 2 s( 25.20%)p 2.96( 74.71%)d 0.00( 0.09%) 0.0000 0.5020 0.0075 0.0008 -0.3065 -0.0090 0.2942 0.0004 0.7526 -0.0078 -0.0052 -0.0120 0.0180 0.0000 0.0195 ( 33.68%) 0.5803* H 3 s(100.00%) 1.0000 0.0040 37. (1.90446) BD ( 1) C 2-Br 4 ( 47.02%) 0.6857* C 2 s( 11.74%)p 7.51( 88.14%)d 0.01( 0.12%) 0.0000 0.3404 0.0387 -0.0001 -0.1896 -0.0223 0.7108 -0.0233 -0.5817 0.0297 0.0011 -0.0018 -0.0301 -0.0170 0.0005 ( 52.98%) 0.7279*Br 4 s( 8.79%)p10.33( 90.80%)d 0.05( 0.41%) 0.0000 0.0000 0.0000 -0.2949 0.0309 -0.0003 -0.0003 -0.0001 0.0000 0.0000 0.1717 0.0003 0.0000 0.0000 -0.7413 -0.0305 0.0000 0.0000 0.5721 0.0271 0.0000 -0.0142 0.0000 0.0122 0.0000 -0.0535 0.0000 -0.0302 0.0000 0.0006 38. (1.98067) BD ( 1) C 2- C 5 ( 51.70%) 0.7190* C 2 s( 33.92%)p 1.95( 66.03%)d 0.00( 0.05%) 0.0000 0.5822 -0.0139 -0.0008 -0.4043 -0.0164 -0.6355 -0.0002 -0.3045 0.0043 0.0147 0.0061 0.0125 -0.0074 -0.0080 ( 48.30%) 0.6950* C 5 s( 30.26%)p 2.30( 69.69%)d 0.00( 0.05%) 0.0000 0.5500 -0.0022 0.0017 0.4377 -0.0125 0.6794 -0.0005 0.2086 -0.0034 0.0188 0.0059 0.0079 -0.0075 -0.0063 39. (1.97510) BD ( 1) C 5- C 6 ( 51.62%) 0.7185* C 5 s( 35.20%)p 1.84( 64.75%)d 0.00( 0.05%) 0.0000 0.5933 0.0004 -0.0008 -0.1229 -0.0024 -0.1624 0.0122 -0.7783 -0.0103 0.0037 0.0046 0.0067 -0.0018 0.0199 ( 48.38%) 0.6955* C 6 s( 34.70%)p 1.88( 65.23%)d 0.00( 0.07%) 0.0000 0.5890 -0.0047 -0.0024 0.1681 0.0054 0.1906 0.0221 0.7663 0.0034 0.0047 0.0076 0.0070 -0.0015 0.0233 40. (1.96908) BD ( 1) C 5- C 10 ( 51.64%) 0.7186* C 5 s( 34.47%)p 1.90( 65.48%)d 0.00( 0.05%) 0.0000 0.5871 -0.0012 -0.0009 -0.2893 -0.0019 -0.4704 -0.0013 0.5913 0.0135 0.0099 -0.0076 -0.0153 -0.0053 0.0093 ( 48.36%) 0.6954* C 10 s( 34.93%)p 1.86( 65.00%)d 0.00( 0.07%) 0.0000 0.5910 -0.0062 -0.0020 0.2700 0.0097 0.5098 0.0168 -0.5628 0.0080 0.0114 -0.0098 -0.0177 -0.0062 0.0099 41. (1.66728) BD ( 2) C 5- C 10 ( 53.15%) 0.7290* C 5 s( 0.01%)p99.99( 99.96%)d 1.89( 0.02%) 0.0000 0.0022 0.0111 0.0007 0.8420 -0.0130 -0.5387 0.0033 -0.0187 0.0035 -0.0067 0.0076 -0.0034 -0.0114 -0.0003 ( 46.85%) 0.6845* C 10 s( 0.00%)p 1.00( 99.95%)d 0.00( 0.05%) 0.0000 0.0028 0.0014 -0.0003 0.8609 -0.0026 -0.5064 -0.0007 -0.0428 0.0018 0.0027 -0.0178 0.0104 0.0051 0.0007 42. (1.97950) BD ( 1) C 6- C 7 ( 50.59%) 0.7113* C 6 s( 35.75%)p 1.80( 64.19%)d 0.00( 0.06%) 0.0000 0.5978 -0.0114 -0.0005 -0.4056 -0.0081 -0.6583 -0.0051 -0.2065 -0.0374 0.0199 0.0037 0.0055 -0.0106 -0.0084 ( 49.41%) 0.7029* C 7 s( 35.23%)p 1.84( 64.70%)d 0.00( 0.07%) 0.0000 0.5935 -0.0092 -0.0003 0.4095 0.0109 0.6691 0.0218 0.1740 -0.0283 0.0198 0.0062 0.0094 -0.0100 -0.0067 43. (1.65872) BD ( 2) C 6- C 7 ( 50.23%) 0.7087* C 6 s( 0.01%)p 1.00( 99.95%)d 0.00( 0.04%) 0.0000 -0.0044 0.0079 -0.0011 0.8558 -0.0111 -0.5135 0.0058 -0.0567 -0.0013 -0.0104 0.0066 -0.0028 -0.0168 -0.0015 ( 49.77%) 0.7055* C 7 s( 0.00%)p 1.00( 99.95%)d 0.00( 0.05%) 0.0000 0.0000 0.0022 -0.0005 0.8573 -0.0113 -0.5118 0.0048 -0.0491 0.0001 0.0060 0.0131 -0.0087 0.0135 -0.0014 44. (1.98141) BD ( 1) C 6- H 15 ( 63.21%) 0.7951* C 6 s( 29.46%)p 2.39( 70.46%)d 0.00( 0.07%) 0.0000 0.5427 0.0124 0.0022 0.2717 -0.0104 0.5151 -0.0135 -0.6043 -0.0001 0.0111 -0.0102 -0.0198 -0.0072 0.0083 ( 36.79%) 0.6065* H 15 s(100.00%) 1.0000 0.0027 45. (1.98197) BD ( 1) C 7- C 8 ( 50.10%) 0.7078* C 7 s( 35.20%)p 1.84( 64.73%)d 0.00( 0.06%) 0.0000 0.5933 -0.0080 -0.0008 -0.2702 -0.0191 -0.5064 -0.0307 0.5625 -0.0114 0.0102 -0.0090 -0.0178 -0.0065 0.0101 ( 49.90%) 0.7064* C 8 s( 35.15%)p 1.84( 64.78%)d 0.00( 0.07%) 0.0000 0.5928 -0.0082 -0.0006 0.2607 -0.0077 0.4762 -0.0098 -0.5930 -0.0351 0.0122 -0.0095 -0.0179 -0.0075 0.0067 46. (1.98258) BD ( 1) C 7- H 14 ( 62.93%) 0.7933* C 7 s( 29.50%)p 2.39( 70.43%)d 0.00( 0.07%) 0.0000 0.5429 0.0137 0.0009 -0.1525 0.0023 -0.1781 0.0024 -0.8057 0.0154 0.0037 0.0077 0.0087 -0.0012 0.0240 ( 37.07%) 0.6089* H 14 s(100.00%) 1.0000 0.0016 47. (1.98205) BD ( 1) C 8- C 9 ( 49.92%) 0.7065* C 8 s( 35.23%)p 1.84( 64.71%)d 0.00( 0.07%) 0.0000 0.5935 -0.0083 -0.0006 0.1329 -0.0133 0.1568 -0.0237 0.7768 0.0254 0.0052 0.0078 0.0099 -0.0022 0.0217 ( 50.08%) 0.7077* C 9 s( 35.31%)p 1.83( 64.63%)d 0.00( 0.06%) 0.0000 0.5941 -0.0080 -0.0008 -0.1432 -0.0194 -0.1994 -0.0317 -0.7646 -0.0066 0.0041 0.0058 0.0069 -0.0018 0.0233 48. (1.64088) BD ( 2) C 8- C 9 ( 49.46%) 0.7033* C 8 s( 0.00%)p 1.00( 99.95%)d 0.00( 0.05%) 0.0000 0.0019 -0.0007 0.0001 -0.8550 0.0117 0.5163 -0.0069 0.0406 -0.0002 -0.0074 -0.0119 0.0079 -0.0150 0.0008 ( 50.54%) 0.7109* C 9 s( 0.00%)p 1.00( 99.95%)d 0.00( 0.05%) 0.0000 0.0025 -0.0005 0.0001 -0.8564 0.0119 0.5150 -0.0073 0.0281 -0.0007 -0.0038 0.0175 -0.0104 -0.0060 -0.0012 49. (1.98309) BD ( 1) C 8- H 13 ( 62.85%) 0.7928* C 8 s( 29.56%)p 2.38( 70.37%)d 0.00( 0.07%) 0.0000 0.5435 0.0132 0.0010 -0.4269 0.0081 -0.6932 0.0129 -0.2017 0.0038 0.0208 0.0056 0.0087 -0.0103 -0.0093 ( 37.15%) 0.6095* H 13 s(100.00%) 1.0000 0.0016 50. (1.97891) BD ( 1) C 9- C 10 ( 49.49%) 0.7035* C 9 s( 35.09%)p 1.85( 64.84%)d 0.00( 0.07%) 0.0000 0.5923 -0.0094 -0.0002 0.4064 0.0050 0.6614 0.0069 0.2110 0.0363 0.0205 0.0041 0.0063 -0.0107 -0.0083 ( 50.51%) 0.7107* C 10 s( 35.63%)p 1.81( 64.31%)d 0.00( 0.06%) 0.0000 0.5968 -0.0109 -0.0004 -0.4044 -0.0105 -0.6693 -0.0200 -0.1739 0.0295 0.0189 0.0059 0.0096 -0.0103 -0.0061 51. (1.98228) BD ( 1) C 9- H 12 ( 62.91%) 0.7932* C 9 s( 29.54%)p 2.38( 70.39%)d 0.00( 0.07%) 0.0000 0.5433 0.0139 0.0009 -0.2826 0.0051 -0.5057 0.0090 0.6066 -0.0124 0.0109 -0.0107 -0.0193 -0.0064 0.0089 ( 37.09%) 0.6090* H 12 s(100.00%) 1.0000 0.0016 52. (1.98208) BD ( 1) C 10- H 11 ( 62.92%) 0.7932* C 10 s( 29.36%)p 2.40( 70.56%)d 0.00( 0.07%) 0.0000 0.5417 0.0135 0.0018 0.1470 -0.0084 0.1847 -0.0128 0.8060 -0.0101 0.0041 0.0075 0.0099 -0.0016 0.0239 ( 37.08%) 0.6090* H 11 s(100.00%) 1.0000 0.0019 53. (1.97692) BD ( 1) C 16- C 17 ( 52.09%) 0.7218* C 16 s( 33.71%)p 1.97( 66.24%)d 0.00( 0.05%) 0.0000 0.5806 0.0032 -0.0003 -0.1448 -0.0108 -0.6994 0.0047 -0.3900 0.0029 0.0053 0.0026 0.0164 -0.0115 -0.0058 ( 47.91%) 0.6921* C 17 s( 33.07%)p 2.02( 66.86%)d 0.00( 0.07%) 0.0000 0.5750 -0.0049 -0.0022 0.1061 -0.0182 0.7170 0.0071 0.3781 0.0042 0.0074 0.0038 0.0196 -0.0144 -0.0071 54. (1.97493) BD ( 1) C 16- C 21 ( 51.97%) 0.7209* C 16 s( 32.10%)p 2.11( 67.85%)d 0.00( 0.05%) 0.0000 0.5665 0.0040 0.0006 0.7780 -0.0078 0.2416 0.0051 0.1218 0.0022 0.0111 0.0054 0.0057 0.0133 -0.0120 ( 48.03%) 0.6930* C 21 s( 33.47%)p 1.99( 66.46%)d 0.00( 0.07%) 0.0000 0.5786 -0.0031 -0.0025 -0.7702 -0.0094 -0.2403 0.0124 -0.1154 0.0066 0.0136 0.0066 0.0056 0.0159 -0.0136 55. (1.98263) BD ( 1) C 17- C 18 ( 50.32%) 0.7094* C 17 s( 36.15%)p 1.76( 63.78%)d 0.00( 0.07%) 0.0000 0.6012 -0.0118 -0.0002 0.6158 -0.0079 -0.4389 -0.0315 -0.2543 -0.0167 -0.0162 -0.0096 0.0081 0.0101 -0.0113 ( 49.68%) 0.7048* C 18 s( 35.44%)p 1.82( 64.49%)d 0.00( 0.07%) 0.0000 0.5952 -0.0106 -0.0004 -0.6336 -0.0343 0.4264 -0.0143 0.2455 -0.0068 -0.0183 -0.0106 0.0114 0.0045 -0.0105 56. (1.64888) BD ( 2) C 17- C 18 ( 46.12%) 0.6791* C 17 s( 0.00%)p 1.00( 99.94%)d 0.00( 0.06%) 0.0000 0.0012 -0.0004 0.0000 0.0280 -0.0008 -0.4701 0.0017 0.8818 -0.0033 -0.0118 0.0218 -0.0024 -0.0016 -0.0048 ( 53.88%) 0.7340* C 18 s( 0.00%)p 1.00( 99.94%)d 0.00( 0.06%) 0.0000 -0.0004 -0.0002 0.0001 0.0238 -0.0004 -0.4715 0.0051 0.8811 -0.0096 0.0028 -0.0040 0.0125 0.0095 0.0169 57. (1.98078) BD ( 1) C 17- H 26 ( 63.76%) 0.7985* C 17 s( 30.70%)p 2.26( 69.23%)d 0.00( 0.07%) 0.0000 0.5539 0.0125 0.0018 -0.7792 0.0204 -0.2662 -0.0052 -0.1179 -0.0025 0.0133 0.0055 0.0039 0.0172 -0.0136 ( 36.24%) 0.6020* H 26 s(100.00%) 1.0000 0.0020 58. (1.98372) BD ( 1) C 18- C 19 ( 50.00%) 0.7071* C 18 s( 34.14%)p 1.93( 65.79%)d 0.00( 0.07%) 0.0000 0.5842 -0.0083 -0.0004 0.7617 0.0272 0.2515 -0.0231 0.1143 -0.0131 0.0145 0.0068 0.0056 0.0149 -0.0133 ( 50.00%) 0.7071* C 19 s( 35.08%)p 1.85( 64.85%)d 0.00( 0.07%) 0.0000 0.5923 -0.0079 -0.0008 -0.7467 -0.0011 -0.2686 -0.0319 -0.1320 -0.0172 0.0113 0.0051 0.0040 0.0180 -0.0138 59. (1.98180) BD ( 1) C 18- H 25 ( 63.89%) 0.7993* C 18 s( 30.36%)p 2.29( 69.57%)d 0.00( 0.07%) 0.0000 0.5508 0.0147 0.0006 -0.1233 0.0027 -0.7286 0.0159 -0.3864 0.0084 0.0055 0.0028 0.0193 -0.0150 -0.0064 ( 36.11%) 0.6009* H 25 s(100.00%) 1.0000 0.0018 60. (1.98336) BD ( 1) C 19- C 20 ( 49.96%) 0.7068* C 19 s( 35.20%)p 1.84( 64.74%)d 0.00( 0.07%) 0.0000 0.5932 -0.0079 -0.0009 0.1542 0.0354 0.6946 0.0072 0.3738 0.0031 0.0047 0.0024 0.0198 -0.0149 -0.0062 ( 50.04%) 0.7074* C 20 s( 34.18%)p 1.92( 65.75%)d 0.00( 0.07%) 0.0000 0.5846 -0.0080 -0.0005 -0.1235 0.0316 -0.7036 -0.0186 -0.3819 -0.0109 0.0090 0.0047 0.0192 -0.0131 -0.0069 61. (1.98352) BD ( 1) C 19- H 24 ( 63.75%) 0.7984* C 19 s( 29.65%)p 2.37( 70.28%)d 0.00( 0.08%) 0.0000 0.5444 0.0126 0.0014 0.6451 -0.0140 -0.4643 0.0103 -0.2658 0.0058 -0.0193 -0.0111 0.0097 0.0069 -0.0107 ( 36.25%) 0.6021* H 24 s(100.00%) 1.0000 0.0018 62. (1.98316) BD ( 1) C 20- C 21 ( 49.68%) 0.7048* C 20 s( 35.24%)p 1.84( 64.69%)d 0.00( 0.07%) 0.0000 0.5935 -0.0114 0.0000 -0.6068 0.0082 0.4563 0.0329 0.2627 0.0178 -0.0173 -0.0103 0.0091 0.0096 -0.0117 ( 50.32%) 0.7094* C 21 s( 36.37%)p 1.75( 63.57%)d 0.00( 0.07%) 0.0000 0.6029 -0.0133 -0.0007 0.6237 0.0329 -0.4281 0.0154 -0.2490 0.0078 -0.0177 -0.0103 0.0110 0.0041 -0.0099 63. (1.63693) BD ( 2) C 20- C 21 ( 54.35%) 0.7372* C 20 s( 0.00%)p 1.00( 99.94%)d 0.00( 0.06%) 0.0000 0.0002 0.0000 0.0000 0.0195 -0.0002 -0.4793 0.0050 0.8770 -0.0095 0.0114 -0.0208 -0.0006 -0.0007 0.0004 ( 45.65%) 0.6757* C 21 s( 0.00%)p 1.00( 99.94%)d 0.00( 0.06%) 0.0000 0.0017 0.0000 0.0000 0.0195 -0.0001 -0.4794 0.0016 0.8770 -0.0028 -0.0056 0.0091 -0.0120 -0.0092 -0.0169 64. (1.98165) BD ( 1) C 20- H 23 ( 63.95%) 0.7997* C 20 s( 30.53%)p 2.27( 69.40%)d 0.00( 0.07%) 0.0000 0.5523 0.0152 0.0004 0.7836 -0.0173 0.2547 -0.0059 0.1216 -0.0029 0.0122 0.0057 0.0042 0.0171 -0.0133 ( 36.05%) 0.6004* H 23 s(100.00%) 1.0000 0.0018 65. (1.98242) BD ( 1) C 21- H 22 ( 63.66%) 0.7979* C 21 s( 30.07%)p 2.32( 69.86%)d 0.00( 0.07%) 0.0000 0.5482 0.0128 0.0025 0.1258 0.0107 0.7264 -0.0152 0.3933 -0.0087 0.0056 0.0029 0.0202 -0.0159 -0.0061 ( 36.34%) 0.6028* H 22 s(100.00%) 1.0000 0.0020 ---------------- non-Lewis ---------------------------------------------------- 66. (0.80942) LV ( 1) C 19 s( 0.00%)p 1.00( 99.95%)d 0.00( 0.05%) 0.0000 0.0011 -0.0001 0.0000 0.0173 -0.0002 -0.4774 0.0038 0.8782 -0.0075 0.0081 -0.0145 0.0074 0.0056 0.0108 67. (0.02463) BD*( 1) C 1- C 2 ( 50.27%) 0.7090* C 1 s( 34.40%)p 1.91( 65.54%)d 0.00( 0.07%) 0.0000 0.5864 -0.0078 -0.0003 -0.8031 -0.0009 -0.0901 0.0086 -0.0455 0.0123 0.0032 0.0039 0.0017 0.0215 -0.0137 ( 49.73%) -0.7052* C 2 s( 29.31%)p 2.41( 70.61%)d 0.00( 0.08%) 0.0000 0.5410 -0.0216 0.0000 0.8388 0.0290 -0.0364 0.0020 -0.0039 0.0166 0.0017 -0.0015 0.0000 0.0242 -0.0138 68. (0.02097) BD*( 1) C 1- C 16 ( 50.77%) 0.7125* C 1 s( 37.97%)p 1.63( 61.95%)d 0.00( 0.07%) 0.0000 0.6160 -0.0154 -0.0035 0.5234 0.0109 -0.4953 -0.0028 -0.3165 -0.0021 -0.0189 -0.0120 0.0124 0.0018 -0.0071 ( 49.23%) -0.7016* C 16 s( 34.12%)p 1.93( 65.82%)d 0.00( 0.05%) 0.0000 0.5841 -0.0084 -0.0004 -0.6108 -0.0012 0.4646 0.0005 0.2633 0.0012 -0.0164 -0.0096 0.0097 0.0039 -0.0089 69. (0.16446) BD*( 2) C 1- C 16 ( 63.49%) 0.7968* C 1 s( 0.01%)p 1.00( 99.91%)d 0.00( 0.08%) 0.0000 -0.0062 0.0073 -0.0005 -0.0150 0.0053 0.5213 -0.0009 -0.8527 -0.0054 0.0087 -0.0156 0.0096 0.0090 0.0179 ( 36.51%) -0.6043* C 16 s( 0.00%)p 1.00( 99.99%)d 0.00( 0.01%) 0.0000 -0.0042 0.0003 0.0000 -0.0111 -0.0002 0.4860 0.0012 -0.8738 -0.0034 -0.0032 0.0053 -0.0042 -0.0039 -0.0069 70. (0.00985) BD*( 1) C 1- H 27 ( 35.63%) 0.5969* C 1 s( 27.61%)p 2.62( 72.29%)d 0.00( 0.09%) 0.0000 -0.5252 -0.0182 -0.0034 -0.2826 0.0057 -0.6879 0.0108 -0.4119 0.0015 -0.0133 -0.0081 -0.0220 0.0126 0.0062 ( 64.37%) -0.8023* H 27 s(100.00%) -1.0000 -0.0029 71. (0.01425) BD*( 1) C 2- H 3 ( 33.68%) 0.5803* C 2 s( 25.20%)p 2.96( 74.71%)d 0.00( 0.09%) 0.0000 -0.5020 -0.0075 -0.0008 0.3065 0.0090 -0.2942 -0.0004 -0.7526 0.0078 0.0052 0.0120 -0.0180 0.0000 -0.0195 ( 66.32%) -0.8144* H 3 s(100.00%) -1.0000 -0.0040 72. (0.05930) BD*( 1) C 2-Br 4 ( 52.98%) 0.7279* C 2 s( 11.74%)p 7.51( 88.14%)d 0.01( 0.12%) 0.0000 0.3404 0.0387 -0.0001 -0.1896 -0.0223 0.7108 -0.0233 -0.5817 0.0297 0.0011 -0.0018 -0.0301 -0.0170 0.0005 ( 47.02%) -0.6857*Br 4 s( 8.79%)p10.33( 90.80%)d 0.05( 0.41%) 0.0000 0.0000 0.0000 -0.2949 0.0309 -0.0003 -0.0003 -0.0001 0.0000 0.0000 0.1717 0.0003 0.0000 0.0000 -0.7413 -0.0305 0.0000 0.0000 0.5721 0.0271 0.0000 -0.0142 0.0000 0.0122 0.0000 -0.0535 0.0000 -0.0302 0.0000 0.0006 73. (0.03266) BD*( 1) C 2- C 5 ( 48.30%) 0.6950* C 2 s( 33.92%)p 1.95( 66.03%)d 0.00( 0.05%) 0.0000 0.5822 -0.0139 -0.0008 -0.4043 -0.0164 -0.6355 -0.0002 -0.3045 0.0043 0.0147 0.0061 0.0125 -0.0074 -0.0080 ( 51.70%) -0.7190* C 5 s( 30.26%)p 2.30( 69.69%)d 0.00( 0.05%) 0.0000 0.5500 -0.0022 0.0017 0.4377 -0.0125 0.6794 -0.0005 0.2086 -0.0034 0.0188 0.0059 0.0079 -0.0075 -0.0063 74. (0.02320) BD*( 1) C 5- C 6 ( 48.38%) 0.6955* C 5 s( 35.20%)p 1.84( 64.75%)d 0.00( 0.05%) 0.0000 -0.5933 -0.0004 0.0008 0.1229 0.0024 0.1624 -0.0122 0.7783 0.0103 -0.0037 -0.0046 -0.0067 0.0018 -0.0199 ( 51.62%) -0.7185* C 6 s( 34.70%)p 1.88( 65.23%)d 0.00( 0.07%) 0.0000 -0.5890 0.0047 0.0024 -0.1681 -0.0054 -0.1906 -0.0221 -0.7663 -0.0034 -0.0047 -0.0076 -0.0070 0.0015 -0.0233 75. (0.02191) BD*( 1) C 5- C 10 ( 48.36%) 0.6954* C 5 s( 34.47%)p 1.90( 65.48%)d 0.00( 0.05%) 0.0000 -0.5871 0.0012 0.0009 0.2893 0.0019 0.4704 0.0013 -0.5913 -0.0135 -0.0099 0.0076 0.0153 0.0053 -0.0093 ( 51.64%) -0.7186* C 10 s( 34.93%)p 1.86( 65.00%)d 0.00( 0.07%) 0.0000 -0.5910 0.0062 0.0020 -0.2700 -0.0097 -0.5098 -0.0168 0.5628 -0.0080 -0.0114 0.0098 0.0177 0.0062 -0.0099 76. (0.37188) BD*( 2) C 5- C 10 ( 46.85%) 0.6845* C 5 s( 0.01%)p99.99( 99.96%)d 1.89( 0.02%) 0.0000 0.0022 0.0111 0.0007 0.8420 -0.0130 -0.5387 0.0033 -0.0187 0.0035 -0.0067 0.0076 -0.0034 -0.0114 -0.0003 ( 53.15%) -0.7290* C 10 s( 0.00%)p 1.00( 99.95%)d 0.00( 0.05%) 0.0000 0.0028 0.0014 -0.0003 0.8609 -0.0026 -0.5064 -0.0007 -0.0428 0.0018 0.0027 -0.0178 0.0104 0.0051 0.0007 77. (0.01357) BD*( 1) C 6- C 7 ( 49.41%) 0.7029* C 6 s( 35.75%)p 1.80( 64.19%)d 0.00( 0.06%) 0.0000 -0.5978 0.0114 0.0005 0.4056 0.0081 0.6583 0.0051 0.2065 0.0374 -0.0199 -0.0037 -0.0055 0.0106 0.0084 ( 50.59%) -0.7113* C 7 s( 35.23%)p 1.84( 64.70%)d 0.00( 0.07%) 0.0000 -0.5935 0.0092 0.0003 -0.4095 -0.0109 -0.6691 -0.0218 -0.1740 0.0283 -0.0198 -0.0062 -0.0094 0.0100 0.0067 78. (0.30941) BD*( 2) C 6- C 7 ( 49.77%) 0.7055* C 6 s( 0.01%)p 1.00( 99.95%)d 0.00( 0.04%) 0.0000 -0.0044 0.0079 -0.0011 0.8558 -0.0111 -0.5135 0.0058 -0.0567 -0.0013 -0.0104 0.0066 -0.0028 -0.0168 -0.0015 ( 50.23%) -0.7087* C 7 s( 0.00%)p 1.00( 99.95%)d 0.00( 0.05%) 0.0000 0.0000 0.0022 -0.0005 0.8573 -0.0113 -0.5118 0.0048 -0.0491 0.0001 0.0060 0.0131 -0.0087 0.0135 -0.0014 79. (0.01444) BD*( 1) C 6- H 15 ( 36.79%) 0.6065* C 6 s( 29.46%)p 2.39( 70.46%)d 0.00( 0.07%) 0.0000 -0.5427 -0.0124 -0.0022 -0.2717 0.0104 -0.5151 0.0135 0.6043 0.0001 -0.0111 0.0102 0.0198 0.0072 -0.0083 ( 63.21%) -0.7951* H 15 s(100.00%) -1.0000 -0.0027 80. (0.01433) BD*( 1) C 7- C 8 ( 49.90%) 0.7064* C 7 s( 35.20%)p 1.84( 64.73%)d 0.00( 0.06%) 0.0000 -0.5933 0.0080 0.0008 0.2702 0.0191 0.5064 0.0307 -0.5625 0.0114 -0.0102 0.0090 0.0178 0.0065 -0.0101 ( 50.10%) -0.7078* C 8 s( 35.15%)p 1.84( 64.78%)d 0.00( 0.07%) 0.0000 -0.5928 0.0082 0.0006 -0.2607 0.0077 -0.4762 0.0098 0.5930 0.0351 -0.0122 0.0095 0.0179 0.0075 -0.0067 81. (0.01142) BD*( 1) C 7- H 14 ( 37.07%) 0.6089* C 7 s( 29.50%)p 2.39( 70.43%)d 0.00( 0.07%) 0.0000 -0.5429 -0.0137 -0.0009 0.1525 -0.0023 0.1781 -0.0024 0.8057 -0.0154 -0.0037 -0.0077 -0.0087 0.0012 -0.0240 ( 62.93%) -0.7933* H 14 s(100.00%) -1.0000 -0.0016 82. (0.01416) BD*( 1) C 8- C 9 ( 50.08%) 0.7077* C 8 s( 35.23%)p 1.84( 64.71%)d 0.00( 0.07%) 0.0000 0.5935 -0.0083 -0.0006 0.1329 -0.0133 0.1568 -0.0237 0.7768 0.0254 0.0052 0.0078 0.0099 -0.0022 0.0217 ( 49.92%) -0.7065* C 9 s( 35.31%)p 1.83( 64.63%)d 0.00( 0.06%) 0.0000 0.5941 -0.0080 -0.0008 -0.1432 -0.0194 -0.1994 -0.0317 -0.7646 -0.0066 0.0041 0.0058 0.0069 -0.0018 0.0233 83. (0.30876) BD*( 2) C 8- C 9 ( 50.54%) 0.7109* C 8 s( 0.00%)p 1.00( 99.95%)d 0.00( 0.05%) 0.0000 -0.0019 0.0007 -0.0001 0.8550 -0.0117 -0.5163 0.0069 -0.0406 0.0002 0.0074 0.0119 -0.0079 0.0150 -0.0008 ( 49.46%) -0.7033* C 9 s( 0.00%)p 1.00( 99.95%)d 0.00( 0.05%) 0.0000 -0.0025 0.0005 -0.0001 0.8564 -0.0119 -0.5150 0.0073 -0.0281 0.0007 0.0038 -0.0175 0.0104 0.0060 0.0012 84. (0.01160) BD*( 1) C 8- H 13 ( 37.15%) 0.6095* C 8 s( 29.56%)p 2.38( 70.37%)d 0.00( 0.07%) 0.0000 -0.5435 -0.0132 -0.0010 0.4269 -0.0081 0.6932 -0.0129 0.2017 -0.0038 -0.0208 -0.0056 -0.0087 0.0103 0.0093 ( 62.85%) -0.7928* H 13 s(100.00%) -1.0000 -0.0016 85. (0.01304) BD*( 1) C 9- C 10 ( 50.51%) 0.7107* C 9 s( 35.09%)p 1.85( 64.84%)d 0.00( 0.07%) 0.0000 0.5923 -0.0094 -0.0002 0.4064 0.0050 0.6614 0.0069 0.2110 0.0363 0.0205 0.0041 0.0063 -0.0107 -0.0083 ( 49.49%) -0.7035* C 10 s( 35.63%)p 1.81( 64.31%)d 0.00( 0.06%) 0.0000 0.5968 -0.0109 -0.0004 -0.4044 -0.0105 -0.6693 -0.0200 -0.1739 0.0295 0.0189 0.0059 0.0096 -0.0103 -0.0061 86. (0.01142) BD*( 1) C 9- H 12 ( 37.09%) 0.6090* C 9 s( 29.54%)p 2.38( 70.39%)d 0.00( 0.07%) 0.0000 -0.5433 -0.0139 -0.0009 0.2826 -0.0051 0.5057 -0.0090 -0.6066 0.0124 -0.0109 0.0107 0.0193 0.0064 -0.0089 ( 62.91%) -0.7932* H 12 s(100.00%) -1.0000 -0.0016 87. (0.01164) BD*( 1) C 10- H 11 ( 37.08%) 0.6090* C 10 s( 29.36%)p 2.40( 70.56%)d 0.00( 0.07%) 0.0000 -0.5417 -0.0135 -0.0018 -0.1470 0.0084 -0.1847 0.0128 -0.8060 0.0101 -0.0041 -0.0075 -0.0099 0.0016 -0.0239 ( 62.92%) -0.7932* H 11 s(100.00%) -1.0000 -0.0019 88. (0.02588) BD*( 1) C 16- C 17 ( 47.91%) 0.6921* C 16 s( 33.71%)p 1.97( 66.24%)d 0.00( 0.05%) 0.0000 -0.5806 -0.0032 0.0003 0.1448 0.0108 0.6994 -0.0047 0.3900 -0.0029 -0.0053 -0.0026 -0.0164 0.0115 0.0058 ( 52.09%) -0.7218* C 17 s( 33.07%)p 2.02( 66.86%)d 0.00( 0.07%) 0.0000 -0.5750 0.0049 0.0022 -0.1061 0.0182 -0.7170 -0.0071 -0.3781 -0.0042 -0.0074 -0.0038 -0.0196 0.0144 0.0071 89. (0.02153) BD*( 1) C 16- C 21 ( 48.03%) 0.6930* C 16 s( 32.10%)p 2.11( 67.85%)d 0.00( 0.05%) 0.0000 -0.5665 -0.0040 -0.0006 -0.7780 0.0078 -0.2416 -0.0051 -0.1218 -0.0022 -0.0111 -0.0054 -0.0057 -0.0133 0.0120 ( 51.97%) -0.7209* C 21 s( 33.47%)p 1.99( 66.46%)d 0.00( 0.07%) 0.0000 -0.5786 0.0031 0.0025 0.7702 0.0094 0.2403 -0.0124 0.1154 -0.0066 -0.0136 -0.0066 -0.0056 -0.0159 0.0136 90. (0.01174) BD*( 1) C 17- C 18 ( 49.68%) 0.7048* C 17 s( 36.15%)p 1.76( 63.78%)d 0.00( 0.07%) 0.0000 0.6012 -0.0118 -0.0002 0.6158 -0.0079 -0.4389 -0.0315 -0.2543 -0.0167 -0.0162 -0.0096 0.0081 0.0101 -0.0113 ( 50.32%) -0.7094* C 18 s( 35.44%)p 1.82( 64.49%)d 0.00( 0.07%) 0.0000 0.5952 -0.0106 -0.0004 -0.6336 -0.0343 0.4264 -0.0143 0.2455 -0.0068 -0.0183 -0.0106 0.0114 0.0045 -0.0105 91. (0.18136) BD*( 2) C 17- C 18 ( 53.88%) 0.7340* C 17 s( 0.00%)p 1.00( 99.94%)d 0.00( 0.06%) 0.0000 0.0012 -0.0004 0.0000 0.0280 -0.0008 -0.4701 0.0017 0.8818 -0.0033 -0.0118 0.0218 -0.0024 -0.0016 -0.0048 ( 46.12%) -0.6791* C 18 s( 0.00%)p 1.00( 99.94%)d 0.00( 0.06%) 0.0000 -0.0004 -0.0002 0.0001 0.0238 -0.0004 -0.4715 0.0051 0.8811 -0.0096 0.0028 -0.0040 0.0125 0.0095 0.0169 92. (0.01396) BD*( 1) C 17- H 26 ( 36.24%) 0.6020* C 17 s( 30.70%)p 2.26( 69.23%)d 0.00( 0.07%) 0.0000 -0.5539 -0.0125 -0.0018 0.7792 -0.0204 0.2662 0.0052 0.1179 0.0025 -0.0133 -0.0055 -0.0039 -0.0172 0.0136 ( 63.76%) -0.7985* H 26 s(100.00%) -1.0000 -0.0020 93. (0.01407) BD*( 1) C 18- C 19 ( 50.00%) 0.7071* C 18 s( 34.14%)p 1.93( 65.79%)d 0.00( 0.07%) 0.0000 -0.5842 0.0083 0.0004 -0.7617 -0.0272 -0.2515 0.0231 -0.1143 0.0131 -0.0145 -0.0068 -0.0056 -0.0149 0.0133 ( 50.00%) -0.7071* C 19 s( 35.08%)p 1.85( 64.85%)d 0.00( 0.07%) 0.0000 -0.5923 0.0079 0.0008 0.7467 0.0011 0.2686 0.0319 0.1320 0.0172 -0.0113 -0.0051 -0.0040 -0.0180 0.0138 94. (0.01162) BD*( 1) C 18- H 25 ( 36.11%) 0.6009* C 18 s( 30.36%)p 2.29( 69.57%)d 0.00( 0.07%) 0.0000 -0.5508 -0.0147 -0.0006 0.1233 -0.0027 0.7286 -0.0159 0.3864 -0.0084 -0.0055 -0.0028 -0.0193 0.0150 0.0064 ( 63.89%) -0.7993* H 25 s(100.00%) -1.0000 -0.0018 95. (0.01394) BD*( 1) C 19- C 20 ( 50.04%) 0.7074* C 19 s( 35.20%)p 1.84( 64.74%)d 0.00( 0.07%) 0.0000 0.5932 -0.0079 -0.0009 0.1542 0.0354 0.6946 0.0072 0.3738 0.0031 0.0047 0.0024 0.0198 -0.0149 -0.0062 ( 49.96%) -0.7068* C 20 s( 34.18%)p 1.92( 65.75%)d 0.00( 0.07%) 0.0000 0.5846 -0.0080 -0.0005 -0.1235 0.0316 -0.7036 -0.0186 -0.3819 -0.0109 0.0090 0.0047 0.0192 -0.0131 -0.0069 96. (0.01020) BD*( 1) C 19- H 24 ( 36.25%) 0.6021* C 19 s( 29.65%)p 2.37( 70.28%)d 0.00( 0.08%) 0.0000 -0.5444 -0.0126 -0.0014 -0.6451 0.0140 0.4643 -0.0103 0.2658 -0.0058 0.0193 0.0111 -0.0097 -0.0069 0.0107 ( 63.75%) -0.7984* H 24 s(100.00%) -1.0000 -0.0018 97. (0.01163) BD*( 1) C 20- C 21 ( 50.32%) 0.7094* C 20 s( 35.24%)p 1.84( 64.69%)d 0.00( 0.07%) 0.0000 -0.5935 0.0114 0.0000 0.6068 -0.0082 -0.4563 -0.0329 -0.2627 -0.0178 0.0173 0.0103 -0.0091 -0.0096 0.0117 ( 49.68%) -0.7048* C 21 s( 36.37%)p 1.75( 63.57%)d 0.00( 0.07%) 0.0000 -0.6029 0.0133 0.0007 -0.6237 -0.0329 0.4281 -0.0154 0.2490 -0.0078 0.0177 0.0103 -0.0110 -0.0041 0.0099 98. (0.19145) BD*( 2) C 20- C 21 ( 45.65%) 0.6757* C 20 s( 0.00%)p 1.00( 99.94%)d 0.00( 0.06%) 0.0000 -0.0002 0.0000 0.0000 -0.0195 0.0002 0.4793 -0.0050 -0.8770 0.0095 -0.0114 0.0208 0.0006 0.0007 -0.0004 ( 54.35%) -0.7372* C 21 s( 0.00%)p 1.00( 99.94%)d 0.00( 0.06%) 0.0000 -0.0017 0.0000 0.0000 -0.0195 0.0001 0.4794 -0.0016 -0.8770 0.0028 0.0056 -0.0091 0.0120 0.0092 0.0169 99. (0.01175) BD*( 1) C 20- H 23 ( 36.05%) 0.6004* C 20 s( 30.53%)p 2.27( 69.40%)d 0.00( 0.07%) 0.0000 -0.5523 -0.0152 -0.0004 -0.7836 0.0173 -0.2547 0.0059 -0.1216 0.0029 -0.0122 -0.0057 -0.0042 -0.0171 0.0133 ( 63.95%) -0.7997* H 23 s(100.00%) -1.0000 -0.0018 100. (0.01064) BD*( 1) C 21- H 22 ( 36.34%) 0.6028* C 21 s( 30.07%)p 2.32( 69.86%)d 0.00( 0.07%) 0.0000 -0.5482 -0.0128 -0.0025 -0.1258 -0.0107 -0.7264 0.0152 -0.3933 0.0087 -0.0056 -0.0029 -0.0202 0.0159 0.0061 ( 63.66%) -0.7979* H 22 s(100.00%) -1.0000 -0.0020 101. (0.00614) RY ( 1) C 1 s( 2.23%)p41.51( 92.47%)d 2.38( 5.30%) 0.0000 0.0029 0.1492 -0.0004 -0.0148 -0.4514 -0.0181 -0.7494 -0.0106 -0.3985 0.0735 0.0862 0.0737 -0.1851 0.0212 102. (0.00279) RY ( 2) C 1 s( 1.54%)p63.28( 97.32%)d 0.74( 1.14%) 0.0000 -0.0043 0.1235 0.0110 -0.0006 0.4443 -0.0009 -0.6031 -0.0003 0.6419 0.0224 -0.0452 -0.0876 0.0258 -0.0231 103. (0.00211) RY ( 3) C 1 s( 9.93%)p 7.97( 79.12%)d 1.10( 10.95%) 0.0000 0.0006 0.3139 -0.0274 0.0056 -0.6700 -0.0112 0.1635 -0.0035 0.5616 0.0078 -0.2753 0.1291 -0.0429 0.1233 104. (0.00092) RY ( 4) C 1 s( 24.72%)p 0.41( 10.23%)d 2.63( 65.06%) 0.0000 -0.0025 0.4873 -0.0986 0.0024 0.2261 -0.0258 0.0459 0.0111 -0.2197 0.6011 -0.2761 0.2751 0.3603 0.0867 105. (0.00063) RY ( 5) C 1 s( 53.77%)p 0.05( 2.47%)d 0.81( 43.76%) 0.0000 0.0071 0.7184 -0.1467 0.0038 0.0471 -0.0067 0.1444 -0.0167 -0.0356 -0.2259 0.5102 -0.3086 -0.0364 -0.1725 106. (0.00012) RY ( 6) C 1 s( 14.88%)p 0.63( 9.39%)d 5.09( 75.72%) 0.0000 -0.0038 -0.2060 0.3261 0.0196 -0.2178 -0.0064 0.0361 -0.0176 0.2109 0.5800 0.5462 -0.0582 0.1927 -0.2863 107. (0.00004) RY ( 7) C 1 s( 8.47%)p 0.09( 0.75%)d10.71( 90.78%) 108. (0.00003) RY ( 8) C 1 s( 27.19%)p 0.10( 2.68%)d 2.58( 70.13%) 109. (0.00002) RY ( 9) C 1 s( 35.56%)p 0.07( 2.34%)d 1.75( 62.09%) 110. (0.00001) RY (10) C 1 s( 21.72%)p 0.16( 3.53%)d 3.44( 74.75%) 111. (0.00591) RY ( 1) C 2 s( 0.18%)p99.99( 96.28%)d19.58( 3.53%) 0.0000 -0.0140 0.0401 0.0001 -0.0096 -0.0204 -0.0131 0.3193 0.0236 0.9272 0.1026 0.0360 -0.1468 0.0378 0.0233 112. (0.00483) RY ( 2) C 2 s( 0.09%)p99.99( 91.29%)d99.99( 8.62%) 0.0000 -0.0121 0.0193 0.0183 0.0239 -0.4646 -0.0269 -0.7936 0.0292 0.2552 0.0106 -0.1398 -0.1314 -0.1977 -0.1012 113. (0.00273) RY ( 3) C 2 s( 0.01%)p99.99( 84.46%)d99.99( 15.52%) 0.0000 0.0015 -0.0074 0.0089 -0.0342 0.7920 -0.0036 -0.4282 0.0040 0.1813 -0.3112 0.1793 -0.0741 0.0611 -0.1304 114. (0.00104) RY ( 4) C 2 s( 48.32%)p 0.02( 1.17%)d 1.05( 50.51%) 0.0000 0.0084 0.6950 -0.0030 0.0317 -0.0217 -0.0389 0.0911 0.0055 -0.0192 -0.4033 0.0539 -0.0601 -0.4617 0.3504 115. (0.00046) RY ( 5) C 2 s( 3.74%)p 0.87( 3.28%)d24.84( 92.98%) 0.0000 -0.0019 0.1934 0.0025 -0.0051 0.0360 -0.0174 -0.1759 -0.0130 -0.0015 0.0419 -0.3361 -0.1321 0.6567 0.6054 116. (0.00034) RY ( 6) C 2 s( 2.32%)p 4.52( 10.49%)d37.56( 87.19%) 0.0000 0.0015 0.1491 0.0313 0.0031 -0.3170 -0.0001 -0.0623 0.0079 -0.0217 -0.1638 0.8118 0.0000 0.4284 -0.0496 117. (0.00012) RY ( 7) C 2 s( 25.96%)p 0.14( 3.60%)d 2.71( 70.44%) 0.0000 -0.0085 0.4993 -0.1009 0.0057 0.1091 0.0017 -0.1259 -0.0040 0.0907 0.4115 -0.0370 0.6912 0.1035 -0.2126 118. (0.00008) RY ( 8) C 2 s( 11.74%)p 0.32( 3.82%)d 7.19( 84.44%) 119. (0.00004) RY ( 9) C 2 s( 10.06%)p 0.60( 6.04%)d 8.34( 83.90%) 120. (0.00001) RY (10) C 2 s( 97.40%)p 0.00( 0.08%)d 0.03( 2.51%) 121. (0.00151) RY ( 1) H 3 s(100.00%) -0.0040 1.0000 122. (0.00156) RY ( 1)Br 4 s( 5.40%)p 6.41( 34.59%)d11.12( 60.02%) 0.0000 0.0000 0.0000 0.0098 0.2318 0.0067 0.0095 0.0000 0.0000 0.0000 -0.0124 0.4985 0.0000 0.0000 0.0302 -0.3001 0.0000 0.0000 -0.0217 0.0761 0.0000 -0.5402 0.0000 0.3934 0.0000 -0.1740 0.0000 0.0065 0.0000 -0.3511 123. (0.00089) RY ( 2)Br 4 s( 2.43%)p15.54( 37.82%)d24.55( 59.75%) 0.0000 0.0000 0.0000 0.0029 0.1559 0.0036 0.0033 0.0015 0.0000 0.0000 -0.0044 0.1261 0.0000 0.0000 0.0086 0.2836 0.0000 0.0000 -0.0122 0.5306 0.0000 -0.2036 0.0000 0.0371 0.0000 -0.2113 0.0000 0.3498 0.0000 0.6226 124. (0.00076) RY ( 3)Br 4 s( 16.45%)p 2.71( 44.50%)d 2.37( 39.05%) 0.0000 0.0000 0.0000 0.0133 0.3989 -0.0657 0.0289 0.0027 0.0000 0.0000 0.0006 -0.2161 0.0000 0.0000 0.0488 -0.4926 0.0000 0.0000 -0.0370 0.3897 0.0000 0.3127 0.0000 -0.2130 0.0000 -0.4215 0.0000 -0.2598 0.0000 -0.0472 125. (0.00017) RY ( 4)Br 4 s( 18.29%)p 1.09( 20.02%)d 3.37( 61.68%) 0.0000 0.0000 0.0000 -0.0006 0.4036 0.1409 -0.0051 0.0129 0.0000 0.0000 -0.0055 -0.3052 0.0000 0.0000 0.0015 -0.1270 0.0000 0.0000 -0.0024 -0.3015 0.0000 -0.5893 0.0000 -0.4343 0.0000 0.1849 0.0000 -0.0639 0.0000 0.2065 126. (0.00008) RY ( 5)Br 4 s( 23.54%)p 0.34( 7.98%)d 2.91( 68.48%) 127. (0.00006) RY ( 6)Br 4 s( 23.62%)p 1.79( 42.35%)d 1.44( 34.04%) 128. (0.00005) RY ( 7)Br 4 s( 8.38%)p 0.40( 3.32%)d10.54( 88.31%) 129. (0.00003) RY ( 8)Br 4 s( 91.48%)p 0.07( 6.35%)d 0.02( 2.17%) 130. (0.00001) RY ( 9)Br 4 s( 0.64%)p77.80( 49.51%)d78.34( 49.85%) 131. (0.00000) RY (10)Br 4 s( 16.89%)p 2.91( 49.20%)d 2.01( 33.91%) 132. (0.00000) RY (11)Br 4 s( 93.05%)p 0.05( 4.74%)d 0.02( 2.21%) 133. (0.00000) RY (12)Br 4 s( 99.78%)p 0.00( 0.17%)d 0.00( 0.05%) 134. (0.00521) RY ( 1) C 5 s( 1.19%)p78.70( 93.80%)d 4.20( 5.01%) 0.0000 0.0026 0.1090 0.0047 0.0098 0.6012 0.0026 0.5939 0.0130 -0.4728 -0.0544 -0.0960 -0.1737 0.0500 0.0724 135. (0.00428) RY ( 2) C 5 s( 3.43%)p26.44( 90.57%)d 1.75( 6.00%) 0.0000 -0.0015 0.1849 0.0078 0.0026 0.1189 0.0135 0.4646 -0.0036 0.8219 -0.1223 -0.0058 0.0207 0.0503 0.2051 136. (0.00275) RY ( 3) C 5 s( 2.05%)p46.50( 95.49%)d 1.20( 2.46%) 0.0000 -0.0111 0.1429 0.0000 -0.0148 -0.7674 0.0019 0.5571 0.0077 -0.2352 -0.0298 -0.0771 -0.0038 -0.1328 0.0096 137. (0.00077) RY ( 4) C 5 s( 0.18%)p 1.01( 0.18%)d99.99( 99.64%) 0.0000 0.0003 0.0393 0.0151 0.0095 0.0228 -0.0067 -0.0319 0.0005 -0.0115 0.1684 -0.8144 0.5050 0.2194 0.0415 138. (0.00048) RY ( 5) C 5 s( 81.38%)p 0.04( 3.36%)d 0.19( 15.26%) 0.0000 0.0010 0.9000 -0.0613 -0.0080 0.0042 -0.0007 -0.1638 0.0026 -0.0820 0.2070 0.2145 0.1023 0.2258 -0.0481 139. (0.00019) RY ( 6) C 5 s( 4.59%)p 0.77( 3.54%)d20.04( 91.88%) 0.0000 0.0040 0.2062 -0.0576 -0.0005 0.0120 0.0072 -0.0923 -0.0209 0.1618 0.0740 -0.4658 -0.6306 -0.2850 -0.4663 140. (0.00013) RY ( 7) C 5 s( 14.50%)p 0.32( 4.68%)d 5.57( 80.82%) 0.0000 0.0033 0.2742 0.2642 -0.0067 0.0904 0.0087 -0.1805 0.0060 -0.0768 -0.5073 -0.1087 0.2141 -0.6594 0.2415 141. (0.00007) RY ( 8) C 5 s( 66.36%)p 0.03( 2.13%)d 0.47( 31.50%) 142. (0.00004) RY ( 9) C 5 s( 25.50%)p 0.24( 6.00%)d 2.69( 68.50%) 143. (0.00001) RY (10) C 5 s( 0.89%)p 0.41( 0.36%)d99.99( 98.75%) 144. (0.00458) RY ( 1) C 6 s( 0.13%)p99.99( 93.17%)d49.96( 6.70%) 0.0000 0.0094 0.0351 -0.0042 -0.0096 -0.4054 -0.0179 -0.6559 0.0214 0.5799 0.0087 -0.1273 -0.2230 -0.0243 0.0196 145. (0.00247) RY ( 2) C 6 s( 0.47%)p99.99( 97.24%)d 4.90( 2.29%) 0.0000 -0.0167 0.0623 -0.0226 0.0103 -0.3522 0.0193 -0.4885 0.0224 -0.7802 -0.0531 0.0590 0.0250 0.0621 0.1101 146. (0.00068) RY ( 3) C 6 s( 0.01%)p 1.00( 37.15%)d 1.69( 62.84%) 0.0000 0.0049 0.0036 0.0068 0.0110 0.5229 -0.0076 -0.3128 0.0018 -0.0035 0.2008 0.4809 -0.3635 0.4669 -0.0818 147. (0.00054) RY ( 4) C 6 s( 4.26%)p12.91( 55.03%)d 9.55( 40.71%) 0.0000 -0.0054 0.1966 -0.0627 -0.0037 -0.6033 -0.0035 0.4277 -0.0040 0.0575 0.2923 0.2192 -0.1457 0.5018 0.0255 148. (0.00019) RY ( 5) C 6 s( 88.73%)p 0.03( 2.87%)d 0.09( 8.40%) 0.0000 0.0042 0.9271 -0.1666 -0.0178 0.1631 -0.0121 -0.0045 0.0023 0.0399 -0.1723 0.0185 -0.0156 -0.1115 0.2033 149. (0.00011) RY ( 6) C 6 s( 5.50%)p 0.27( 1.48%)d16.90( 93.02%) 0.0000 -0.0011 0.2103 -0.1040 0.0059 -0.0589 0.0175 -0.0387 0.0213 -0.0951 0.3478 0.0147 -0.0279 -0.2960 -0.8489 150. (0.00004) RY ( 7) C 6 s( 80.69%)p 0.02( 1.35%)d 0.22( 17.96%) 151. (0.00003) RY ( 8) C 6 s( 15.13%)p 0.25( 3.83%)d 5.36( 81.04%) 152. (0.00002) RY ( 9) C 6 s( 4.57%)p 0.81( 3.72%)d20.06( 91.71%) 153. (0.00000) RY (10) C 6 s( 0.59%)p 7.35( 4.34%)d99.99( 95.07%) 154. (0.00482) RY ( 1) C 7 s( 0.11%)p99.99( 92.86%)d65.20( 7.04%) 0.0000 -0.0141 0.0268 -0.0126 -0.0079 -0.1497 -0.0084 -0.1646 -0.0323 -0.9369 0.0763 -0.0828 -0.1168 -0.0491 -0.2040 155. (0.00254) RY ( 2) C 7 s( 0.33%)p99.99( 98.68%)d 3.05( 0.99%) 0.0000 -0.0013 0.0570 0.0013 0.0187 -0.4675 0.0356 -0.8446 -0.0114 0.2306 0.0404 0.0314 0.0608 0.0014 -0.0600 156. (0.00061) RY ( 3) C 7 s( 0.12%)p99.99( 12.56%)d99.99( 87.32%) 0.0000 0.0004 0.0343 -0.0043 -0.0054 0.3149 0.0026 -0.1606 0.0015 -0.0248 0.4263 -0.1901 0.0687 0.8064 0.0203 157. (0.00035) RY ( 4) C 7 s( 0.39%)p99.99( 76.58%)d58.93( 23.03%) 0.0000 0.0004 0.0610 -0.0138 0.0069 0.7582 -0.0039 -0.4345 0.0012 -0.0450 -0.1369 0.3549 -0.1994 -0.2131 -0.0204 158. (0.00017) RY ( 5) C 7 s( 87.94%)p 0.01( 0.53%)d 0.13( 11.52%) 0.0000 0.0037 0.9228 -0.1670 0.0055 -0.0465 0.0124 0.0515 0.0156 0.0097 -0.1447 -0.1332 -0.2036 0.0464 0.1815 159. (0.00011) RY ( 6) C 7 s( 10.55%)p 0.12( 1.27%)d 8.36( 88.18%) 0.0000 0.0023 0.3156 -0.0768 -0.0136 0.0344 -0.0225 0.1019 0.0134 -0.0174 0.2043 0.3925 0.6945 -0.0710 -0.4457 160. (0.00004) RY ( 7) C 7 s( 97.02%)p 0.00( 0.07%)d 0.03( 2.92%) 161. (0.00000) RY ( 8) C 7 s( 0.11%)p47.38( 5.41%)d99.99( 94.48%) 162. (0.00000) RY ( 9) C 7 s( 2.95%)p 1.03( 3.04%)d31.86( 94.01%) 163. (0.00000) RY (10) C 7 s( 0.54%)p16.84( 9.18%)d99.99( 90.28%) 164. (0.00461) RY ( 1) C 8 s( 0.21%)p99.99( 92.20%)d35.39( 7.59%) 0.0000 -0.0136 0.0412 -0.0162 -0.0176 -0.4898 -0.0279 -0.7914 -0.0079 -0.2339 -0.1298 -0.0599 -0.1133 0.0641 0.1961 165. (0.00224) RY ( 2) C 8 s( 0.00%)p 1.00( 98.94%)d 0.01( 1.06%) 0.0000 -0.0001 0.0026 -0.0009 0.0040 -0.0898 0.0090 -0.2282 -0.0399 0.9631 0.0209 -0.0578 -0.0720 -0.0111 -0.0390 166. (0.00060) RY ( 3) C 8 s( 0.01%)p 1.00( 0.81%)d99.99( 99.19%) 0.0000 0.0001 0.0075 -0.0020 0.0079 -0.0742 -0.0047 0.0493 0.0001 -0.0071 0.1302 -0.8372 0.4913 0.1696 0.0622 167. (0.00036) RY ( 4) C 8 s( 0.02%)p99.99( 88.64%)d99.99( 11.34%) 0.0000 0.0001 0.0110 -0.0076 0.0064 0.8060 -0.0035 -0.4849 0.0000 -0.0411 0.1561 -0.0176 -0.0050 0.2978 0.0020 168. (0.00012) RY ( 5) C 8 s( 0.01%)p 1.00( 1.11%)d88.72( 98.88%) 0.0000 -0.0001 0.0081 -0.0055 0.0029 -0.0095 0.0070 -0.0229 -0.0296 0.0980 -0.1888 0.4649 0.7462 0.1377 0.4015 169. (0.00010) RY ( 6) C 8 s( 97.70%)p 0.00( 0.11%)d 0.02( 2.20%) 0.0000 0.0059 0.9239 -0.3513 0.0088 0.0067 0.0153 0.0258 0.0048 0.0032 -0.0684 0.0106 0.0285 0.0189 -0.1265 170. (0.00004) RY ( 7) C 8 s( 98.40%)p 0.00( 0.04%)d 0.02( 1.56%) 171. (0.00000) RY ( 8) C 8 s( 0.70%)p11.00( 7.75%)d99.99( 91.55%) 172. (0.00000) RY ( 9) C 8 s( 2.02%)p 2.22( 4.48%)d46.34( 93.50%) 173. (0.00000) RY (10) C 8 s( 1.00%)p 6.14( 6.12%)d93.27( 92.89%) 174. (0.00475) RY ( 1) C 9 s( 0.10%)p99.99( 92.75%)d74.25( 7.15%) 0.0000 -0.0137 0.0250 -0.0122 -0.0123 -0.3159 -0.0213 -0.5584 0.0242 0.7175 -0.0116 0.1353 0.2288 0.0149 -0.0217 175. (0.00250) RY ( 2) C 9 s( 0.28%)p99.99( 98.69%)d 3.66( 1.03%) 0.0000 -0.0010 0.0528 -0.0048 0.0167 -0.3782 0.0254 -0.6315 0.0283 -0.6658 0.0472 0.0020 0.0132 -0.0224 -0.0858 176. (0.00059) RY ( 3) C 9 s( 0.03%)p99.99( 4.59%)d99.99( 95.38%) 0.0000 0.0001 0.0161 -0.0029 -0.0095 -0.1846 0.0063 0.1083 0.0004 0.0020 -0.3248 -0.5560 0.3593 -0.6390 0.0427 177. (0.00036) RY ( 4) C 9 s( 0.84%)p99.99( 84.02%)d18.10( 15.15%) 0.0000 0.0003 0.0885 -0.0234 0.0041 0.7938 -0.0017 -0.4582 -0.0022 -0.0077 0.0498 -0.3307 0.1873 0.0644 0.0200 178. (0.00015) RY ( 5) C 9 s( 81.62%)p 0.01( 0.49%)d 0.22( 17.90%) 0.0000 0.0037 0.8858 -0.1773 0.0104 -0.0521 0.0181 0.0413 -0.0052 -0.0009 -0.2275 0.0308 -0.0774 0.1124 0.3280 179. (0.00011) RY ( 6) C 9 s( 16.34%)p 0.09( 1.47%)d 5.03( 82.19%) 0.0000 0.0027 0.3998 -0.0598 -0.0087 0.0131 -0.0124 0.0947 -0.0247 0.0685 0.3633 -0.0409 -0.0323 -0.1983 -0.8049 180. (0.00004) RY ( 7) C 9 s( 96.79%)p 0.00( 0.04%)d 0.03( 3.17%) 181. (0.00000) RY ( 8) C 9 s( 0.51%)p13.42( 6.90%)d99.99( 92.58%) 182. (0.00000) RY ( 9) C 9 s( 1.35%)p 4.60( 6.21%)d68.47( 92.44%) 183. (0.00000) RY (10) C 9 s( 2.21%)p 2.27( 5.01%)d41.96( 92.77%) 184. (0.00488) RY ( 1) C 10 s( 0.21%)p99.99( 93.38%)d31.18( 6.42%) 0.0000 0.0096 0.0440 -0.0057 -0.0056 -0.2644 -0.0080 -0.3294 -0.0304 -0.8685 -0.0867 0.0685 0.1044 0.0466 0.1972 185. (0.00224) RY ( 2) C 10 s( 0.59%)p99.99( 96.25%)d 5.40( 3.16%) 0.0000 -0.0154 0.0688 -0.0297 0.0107 -0.4563 0.0248 -0.7605 -0.0082 0.4186 -0.0252 -0.0967 -0.1383 0.0377 0.0326 186. (0.00078) RY ( 3) C 10 s( 0.01%)p 1.00( 31.70%)d 2.15( 68.29%) 0.0000 0.0004 0.0039 0.0081 -0.0083 0.4834 0.0051 -0.2866 -0.0007 -0.0334 0.3631 -0.2531 0.1788 0.6744 0.0150 187. (0.00039) RY ( 4) C 10 s( 0.17%)p99.99( 59.67%)d99.99( 40.16%) 0.0000 0.0002 0.0328 -0.0247 -0.0034 -0.6424 -0.0009 0.4283 0.0012 0.0244 0.2948 0.0814 -0.1072 0.5443 -0.0167 188. (0.00019) RY ( 5) C 10 s( 94.05%)p 0.02( 1.42%)d 0.05( 4.53%) 0.0000 0.0057 0.9368 -0.2505 -0.0096 0.0842 -0.0121 0.0803 -0.0100 -0.0185 -0.0829 -0.1275 -0.1457 0.0052 0.0305 189. (0.00009) RY ( 6) C 10 s( 8.13%)p 0.32( 2.61%)d10.99( 89.26%) 190. (0.00004) RY ( 7) C 10 s( 83.09%)p 0.01( 1.19%)d 0.19( 15.72%) 191. (0.00001) RY ( 8) C 10 s( 12.00%)p 0.44( 5.28%)d 6.90( 82.72%) 192. (0.00001) RY ( 9) C 10 s( 0.44%)p 0.74( 0.33%)d99.99( 99.23%) 193. (0.00000) RY (10) C 10 s( 1.41%)p 5.89( 8.32%)d63.84( 90.26%) 194. (0.00088) RY ( 1) H 11 s(100.00%) -0.0019 1.0000 195. (0.00073) RY ( 1) H 12 s(100.00%) -0.0016 1.0000 196. (0.00071) RY ( 1) H 13 s(100.00%) -0.0016 1.0000 197. (0.00072) RY ( 1) H 14 s(100.00%) -0.0016 1.0000 198. (0.00123) RY ( 1) H 15 s(100.00%) -0.0027 1.0000 199. (0.00582) RY ( 1) C 16 s( 1.03%)p91.39( 94.02%)d 4.82( 4.95%) 0.0000 -0.0100 0.1009 0.0012 -0.0093 -0.9677 0.0050 -0.0380 0.0033 -0.0466 0.1544 0.0844 -0.0672 0.1152 -0.0280 200. (0.00444) RY ( 2) C 16 s( 1.23%)p75.27( 92.63%)d 4.99( 6.14%) 0.0000 -0.0071 0.1102 -0.0105 -0.0051 -0.0408 0.0073 0.8201 0.0036 0.5020 0.1385 0.0886 0.0684 -0.1680 0.0380 201. (0.00062) RY ( 3) C 16 s( 0.00%)p 1.00( 0.98%)d99.99( 99.01%) 0.0000 -0.0001 0.0064 -0.0006 -0.0004 -0.0020 0.0018 -0.0560 -0.0033 0.0818 -0.2613 0.5317 0.4448 0.3500 0.5647 202. (0.00036) RY ( 4) C 16 s( 6.13%)p12.98( 79.52%)d 2.34( 14.36%) 0.0000 0.0012 0.2317 0.0871 -0.0022 0.0359 0.0036 0.4184 0.0014 -0.7866 0.1545 -0.1682 0.1792 -0.0028 0.2435 203. (0.00029) RY ( 5) C 16 s( 74.02%)p 0.15( 10.92%)d 0.20( 15.06%) 0.0000 0.0041 0.8538 0.1055 -0.0060 0.0870 0.0097 -0.2942 0.0063 0.1221 0.1302 0.1561 0.0347 -0.3272 0.0327 204. (0.00024) RY ( 6) C 16 s( 0.42%)p30.32( 12.84%)d99.99( 86.74%) 0.0000 -0.0001 -0.0353 0.0547 -0.0021 0.0089 0.0063 -0.1969 -0.0086 0.2990 0.4925 -0.5984 0.2779 0.1955 0.3889 205. (0.00016) RY ( 7) C 16 s( 48.86%)p 0.04( 1.80%)d 1.01( 49.34%) 0.0000 -0.0025 -0.4012 0.5724 0.0011 -0.0440 0.0092 -0.1125 0.0067 -0.0569 0.2887 0.2714 0.2523 -0.5222 0.0051 206. (0.00007) RY ( 8) C 16 s( 27.21%)p 0.14( 3.93%)d 2.53( 68.87%) 207. (0.00002) RY ( 9) C 16 s( 39.40%)p 0.09( 3.45%)d 1.45( 57.15%) 208. (0.00000) RY (10) C 16 s( 1.77%)p 0.01( 0.02%)d55.60( 98.21%) 209. (0.00430) RY ( 1) C 17 s( 0.09%)p99.99( 92.27%)d89.44( 7.65%) 0.0000 0.0083 0.0279 -0.0023 0.0321 0.9129 0.0096 0.2678 0.0049 0.1283 0.1502 0.0731 -0.0795 0.1972 -0.0577 210. (0.00225) RY ( 2) C 17 s( 0.86%)p99.99( 97.03%)d 2.46( 2.11%) 0.0000 -0.0167 0.0814 -0.0412 -0.0062 0.3109 0.0229 -0.8259 0.0126 -0.4368 0.0793 0.0490 0.0315 -0.1049 0.0212 211. (0.00075) RY ( 3) C 17 s( 0.11%)p99.99( 45.81%)d99.99( 54.08%) 0.0000 0.0002 0.0314 -0.0117 0.0002 -0.0134 0.0050 0.3225 -0.0104 -0.5948 -0.1023 0.1789 -0.3803 -0.2875 -0.5206 212. (0.00031) RY ( 4) C 17 s( 0.28%)p99.99( 46.33%)d99.99( 53.38%) 0.0000 0.0000 0.0530 0.0008 0.0005 0.0062 0.0063 -0.3093 -0.0119 0.6062 -0.2812 0.4602 -0.2585 -0.1816 -0.3783 213. (0.00018) RY ( 5) C 17 s( 92.03%)p 0.02( 1.51%)d 0.07( 6.46%) 0.0000 0.0069 0.9390 -0.1962 0.0185 -0.0506 -0.0083 0.1001 -0.0034 0.0464 0.1538 0.0480 0.0417 -0.1553 0.1130 214. (0.00009) RY ( 6) C 17 s( 10.80%)p 0.17( 1.81%)d 8.10( 87.39%) 215. (0.00004) RY ( 7) C 17 s( 79.00%)p 0.02( 1.77%)d 0.24( 19.24%) 216. (0.00002) RY ( 8) C 17 s( 13.47%)p 0.42( 5.69%)d 6.00( 80.84%) 217. (0.00001) RY ( 9) C 17 s( 1.37%)p 5.79( 7.92%)d66.29( 90.71%) 218. (0.00000) RY (10) C 17 s( 2.09%)p 0.02( 0.04%)d46.87( 97.87%) 219. (0.00500) RY ( 1) C 18 s( 0.06%)p99.99( 92.96%)d99.99( 6.98%) 0.0000 -0.0136 0.0167 -0.0104 -0.0058 -0.1716 -0.0320 -0.8371 -0.0171 -0.4450 -0.0608 -0.0407 -0.1181 0.2219 -0.0354 220. (0.00249) RY ( 2) C 18 s( 0.15%)p99.99( 98.87%)d 6.35( 0.97%) 0.0000 0.0005 0.0383 0.0081 -0.0408 0.9774 0.0050 -0.1419 0.0040 -0.1075 -0.0854 -0.0421 0.0104 -0.0223 0.0069 221. (0.00036) RY ( 3) C 18 s( 0.00%)p 1.00( 16.68%)d 5.00( 83.32%) 0.0000 0.0000 0.0017 0.0025 -0.0003 -0.0081 0.0038 0.1949 -0.0070 -0.3587 0.4356 -0.8002 -0.0395 -0.0397 -0.0052 222. (0.00028) RY ( 4) C 18 s( 0.04%)p99.99( 73.09%)d99.99( 26.87%) 0.0000 0.0000 0.0194 -0.0054 0.0006 -0.0272 0.0003 0.4028 0.0005 -0.7536 -0.1997 0.3445 -0.1730 -0.1376 -0.2475 223. (0.00017) RY ( 5) C 18 s( 64.62%)p 0.00( 0.16%)d 0.55( 35.23%) 0.0000 0.0039 0.7926 -0.1340 -0.0160 0.0286 0.0171 -0.0066 0.0097 0.0073 0.5111 0.2738 -0.0848 0.0944 0.0044 224. (0.00010) RY ( 6) C 18 s( 33.94%)p 0.03( 1.08%)d 1.91( 64.98%) 0.0000 0.0030 0.5659 -0.1387 0.0272 -0.0983 0.0074 0.0009 0.0032 0.0179 -0.6563 -0.3551 0.0844 -0.2635 0.1282 225. (0.00005) RY ( 7) C 18 s( 96.39%)p 0.00( 0.17%)d 0.04( 3.44%) 226. (0.00000) RY ( 8) C 18 s( 2.12%)p 3.08( 6.53%)d43.04( 91.35%) 227. (0.00000) RY ( 9) C 18 s( 2.69%)p 0.28( 0.74%)d35.96( 96.57%) 228. (0.00000) RY (10) C 18 s( 0.06%)p99.99( 9.91%)d99.99( 90.03%) 229. (0.00475) RY ( 1) C 19 s( 0.34%)p99.99( 91.75%)d23.15( 7.91%) 0.0000 -0.0144 0.0535 -0.0187 0.0288 0.7404 -0.0209 -0.5267 -0.0120 -0.3008 0.2406 0.1332 -0.0038 -0.0530 0.0257 230. (0.00210) RY ( 2) C 19 s( 0.02%)p99.99( 98.75%)d76.11( 1.23%) 0.0000 0.0000 0.0126 -0.0018 -0.0242 0.6288 -0.0252 0.6815 -0.0130 0.3555 0.0170 0.0078 -0.0459 0.0973 -0.0202 231. (0.00057) RY ( 3) C 19 s( 0.00%)p 1.00( 0.01%)d99.99( 99.99%) 0.0000 0.0000 0.0017 0.0010 0.0000 -0.0020 0.0002 0.0045 -0.0004 -0.0097 -0.2886 0.5694 0.4293 0.3369 0.5428 232. (0.00018) RY ( 4) C 19 s( 0.02%)p99.99( 85.29%)d99.99( 14.69%) 0.0000 0.0002 0.0139 -0.0043 -0.0008 0.0188 -0.0004 -0.4367 -0.0008 0.8136 0.1355 -0.2521 0.1434 0.0676 0.1995 233. (0.00014) RY ( 5) C 19 s( 1.93%)p 0.72( 1.40%)d50.20( 96.68%) 0.0000 0.0010 0.1268 -0.0564 0.0177 -0.0734 0.0226 -0.0861 0.0116 -0.0137 0.1607 0.0512 -0.4168 0.8576 -0.1710 234. (0.00010) RY ( 6) C 19 s( 93.92%)p 0.00( 0.12%)d 0.06( 5.96%) 0.0000 0.0064 0.8475 -0.4699 -0.0157 -0.0166 0.0068 0.0241 0.0041 -0.0068 -0.1371 -0.0601 -0.0658 -0.1334 0.1228 235. (0.00003) RY ( 7) C 19 s( 96.41%)p 0.00( 0.32%)d 0.03( 3.27%) 236. (0.00000) RY ( 8) C 19 s( 2.15%)p 3.45( 7.41%)d42.10( 90.44%) 237. (0.00000) RY ( 9) C 19 s( 0.07%)p99.99( 14.38%)d99.99( 85.55%) 238. (0.00000) RY (10) C 19 s( 5.22%)p 0.14( 0.75%)d18.00( 94.03%) 239. (0.00485) RY ( 1) C 20 s( 0.03%)p99.99( 92.77%)d99.99( 7.20%) 0.0000 0.0133 -0.0017 0.0093 -0.0348 -0.8969 -0.0118 -0.3141 -0.0058 -0.1524 0.1518 0.0774 -0.0754 0.1852 -0.0546 240. (0.00253) RY ( 2) C 20 s( 0.25%)p99.99( 98.85%)d 3.56( 0.90%) 0.0000 0.0008 0.0496 0.0072 -0.0153 0.3593 0.0343 -0.8084 0.0190 -0.4519 -0.0649 -0.0356 -0.0259 0.0521 -0.0101 241. (0.00034) RY ( 3) C 20 s( 0.01%)p99.99( 14.08%)d99.99( 85.90%) 0.0000 0.0001 0.0108 -0.0034 -0.0004 -0.0067 0.0034 0.1797 -0.0060 -0.3293 0.0839 -0.1059 0.4944 0.3772 0.6739 242. (0.00030) RY ( 4) C 20 s( 0.04%)p99.99( 76.07%)d99.99( 23.89%) 0.0000 0.0000 0.0175 -0.0091 -0.0003 -0.0179 -0.0001 0.4209 -0.0004 -0.7637 -0.1902 0.3345 -0.1554 -0.1158 -0.2309 243. (0.00016) RY ( 5) C 20 s( 60.86%)p 0.00( 0.15%)d 0.64( 38.99%) 0.0000 0.0034 0.7745 -0.0933 -0.0227 0.0203 0.0114 -0.0195 0.0067 0.0067 0.4510 0.2483 0.1072 -0.3264 0.0827 244. (0.00010) RY ( 6) C 20 s( 37.86%)p 0.03( 1.17%)d 1.61( 60.97%) 245. (0.00005) RY ( 7) C 20 s( 97.52%)p 0.00( 0.10%)d 0.02( 2.39%) 246. (0.00000) RY ( 8) C 20 s( 1.34%)p 4.84( 6.49%)d68.76( 92.17%) 247. (0.00000) RY ( 9) C 20 s( 1.62%)p 2.25( 3.64%)d58.47( 94.74%) 248. (0.00000) RY (10) C 20 s( 0.53%)p12.96( 6.88%)d99.99( 92.59%) 249. (0.00484) RY ( 1) C 21 s( 0.44%)p99.99( 92.73%)d15.45( 6.83%) 0.0000 0.0068 0.0649 -0.0127 -0.0045 0.0497 -0.0291 -0.8432 -0.0158 -0.4613 0.0706 0.0488 0.1119 -0.2162 0.0407 250. (0.00234) RY ( 2) C 21 s( 1.55%)p61.49( 95.08%)d 2.18( 3.37%) 0.0000 -0.0188 0.1124 -0.0499 -0.0229 0.9737 0.0043 0.0465 0.0027 -0.0007 0.1126 0.0808 -0.0718 0.0965 -0.0080 251. (0.00075) RY ( 3) C 21 s( 0.01%)p 1.00( 25.65%)d 2.90( 74.34%) 0.0000 -0.0001 0.0065 -0.0028 -0.0001 0.0250 -0.0068 -0.2436 0.0121 0.4431 0.4228 -0.7377 0.0589 0.0377 0.1251 252. (0.00027) RY ( 4) C 21 s( 0.35%)p99.99( 62.07%)d99.99( 37.57%) 0.0000 0.0006 0.0555 -0.0217 0.0017 -0.0232 -0.0066 0.3760 0.0104 -0.6919 0.2107 -0.3295 0.2303 0.2038 0.3581 253. (0.00019) RY ( 5) C 21 s( 82.54%)p 0.04( 3.70%)d 0.17( 13.76%) 0.0000 0.0094 0.8827 -0.2147 0.0189 -0.1800 -0.0123 0.0063 -0.0081 0.0632 0.2503 0.1766 -0.1750 0.1133 0.0171 254. (0.00008) RY ( 6) C 21 s( 22.99%)p 0.07( 1.57%)d 3.28( 75.44%) 255. (0.00003) RY ( 7) C 21 s( 71.37%)p 0.03( 2.46%)d 0.37( 26.18%) 256. (0.00001) RY ( 8) C 21 s( 17.98%)p 0.27( 4.86%)d 4.29( 77.16%) 257. (0.00000) RY ( 9) C 21 s( 1.74%)p 3.25( 5.64%)d53.30( 92.62%) 258. (0.00000) RY (10) C 21 s( 1.12%)p 5.73( 6.43%)d82.37( 92.45%) 259. (0.00084) RY ( 1) H 22 s(100.00%) -0.0020 1.0000 260. (0.00064) RY ( 1) H 23 s(100.00%) -0.0018 1.0000 261. (0.00065) RY ( 1) H 24 s(100.00%) -0.0018 1.0000 262. (0.00065) RY ( 1) H 25 s(100.00%) -0.0018 1.0000 263. (0.00130) RY ( 1) H 26 s(100.00%) -0.0020 1.0000 264. (0.00156) RY ( 1) H 27 s(100.00%) -0.0029 1.0000 NHO DIRECTIONALITY AND BOND BENDING (deviation from line of nuclear centers at the position of maximum hybrid amplitude) [Thresholds for printing: angular deviation > 1.0 degree] p- or d-character > 25.0% orbital occupancy > 0.10e Line of Centers Hybrid 1 Hybrid 2 --------------- ------------------- ------------------ NBO Theta Phi Theta Phi Dev Theta Phi Dev =============================================================================== 30. LP ( 2)Br 4 -- -- 36.8 100.2 -- -- -- -- 31. LP ( 3)Br 4 -- -- 89.7 192.2 -- -- -- -- 32. BD ( 1) C 1- C 2 91.5 182.1 92.4 185.3 3.3 89.3 358.8 3.4 33. BD ( 1) C 1- C 16 111.1 320.0 113.3 317.0 3.5 70.5 141.8 2.3 34. BD ( 2) C 1- C 16 111.1 320.0 32.2 273.6 87.8 28.7 270.4 88.6 37. BD ( 1) C 2-Br 4 126.9 98.2 127.4 103.6 4.4 52.8 283.0 3.9 38. BD ( 1) C 2- C 5 107.2 237.0 111.1 237.0 3.9 75.1 57.8 2.4 39. BD ( 1) C 5- C 6 163.4 230.2 165.3 231.6 1.9 17.7 49.2 1.2 40. BD ( 1) C 5- C 10 44.1 240.3 42.5 238.6 2.0 134.8 62.0 1.6 41. BD ( 2) C 5- C 10 44.1 240.3 90.4 326.6 87.7 93.3 329.9 87.9 42. BD ( 1) C 6- C 7 103.7 238.5 105.0 238.4 1.3 77.8 58.6 1.4 43. BD ( 2) C 6- C 7 103.7 238.5 93.2 328.2 89.0 92.4 329.7 89.4 45. BD ( 1) C 7- C 8 44.0 241.6 45.8 241.9 1.7 137.7 61.4 1.7 47. BD ( 1) C 8- C 9 16.3 52.2 14.7 49.8 1.7 162.0 234.2 1.8 48. BD ( 2) C 8- C 9 16.3 52.2 87.1 148.3 88.9 89.2 148.8 88.9 50. BD ( 1) C 9- C 10 76.1 58.8 74.6 58.5 1.5 102.4 238.9 1.5 53. BD ( 1) C 16- C 17 117.8 259.9 118.4 257.6 2.1 -- -- -- 55. BD ( 1) C 17- C 18 108.2 325.2 -- -- -- 72.2 146.2 1.1 56. BD ( 2) C 17- C 18 108.2 325.2 152.3 91.6 89.1 27.4 272.5 89.2 58. BD ( 1) C 18- C 19 81.1 19.3 82.0 18.1 1.4 99.6 200.2 1.2 60. BD ( 1) C 19- C 20 62.1 78.4 62.3 77.0 1.2 118.1 260.0 1.5 62. BD ( 1) C 20- C 21 71.4 144.5 70.9 143.0 1.5 108.0 326.0 1.6 63. BD ( 2) C 20- C 21 71.4 144.5 28.6 270.7 89.3 29.5 273.2 89.2 SECOND ORDER PERTURBATION THEORY ANALYSIS OF FOCK MATRIX IN NBO BASIS Threshold for printing: 0.50 kcal/mol E(2) E(NL)-E(L) F(L,NL) Donor (L) NBO Acceptor (NL) NBO kcal/mol a.u. a.u. =============================================================================== within unit 1 30. LP ( 2)Br 4 71. BD*( 1) C 2- H 3 1.31 0.75 0.028 30. LP ( 2)Br 4 73. BD*( 1) C 2- C 5 1.40 0.70 0.028 30. LP ( 2)Br 4 79. BD*( 1) C 6- H 15 0.72 0.78 0.021 30. LP ( 2)Br 4 111. RY ( 1) C 2 0.57 1.19 0.023 31. LP ( 3)Br 4 67. BD*( 1) C 1- C 2 0.90 0.69 0.022 31. LP ( 3)Br 4 69. BD*( 2) C 1- C 16 5.25 0.28 0.035 31. LP ( 3)Br 4 72. BD*( 1) C 2-Br 4 1.87 0.31 0.021 31. LP ( 3)Br 4 73. BD*( 1) C 2- C 5 0.61 0.71 0.018 32. BD ( 1) C 1- C 2 68. BD*( 1) C 1- C 16 1.19 1.16 0.033 32. BD ( 1) C 1- C 2 73. BD*( 1) C 2- C 5 0.99 1.03 0.029 32. BD ( 1) C 1- C 2 76. BD*( 2) C 5- C 10 1.51 0.66 0.028 32. BD ( 1) C 1- C 2 89. BD*( 1) C 16- C 21 1.71 1.12 0.039 32. BD ( 1) C 1- C 2 136. RY ( 3) C 5 0.97 1.44 0.033 32. BD ( 1) C 1- C 2 199. RY ( 1) C 16 1.02 1.84 0.039 32. BD ( 1) C 1- C 2 200. RY ( 2) C 16 1.53 1.90 0.048 33. BD ( 1) C 1- C 16 67. BD*( 1) C 1- C 2 1.03 1.04 0.029 33. BD ( 1) C 1- C 16 70. BD*( 1) C 1- H 27 0.64 1.10 0.024 33. BD ( 1) C 1- C 16 88. BD*( 1) C 16- C 17 2.46 1.15 0.048 33. BD ( 1) C 1- C 16 89. BD*( 1) C 16- C 21 1.74 1.14 0.040 33. BD ( 1) C 1- C 16 90. BD*( 1) C 17- C 18 0.98 1.24 0.031 33. BD ( 1) C 1- C 16 97. BD*( 1) C 20- C 21 1.13 1.23 0.033 33. BD ( 1) C 1- C 16 111. RY ( 1) C 2 1.07 1.55 0.036 33. BD ( 1) C 1- C 16 112. RY ( 2) C 2 0.63 1.50 0.027 33. BD ( 1) C 1- C 16 209. RY ( 1) C 17 0.99 1.93 0.039 33. BD ( 1) C 1- C 16 249. RY ( 1) C 21 1.50 1.89 0.048 34. BD ( 2) C 1- C 16 69. BD*( 2) C 1- C 16 10.33 0.27 0.047 34. BD ( 2) C 1- C 16 71. BD*( 1) C 2- H 3 0.89 0.74 0.023 34. BD ( 2) C 1- C 16 72. BD*( 1) C 2-Br 4 3.82 0.29 0.030 34. BD ( 2) C 1- C 16 91. BD*( 2) C 17- C 18 23.54 0.31 0.076 34. BD ( 2) C 1- C 16 98. BD*( 2) C 20- C 21 25.86 0.30 0.079 34. BD ( 2) C 1- C 16 202. RY ( 4) C 16 0.77 1.19 0.027 34. BD ( 2) C 1- C 16 211. RY ( 3) C 17 1.69 1.59 0.046 34. BD ( 2) C 1- C 16 251. RY ( 3) C 21 1.41 1.86 0.046 35. BD ( 1) C 1- H 27 73. BD*( 1) C 2- C 5 3.83 0.94 0.053 35. BD ( 1) C 1- H 27 88. BD*( 1) C 16- C 17 5.36 1.03 0.066 35. BD ( 1) C 1- H 27 89. BD*( 1) C 16- C 21 0.60 1.02 0.022 35. BD ( 1) C 1- H 27 111. RY ( 1) C 2 0.53 1.43 0.025 35. BD ( 1) C 1- H 27 199. RY ( 1) C 16 1.23 1.74 0.041 36. BD ( 1) C 2- H 3 68. BD*( 1) C 1- C 16 3.11 1.05 0.051 36. BD ( 1) C 2- H 3 69. BD*( 2) C 1- C 16 2.92 0.50 0.034 36. BD ( 1) C 2- H 3 73. BD*( 1) C 2- C 5 0.60 0.92 0.021 36. BD ( 1) C 2- H 3 74. BD*( 1) C 5- C 6 3.08 1.09 0.052 36. BD ( 1) C 2- H 3 76. BD*( 2) C 5- C 10 0.89 0.55 0.020 36. BD ( 1) C 2- H 3 134. RY ( 1) C 5 0.70 1.65 0.030 37. BD ( 1) C 2-Br 4 68. BD*( 1) C 1- C 16 1.19 1.02 0.031 37. BD ( 1) C 2-Br 4 69. BD*( 2) C 1- C 16 12.88 0.47 0.070 37. BD ( 1) C 2-Br 4 75. BD*( 1) C 5- C 10 1.84 1.06 0.039 37. BD ( 1) C 2-Br 4 76. BD*( 2) C 5- C 10 1.58 0.52 0.026 37. BD ( 1) C 2-Br 4 102. RY ( 2) C 1 0.79 1.15 0.027 37. BD ( 1) C 2-Br 4 136. RY ( 3) C 5 0.66 1.30 0.026 38. BD ( 1) C 2- C 5 67. BD*( 1) C 1- C 2 0.90 0.97 0.026 38. BD ( 1) C 2- C 5 70. BD*( 1) C 1- H 27 0.95 1.03 0.028 38. BD ( 1) C 2- C 5 71. BD*( 1) C 2- H 3 0.73 1.04 0.025 38. BD ( 1) C 2- C 5 74. BD*( 1) C 5- C 6 1.84 1.16 0.041 38. BD ( 1) C 2- C 5 75. BD*( 1) C 5- C 10 1.29 1.16 0.034 38. BD ( 1) C 2- C 5 77. BD*( 1) C 6- C 7 1.45 1.18 0.037 38. BD ( 1) C 2- C 5 85. BD*( 1) C 9- C 10 1.54 1.17 0.038 38. BD ( 1) C 2- C 5 101. RY ( 1) C 1 1.05 1.68 0.037 38. BD ( 1) C 2- C 5 103. RY ( 3) C 1 0.53 1.49 0.025 38. BD ( 1) C 2- C 5 144. RY ( 1) C 6 1.29 1.84 0.043 38. BD ( 1) C 2- C 5 184. RY ( 1) C 10 1.39 1.83 0.045 39. BD ( 1) C 5- C 6 73. BD*( 1) C 2- C 5 1.42 0.99 0.034 39. BD ( 1) C 5- C 6 75. BD*( 1) C 5- C 10 2.68 1.16 0.050 39. BD ( 1) C 5- C 6 77. BD*( 1) C 6- C 7 1.70 1.18 0.040 39. BD ( 1) C 5- C 6 79. BD*( 1) C 6- H 15 1.07 1.08 0.030 39. BD ( 1) C 5- C 6 81. BD*( 1) C 7- H 14 1.61 1.09 0.037 39. BD ( 1) C 5- C 6 87. BD*( 1) C 10- H 11 1.67 1.08 0.038 39. BD ( 1) C 5- C 6 111. RY ( 1) C 2 0.76 1.48 0.030 39. BD ( 1) C 5- C 6 112. RY ( 2) C 2 0.63 1.43 0.027 39. BD ( 1) C 5- C 6 154. RY ( 1) C 7 1.13 1.86 0.041 39. BD ( 1) C 5- C 6 155. RY ( 2) C 7 0.95 1.32 0.032 39. BD ( 1) C 5- C 6 184. RY ( 1) C 10 0.60 1.84 0.030 40. BD ( 1) C 5- C 10 67. BD*( 1) C 1- C 2 0.53 0.97 0.020 40. BD ( 1) C 5- C 10 72. BD*( 1) C 2-Br 4 2.18 0.59 0.032 40. BD ( 1) C 5- C 10 73. BD*( 1) C 2- C 5 1.43 0.99 0.034 40. BD ( 1) C 5- C 10 74. BD*( 1) C 5- C 6 2.61 1.16 0.049 40. BD ( 1) C 5- C 10 79. BD*( 1) C 6- H 15 1.77 1.07 0.039 40. BD ( 1) C 5- C 10 85. BD*( 1) C 9- C 10 1.60 1.17 0.039 40. BD ( 1) C 5- C 10 86. BD*( 1) C 9- H 12 1.62 1.08 0.037 40. BD ( 1) C 5- C 10 87. BD*( 1) C 10- H 11 1.00 1.07 0.029 40. BD ( 1) C 5- C 10 111. RY ( 1) C 2 0.94 1.48 0.033 40. BD ( 1) C 5- C 10 112. RY ( 2) C 2 0.60 1.43 0.026 40. BD ( 1) C 5- C 10 144. RY ( 1) C 6 0.63 1.84 0.030 40. BD ( 1) C 5- C 10 174. RY ( 1) C 9 1.12 1.86 0.041 40. BD ( 1) C 5- C 10 175. RY ( 2) C 9 0.96 1.31 0.032 41. BD ( 2) C 5- C 10 67. BD*( 1) C 1- C 2 5.04 0.64 0.051 41. BD ( 2) C 5- C 10 71. BD*( 1) C 2- H 3 0.66 0.70 0.019 41. BD ( 2) C 5- C 10 72. BD*( 1) C 2-Br 4 5.37 0.26 0.033 41. BD ( 2) C 5- C 10 78. BD*( 2) C 6- C 7 19.76 0.29 0.067 41. BD ( 2) C 5- C 10 83. BD*( 2) C 8- C 9 18.22 0.29 0.065 41. BD ( 2) C 5- C 10 146. RY ( 3) C 6 1.34 1.72 0.043 41. BD ( 2) C 5- C 10 176. RY ( 3) C 9 0.65 2.14 0.033 41. BD ( 2) C 5- C 10 177. RY ( 4) C 9 0.91 1.03 0.027 41. BD ( 2) C 5- C 10 187. RY ( 4) C 10 0.53 1.37 0.024 42. BD ( 1) C 6- C 7 73. BD*( 1) C 2- C 5 3.45 0.99 0.052 42. BD ( 1) C 6- C 7 74. BD*( 1) C 5- C 6 1.95 1.15 0.042 42. BD ( 1) C 6- C 7 79. BD*( 1) C 6- H 15 1.19 1.07 0.032 42. BD ( 1) C 6- C 7 80. BD*( 1) C 7- C 8 1.50 1.17 0.037 42. BD ( 1) C 6- C 7 81. BD*( 1) C 7- H 14 1.01 1.08 0.029 42. BD ( 1) C 6- C 7 84. BD*( 1) C 8- H 13 1.77 1.08 0.039 42. BD ( 1) C 6- C 7 134. RY ( 1) C 5 2.38 1.72 0.057 42. BD ( 1) C 6- C 7 164. RY ( 1) C 8 0.94 1.86 0.037 42. BD ( 1) C 6- C 7 165. RY ( 2) C 8 0.87 1.31 0.030 43. BD ( 2) C 6- C 7 76. BD*( 2) C 5- C 10 20.57 0.27 0.067 43. BD ( 2) C 6- C 7 83. BD*( 2) C 8- C 9 19.99 0.29 0.067 43. BD ( 2) C 6- C 7 92. BD*( 1) C 17- H 26 0.97 0.73 0.024 43. BD ( 2) C 6- C 7 137. RY ( 4) C 5 0.51 2.17 0.030 43. BD ( 2) C 6- C 7 157. RY ( 4) C 7 0.53 1.13 0.022 43. BD ( 2) C 6- C 7 167. RY ( 4) C 8 1.64 0.97 0.036 44. BD ( 1) C 6- H 15 74. BD*( 1) C 5- C 6 0.58 1.05 0.022 44. BD ( 1) C 6- H 15 75. BD*( 1) C 5- C 10 3.69 1.05 0.056 44. BD ( 1) C 6- H 15 77. BD*( 1) C 6- C 7 0.63 1.07 0.023 44. BD ( 1) C 6- H 15 80. BD*( 1) C 7- C 8 2.99 1.07 0.050 44. BD ( 1) C 6- H 15 134. RY ( 1) C 5 0.77 1.62 0.031 44. BD ( 1) C 6- H 15 135. RY ( 2) C 5 0.55 1.68 0.027 44. BD ( 1) C 6- H 15 154. RY ( 1) C 7 1.03 1.75 0.038 45. BD ( 1) C 7- C 8 77. BD*( 1) C 6- C 7 1.48 1.17 0.037 45. BD ( 1) C 7- C 8 79. BD*( 1) C 6- H 15 1.93 1.07 0.040 45. BD ( 1) C 7- C 8 81. BD*( 1) C 7- H 14 1.02 1.08 0.030 45. BD ( 1) C 7- C 8 82. BD*( 1) C 8- C 9 1.41 1.17 0.036 45. BD ( 1) C 7- C 8 84. BD*( 1) C 8- H 13 0.98 1.08 0.029 45. BD ( 1) C 7- C 8 86. BD*( 1) C 9- H 12 1.89 1.07 0.040 45. BD ( 1) C 7- C 8 144. RY ( 1) C 6 0.75 1.83 0.033 45. BD ( 1) C 7- C 8 145. RY ( 2) C 6 1.20 1.37 0.036 45. BD ( 1) C 7- C 8 174. RY ( 1) C 9 0.92 1.85 0.037 45. BD ( 1) C 7- C 8 175. RY ( 2) C 9 0.95 1.31 0.031 46. BD ( 1) C 7- H 14 74. BD*( 1) C 5- C 6 3.44 1.05 0.054 46. BD ( 1) C 7- H 14 77. BD*( 1) C 6- C 7 0.51 1.06 0.021 46. BD ( 1) C 7- H 14 82. BD*( 1) C 8- C 9 3.07 1.06 0.051 46. BD ( 1) C 7- H 14 144. RY ( 1) C 6 0.80 1.73 0.033 46. BD ( 1) C 7- H 14 164. RY ( 1) C 8 0.92 1.75 0.036 47. BD ( 1) C 8- C 9 80. BD*( 1) C 7- C 8 1.41 1.16 0.036 47. BD ( 1) C 8- C 9 81. BD*( 1) C 7- H 14 1.86 1.08 0.040 47. BD ( 1) C 8- C 9 84. BD*( 1) C 8- H 13 1.00 1.08 0.029 47. BD ( 1) C 8- C 9 85. BD*( 1) C 9- C 10 1.48 1.17 0.037 47. BD ( 1) C 8- C 9 86. BD*( 1) C 9- H 12 1.04 1.08 0.030 47. BD ( 1) C 8- C 9 87. BD*( 1) C 10- H 11 1.90 1.07 0.040 47. BD ( 1) C 8- C 9 154. RY ( 1) C 7 0.90 1.85 0.036 47. BD ( 1) C 8- C 9 155. RY ( 2) C 7 0.98 1.31 0.032 47. BD ( 1) C 8- C 9 184. RY ( 1) C 10 0.76 1.83 0.033 47. BD ( 1) C 8- C 9 185. RY ( 2) C 10 1.16 1.40 0.036 48. BD ( 2) C 8- C 9 76. BD*( 2) C 5- C 10 22.78 0.27 0.070 48. BD ( 2) C 8- C 9 78. BD*( 2) C 6- C 7 20.34 0.28 0.067 48. BD ( 2) C 8- C 9 157. RY ( 4) C 7 1.87 1.13 0.041 48. BD ( 2) C 8- C 9 187. RY ( 4) C 10 1.82 1.36 0.044 49. BD ( 1) C 8- H 13 77. BD*( 1) C 6- C 7 3.15 1.07 0.052 49. BD ( 1) C 8- H 13 85. BD*( 1) C 9- C 10 3.17 1.06 0.052 49. BD ( 1) C 8- H 13 154. RY ( 1) C 7 0.91 1.75 0.036 49. BD ( 1) C 8- H 13 174. RY ( 1) C 9 0.92 1.75 0.036 50. BD ( 1) C 9- C 10 73. BD*( 1) C 2- C 5 3.01 0.99 0.049 50. BD ( 1) C 9- C 10 75. BD*( 1) C 5- C 10 1.86 1.15 0.041 50. BD ( 1) C 9- C 10 82. BD*( 1) C 8- C 9 1.48 1.17 0.037 50. BD ( 1) C 9- C 10 84. BD*( 1) C 8- H 13 1.81 1.08 0.039 50. BD ( 1) C 9- C 10 86. BD*( 1) C 9- H 12 0.99 1.08 0.029 50. BD ( 1) C 9- C 10 87. BD*( 1) C 10- H 11 1.11 1.07 0.031 50. BD ( 1) C 9- C 10 135. RY ( 2) C 5 2.27 1.78 0.057 50. BD ( 1) C 9- C 10 164. RY ( 1) C 8 0.93 1.86 0.037 50. BD ( 1) C 9- C 10 165. RY ( 2) C 8 0.88 1.31 0.030 51. BD ( 1) C 9- H 12 75. BD*( 1) C 5- C 10 3.33 1.04 0.053 51. BD ( 1) C 9- H 12 80. BD*( 1) C 7- C 8 3.10 1.06 0.051 51. BD ( 1) C 9- H 12 164. RY ( 1) C 8 0.92 1.75 0.036 51. BD ( 1) C 9- H 12 184. RY ( 1) C 10 0.77 1.72 0.033 52. BD ( 1) C 10- H 11 74. BD*( 1) C 5- C 6 3.58 1.05 0.055 52. BD ( 1) C 10- H 11 75. BD*( 1) C 5- C 10 0.51 1.05 0.021 52. BD ( 1) C 10- H 11 82. BD*( 1) C 8- C 9 2.98 1.07 0.050 52. BD ( 1) C 10- H 11 85. BD*( 1) C 9- C 10 0.57 1.07 0.022 52. BD ( 1) C 10- H 11 134. RY ( 1) C 5 0.62 1.62 0.028 52. BD ( 1) C 10- H 11 135. RY ( 2) C 5 0.61 1.68 0.029 52. BD ( 1) C 10- H 11 174. RY ( 1) C 9 0.99 1.75 0.037 53. BD ( 1) C 16- C 17 68. BD*( 1) C 1- C 16 2.14 1.14 0.044 53. BD ( 1) C 16- C 17 70. BD*( 1) C 1- H 27 1.07 1.06 0.030 53. BD ( 1) C 16- C 17 89. BD*( 1) C 16- C 21 1.73 1.10 0.039 53. BD ( 1) C 16- C 17 90. BD*( 1) C 17- C 18 1.16 1.19 0.033 53. BD ( 1) C 16- C 17 92. BD*( 1) C 17- H 26 0.75 1.10 0.026 53. BD ( 1) C 16- C 17 94. BD*( 1) C 18- H 25 1.84 1.09 0.040 53. BD ( 1) C 16- C 17 100. BD*( 1) C 21- H 22 1.31 1.08 0.034 53. BD ( 1) C 16- C 17 101. RY ( 1) C 1 1.07 1.70 0.038 53. BD ( 1) C 16- C 17 219. RY ( 1) C 18 1.14 1.86 0.041 53. BD ( 1) C 16- C 17 220. RY ( 2) C 18 0.98 1.32 0.032 53. BD ( 1) C 16- C 17 249. RY ( 1) C 21 0.55 1.84 0.028 54. BD ( 1) C 16- C 21 67. BD*( 1) C 1- C 2 3.33 0.99 0.051 54. BD ( 1) C 16- C 21 68. BD*( 1) C 1- C 16 1.87 1.14 0.041 54. BD ( 1) C 16- C 21 88. BD*( 1) C 16- C 17 1.67 1.10 0.038 54. BD ( 1) C 16- C 21 92. BD*( 1) C 17- H 26 1.50 1.10 0.036 54. BD ( 1) C 16- C 21 97. BD*( 1) C 20- C 21 1.08 1.18 0.032 54. BD ( 1) C 16- C 21 99. BD*( 1) C 20- H 23 1.92 1.09 0.041 54. BD ( 1) C 16- C 21 100. BD*( 1) C 21- H 22 0.55 1.08 0.022 54. BD ( 1) C 16- C 21 101. RY ( 1) C 1 1.86 1.70 0.050 54. BD ( 1) C 16- C 21 209. RY ( 1) C 17 0.60 1.88 0.030 54. BD ( 1) C 16- C 21 239. RY ( 1) C 20 1.11 1.85 0.040 54. BD ( 1) C 16- C 21 240. RY ( 2) C 20 1.04 1.31 0.033 55. BD ( 1) C 17- C 18 68. BD*( 1) C 1- C 16 2.71 1.16 0.050 55. BD ( 1) C 17- C 18 88. BD*( 1) C 16- C 17 1.29 1.12 0.034 55. BD ( 1) C 17- C 18 92. BD*( 1) C 17- H 26 1.25 1.11 0.033 55. BD ( 1) C 17- C 18 93. BD*( 1) C 18- C 19 1.30 1.16 0.035 55. BD ( 1) C 17- C 18 94. BD*( 1) C 18- H 25 1.12 1.10 0.031 55. BD ( 1) C 17- C 18 96. BD*( 1) C 19- H 24 1.51 1.10 0.036 55. BD ( 1) C 17- C 18 199. RY ( 1) C 16 2.35 1.83 0.059 55. BD ( 1) C 17- C 18 229. RY ( 1) C 19 0.98 1.88 0.038 55. BD ( 1) C 17- C 18 230. RY ( 2) C 19 0.86 1.34 0.030 56. BD ( 2) C 17- C 18 66. LV ( 1) C 19 77.95 0.15 0.095 56. BD ( 2) C 17- C 18 69. BD*( 2) C 1- C 16 14.62 0.26 0.055 56. BD ( 2) C 17- C 18 91. BD*( 2) C 17- C 18 0.69 0.29 0.013 56. BD ( 2) C 17- C 18 202. RY ( 4) C 16 0.80 1.17 0.027 56. BD ( 2) C 17- C 18 221. RY ( 3) C 18 0.55 1.96 0.029 56. BD ( 2) C 17- C 18 231. RY ( 3) C 19 0.56 2.18 0.031 56. BD ( 2) C 17- C 18 232. RY ( 4) C 19 1.35 1.01 0.033 57. BD ( 1) C 17- H 26 89. BD*( 1) C 16- C 21 3.58 1.00 0.053 57. BD ( 1) C 17- H 26 90. BD*( 1) C 17- C 18 0.70 1.09 0.025 57. BD ( 1) C 17- H 26 93. BD*( 1) C 18- C 19 3.38 1.05 0.053 57. BD ( 1) C 17- H 26 199. RY ( 1) C 16 0.98 1.72 0.037 57. BD ( 1) C 17- H 26 219. RY ( 1) C 18 1.14 1.76 0.040 58. BD ( 1) C 18- C 19 90. BD*( 1) C 17- C 18 1.25 1.19 0.035 58. BD ( 1) C 18- C 19 92. BD*( 1) C 17- H 26 1.94 1.10 0.041 58. BD ( 1) C 18- C 19 94. BD*( 1) C 18- H 25 0.91 1.10 0.028 58. BD ( 1) C 18- C 19 95. BD*( 1) C 19- C 20 0.96 1.16 0.030 58. BD ( 1) C 18- C 19 96. BD*( 1) C 19- H 24 0.74 1.09 0.025 58. BD ( 1) C 18- C 19 99. BD*( 1) C 20- H 23 1.71 1.10 0.039 58. BD ( 1) C 18- C 19 209. RY ( 1) C 17 1.05 1.89 0.040 58. BD ( 1) C 18- C 19 210. RY ( 2) C 17 1.02 1.46 0.034 58. BD ( 1) C 18- C 19 239. RY ( 1) C 20 0.94 1.86 0.037 58. BD ( 1) C 18- C 19 240. RY ( 2) C 20 0.95 1.32 0.032 59. BD ( 1) C 18- H 25 88. BD*( 1) C 16- C 17 3.66 1.00 0.054 59. BD ( 1) C 18- H 25 90. BD*( 1) C 17- C 18 0.65 1.08 0.024 59. BD ( 1) C 18- H 25 95. BD*( 1) C 19- C 20 3.07 1.04 0.050 59. BD ( 1) C 18- H 25 209. RY ( 1) C 17 0.94 1.78 0.036 59. BD ( 1) C 18- H 25 229. RY ( 1) C 19 0.91 1.76 0.036 60. BD ( 1) C 19- C 20 93. BD*( 1) C 18- C 19 0.96 1.15 0.030 60. BD ( 1) C 19- C 20 94. BD*( 1) C 18- H 25 1.65 1.10 0.038 60. BD ( 1) C 19- C 20 96. BD*( 1) C 19- H 24 0.76 1.09 0.026 60. BD ( 1) C 19- C 20 97. BD*( 1) C 20- C 21 1.30 1.19 0.035 60. BD ( 1) C 19- C 20 99. BD*( 1) C 20- H 23 0.96 1.10 0.029 60. BD ( 1) C 19- C 20 100. BD*( 1) C 21- H 22 2.01 1.08 0.042 60. BD ( 1) C 19- C 20 219. RY ( 1) C 18 0.96 1.86 0.038 60. BD ( 1) C 19- C 20 220. RY ( 2) C 18 0.97 1.33 0.032 60. BD ( 1) C 19- C 20 249. RY ( 1) C 21 0.71 1.85 0.032 60. BD ( 1) C 19- C 20 250. RY ( 2) C 21 1.32 1.45 0.039 61. BD ( 1) C 19- H 24 90. BD*( 1) C 17- C 18 3.21 1.09 0.053 61. BD ( 1) C 19- H 24 97. BD*( 1) C 20- C 21 3.20 1.09 0.053 61. BD ( 1) C 19- H 24 219. RY ( 1) C 18 0.91 1.75 0.036 61. BD ( 1) C 19- H 24 239. RY ( 1) C 20 0.91 1.75 0.036 62. BD ( 1) C 20- C 21 68. BD*( 1) C 1- C 16 2.11 1.16 0.044 62. BD ( 1) C 20- C 21 89. BD*( 1) C 16- C 21 1.21 1.11 0.033 62. BD ( 1) C 20- C 21 95. BD*( 1) C 19- C 20 1.32 1.17 0.035 62. BD ( 1) C 20- C 21 96. BD*( 1) C 19- H 24 1.57 1.10 0.037 62. BD ( 1) C 20- C 21 99. BD*( 1) C 20- H 23 1.17 1.11 0.032 62. BD ( 1) C 20- C 21 100. BD*( 1) C 21- H 22 1.12 1.09 0.031 62. BD ( 1) C 20- C 21 200. RY ( 2) C 16 2.09 1.89 0.056 62. BD ( 1) C 20- C 21 229. RY ( 1) C 19 1.04 1.88 0.040 62. BD ( 1) C 20- C 21 230. RY ( 2) C 19 0.83 1.34 0.030 63. BD ( 2) C 20- C 21 66. LV ( 1) C 19 80.36 0.15 0.097 63. BD ( 2) C 20- C 21 69. BD*( 2) C 1- C 16 12.40 0.26 0.050 63. BD ( 2) C 20- C 21 98. BD*( 2) C 20- C 21 1.02 0.29 0.015 63. BD ( 2) C 20- C 21 202. RY ( 4) C 16 0.60 1.17 0.024 63. BD ( 2) C 20- C 21 231. RY ( 3) C 19 0.55 2.18 0.031 63. BD ( 2) C 20- C 21 232. RY ( 4) C 19 1.45 1.01 0.034 63. BD ( 2) C 20- C 21 241. RY ( 3) C 20 0.57 1.99 0.030 64. BD ( 1) C 20- H 23 89. BD*( 1) C 16- C 21 3.52 0.99 0.053 64. BD ( 1) C 20- H 23 93. BD*( 1) C 18- C 19 3.06 1.04 0.050 64. BD ( 1) C 20- H 23 97. BD*( 1) C 20- C 21 0.64 1.08 0.023 64. BD ( 1) C 20- H 23 229. RY ( 1) C 19 0.92 1.76 0.036 64. BD ( 1) C 20- H 23 249. RY ( 1) C 21 0.78 1.73 0.033 65. BD ( 1) C 21- H 22 88. BD*( 1) C 16- C 17 3.48 1.01 0.053 65. BD ( 1) C 21- H 22 95. BD*( 1) C 19- C 20 3.27 1.05 0.052 65. BD ( 1) C 21- H 22 97. BD*( 1) C 20- C 21 0.61 1.09 0.023 65. BD ( 1) C 21- H 22 200. RY ( 2) C 16 0.56 1.78 0.028 65. BD ( 1) C 21- H 22 239. RY ( 1) C 20 1.04 1.76 0.038 NATURAL BOND ORBITALS (Summary): Principal Delocalizations NBO Occupancy Energy (geminal,vicinal,remote) =============================================================================== Molecular unit 1 (C14H12Br) ------ Lewis -------------------------------------- 1. CR ( 1) C 1 2.00000 -10.30749 2. CR ( 1) C 2 1.99999 -10.29865 3. CR ( 1)Br 4 2.00000 -475.22783 4. CR ( 2)Br 4 2.00000 -50.66828 5. CR ( 3)Br 4 1.99988 -27.53388 6. CR ( 4)Br 4 2.00000 -22.95315 7. CR ( 5)Br 4 1.99999 -40.02417 8. CR ( 6)Br 4 2.00000 -22.95913 9. CR ( 7)Br 4 1.99997 -40.02673 10. CR ( 8)Br 4 2.00000 -22.95595 11. CR ( 9)Br 4 1.99999 -40.02538 12. CR (10)Br 4 2.00000 -2.67705 13. CR (11)Br 4 2.00000 -2.67419 14. CR (12)Br 4 1.99999 -2.67965 15. CR (13)Br 4 1.99999 -2.67707 16. CR (14)Br 4 2.00000 -2.67681 17. CR ( 1) C 5 2.00000 -10.22886 18. CR ( 1) C 6 2.00000 -10.21014 19. CR ( 1) C 7 2.00000 -10.20646 20. CR ( 1) C 8 2.00000 -10.20675 21. CR ( 1) C 9 2.00000 -10.20617 22. CR ( 1) C 10 2.00000 -10.21239 23. CR ( 1) C 16 2.00000 -10.26149 24. CR ( 1) C 17 2.00000 -10.25004 25. CR ( 1) C 18 2.00000 -10.23399 26. CR ( 1) C 19 2.00000 -10.25576 27. CR ( 1) C 20 2.00000 -10.23360 28. CR ( 1) C 21 2.00000 -10.25413 29. LP ( 1)Br 4 1.99665 -0.72450 30. LP ( 2)Br 4 1.98284 -0.31387 73(v),71(v),79(r),111(v) 31. LP ( 3)Br 4 1.90219 -0.31691 69(r),72(g),67(v),73(v) 32. BD ( 1) C 1- C 2 1.98230 -0.64570 89(v),200(v),76(v),68(g) 199(v),73(g),136(v) 33. BD ( 1) C 1- C 16 1.98242 -0.67177 88(g),89(g),249(v),97(v) 111(v),67(g),209(v),90(v) 70(g),112(v) 34. BD ( 2) C 1- C 16 1.53394 -0.30357 98(v),91(v),69(g),72(v) 211(v),251(v),71(v),202(g) 35. BD ( 1) C 1- H 27 1.97790 -0.54802 88(v),73(v),199(v),89(v) 111(v) 36. BD ( 1) C 2- H 3 1.96206 -0.53529 68(v),74(v),69(v),76(v) 134(v),73(g) 37. BD ( 1) C 2-Br 4 1.90446 -0.50553 69(v),75(v),76(v),68(v) 102(v),136(v) 38. BD ( 1) C 2- C 5 1.98067 -0.60428 74(g),85(v),77(v),184(v) 144(v),75(g),101(v),70(v) 67(g),71(g),103(v) 39. BD ( 1) C 5- C 6 1.97510 -0.60619 75(g),77(g),87(v),81(v) 73(g),154(v),79(g),155(v) 111(v),112(v),184(v) 40. BD ( 1) C 5- C 10 1.96908 -0.60276 74(g),72(v),79(v),86(v) 85(g),73(g),174(v),87(g) 175(v),111(v),144(v),112(v) 67(v) 41. BD ( 2) C 5- C 10 1.66728 -0.26681 78(v),83(v),72(v),67(v) 146(v),177(v),71(v),176(v) 187(g) 42. BD ( 1) C 6- C 7 1.97950 -0.59861 73(v),134(v),74(g),84(v) 80(g),79(g),81(g),164(v) 165(v) 43. BD ( 2) C 6- C 7 1.65872 -0.26022 76(v),83(v),167(v),92(r) 157(g),137(v) 44. BD ( 1) C 6- H 15 1.98141 -0.49825 75(v),80(v),154(v),134(v) 77(g),74(g),135(v) 45. BD ( 1) C 7- C 8 1.98197 -0.59569 79(v),86(v),77(g),82(g) 145(v),81(g),84(g),175(v) 174(v),144(v) 46. BD ( 1) C 7- H 14 1.98258 -0.49236 74(v),82(v),164(v),144(v) 77(g) 47. BD ( 1) C 8- C 9 1.98205 -0.59654 87(v),81(v),85(g),80(g) 185(v),86(g),84(g),155(v) 154(v),184(v) 48. BD ( 2) C 8- C 9 1.64088 -0.25598 76(v),78(v),157(v),187(v) 49. BD ( 1) C 8- H 13 1.98309 -0.49276 85(v),77(v),174(v),154(v) 50. BD ( 1) C 9- C 10 1.97891 -0.59792 73(v),135(v),75(g),84(v) 82(g),87(g),86(g),164(v) 165(v) 51. BD ( 1) C 9- H 12 1.98228 -0.49253 75(v),80(v),164(v),184(v) 52. BD ( 1) C 10- H 11 1.98208 -0.49848 74(v),82(v),174(v),134(v) 135(v),85(g),75(g) 53. BD ( 1) C 16- C 17 1.97692 -0.62601 68(g),94(v),89(g),100(v) 90(g),219(v),70(v),101(v) 220(v),92(g),249(v) 54. BD ( 1) C 16- C 21 1.97493 -0.62172 67(v),99(v),68(g),101(v) 88(g),92(v),239(v),97(g) 240(v),209(v),100(g) 55. BD ( 1) C 17- C 18 1.98263 -0.63802 68(v),199(v),96(v),93(g) 88(g),92(g),94(g),229(v) 230(v) 56. BD ( 2) C 17- C 18 1.64888 -0.28921 66(v),69(v),232(v),202(v) 91(g),231(v),221(g) 57. BD ( 1) C 17- H 26 1.98078 -0.52593 89(v),93(v),219(v),199(v) 90(g) 58. BD ( 1) C 18- C 19 1.98372 -0.62922 92(v),99(v),90(g),209(v) 210(v),95(g),240(v),239(v) 94(g),96(g) 59. BD ( 1) C 18- H 25 1.98180 -0.51464 88(v),95(v),209(v),229(v) 90(g) 60. BD ( 1) C 19- C 20 1.98336 -0.63028 100(v),94(v),250(v),97(g) 220(v),93(g),99(g),219(v) 96(g),249(v) 61. BD ( 1) C 19- H 24 1.98352 -0.52353 90(v),97(v),239(v),219(v) 62. BD ( 1) C 20- C 21 1.98316 -0.64024 68(v),200(v),96(v),95(g) 89(g),99(g),100(g),229(v) 230(v) 63. BD ( 2) C 20- C 21 1.63693 -0.28981 66(v),69(v),232(v),98(g) 202(v),241(g),231(v) 64. BD ( 1) C 20- H 23 1.98165 -0.51547 89(v),93(v),229(v),249(v) 97(g) 65. BD ( 1) C 21- H 22 1.98242 -0.52776 88(v),95(v),239(v),97(g) 200(v) ------ non-Lewis ---------------------------------- 66. LV ( 1) C 19 0.80942 -0.14420 67. BD*( 1) C 1- C 2 0.02463 0.37060 68. BD*( 1) C 1- C 16 0.02097 0.51707 69. BD*( 2) C 1- C 16 0.16446 -0.03204 70. BD*( 1) C 1- H 27 0.00985 0.43061 71. BD*( 1) C 2- H 3 0.01425 0.43367 72. BD*( 1) C 2-Br 4 0.05930 -0.01100 73. BD*( 1) C 2- C 5 0.03266 0.38842 74. BD*( 1) C 5- C 6 0.02320 0.55279 75. BD*( 1) C 5- C 10 0.02191 0.55191 76. BD*( 2) C 5- C 10 0.37188 0.01404 77. BD*( 1) C 6- C 7 0.01357 0.57231 78. BD*( 2) C 6- C 7 0.30941 0.02216 79. BD*( 1) C 6- H 15 0.01444 0.47056 80. BD*( 1) C 7- C 8 0.01433 0.56777 81. BD*( 1) C 7- H 14 0.01142 0.47933 82. BD*( 1) C 8- C 9 0.01416 0.57069 83. BD*( 2) C 8- C 9 0.30876 0.02558 84. BD*( 1) C 8- H 13 0.01160 0.47977 85. BD*( 1) C 9- C 10 0.01304 0.57060 86. BD*( 1) C 9- H 12 0.01142 0.47911 87. BD*( 1) C 10- H 11 0.01164 0.46914 88. BD*( 1) C 16- C 17 0.02588 0.48184 89. BD*( 1) C 16- C 21 0.02153 0.47210 90. BD*( 1) C 17- C 18 0.01174 0.56518 91. BD*( 2) C 17- C 18 0.18136 0.00316 92. BD*( 1) C 17- H 26 0.01396 0.47341 93. BD*( 1) C 18- C 19 0.01407 0.52159 94. BD*( 1) C 18- H 25 0.01162 0.46670 95. BD*( 1) C 19- C 20 0.01394 0.52590 96. BD*( 1) C 19- H 24 0.01020 0.46212 97. BD*( 1) C 20- C 21 0.01163 0.56238 98. BD*( 2) C 20- C 21 0.19145 0.00072 99. BD*( 1) C 20- H 23 0.01175 0.46638 100. BD*( 1) C 21- H 22 0.01064 0.45405 101. RY ( 1) C 1 0.00614 1.07414 102. RY ( 2) C 1 0.00279 0.64929 103. RY ( 3) C 1 0.00211 0.88397 104. RY ( 4) C 1 0.00092 1.69507 105. RY ( 5) C 1 0.00063 1.41561 106. RY ( 6) C 1 0.00012 2.07830 107. RY ( 7) C 1 0.00004 1.97997 108. RY ( 8) C 1 0.00003 2.54335 109. RY ( 9) C 1 0.00002 2.95650 110. RY (10) C 1 0.00001 2.45421 111. RY ( 1) C 2 0.00591 0.87857 112. RY ( 2) C 2 0.00483 0.82433 113. RY ( 3) C 2 0.00273 0.80931 114. RY ( 4) C 2 0.00104 1.59951 115. RY ( 5) C 2 0.00046 1.98776 116. RY ( 6) C 2 0.00034 1.84486 117. RY ( 7) C 2 0.00012 2.02202 118. RY ( 8) C 2 0.00008 1.98157 119. RY ( 9) C 2 0.00004 1.85362 120. RY (10) C 2 0.00001 4.18611 121. RY ( 1) H 3 0.00151 0.60641 122. RY ( 1)Br 4 0.00156 0.55213 123. RY ( 2)Br 4 0.00089 0.54213 124. RY ( 3)Br 4 0.00076 0.57297 125. RY ( 4)Br 4 0.00017 0.54106 126. RY ( 5)Br 4 0.00008 1.17485 127. RY ( 6)Br 4 0.00006 0.78322 128. RY ( 7)Br 4 0.00005 0.95487 129. RY ( 8)Br 4 0.00003 4.31138 130. RY ( 9)Br 4 0.00001 0.86014 131. RY (10)Br 4 0.00000 3.04325 132. RY (11)Br 4 0.00000 37.49149 133. RY (12)Br 4 0.00000 38.38849 134. RY ( 1) C 5 0.00521 1.11738 135. RY ( 2) C 5 0.00428 1.18613 136. RY ( 3) C 5 0.00275 0.79532 137. RY ( 4) C 5 0.00077 1.90838 138. RY ( 5) C 5 0.00048 1.31169 139. RY ( 6) C 5 0.00019 2.29064 140. RY ( 7) C 5 0.00013 1.97120 141. RY ( 8) C 5 0.00007 3.58164 142. RY ( 9) C 5 0.00004 2.75317 143. RY (10) C 5 0.00001 2.28134 144. RY ( 1) C 6 0.00458 1.23674 145. RY ( 2) C 6 0.00247 0.76952 146. RY ( 3) C 6 0.00068 1.45128 147. RY ( 4) C 6 0.00054 1.19483 148. RY ( 5) C 6 0.00019 1.19460 149. RY ( 6) C 6 0.00011 2.29141 150. RY ( 7) C 6 0.00004 3.84207 151. RY ( 8) C 6 0.00003 2.42613 152. RY ( 9) C 6 0.00002 2.12402 153. RY (10) C 6 0.00000 2.09371 154. RY ( 1) C 7 0.00482 1.25444 155. RY ( 2) C 7 0.00254 0.71223 156. RY ( 3) C 7 0.00061 1.76817 157. RY ( 4) C 7 0.00035 0.87399 158. RY ( 5) C 7 0.00017 1.18321 159. RY ( 6) C 7 0.00011 2.18926 160. RY ( 7) C 7 0.00004 4.17948 161. RY ( 8) C 7 0.00000 2.11630 162. RY ( 9) C 7 0.00000 2.26016 163. RY (10) C 7 0.00000 1.80059 164. RY ( 1) C 8 0.00461 1.26141 165. RY ( 2) C 8 0.00224 0.70771 166. RY ( 3) C 8 0.00060 1.92003 167. RY ( 4) C 8 0.00036 0.71426 168. RY ( 5) C 8 0.00012 2.33916 169. RY ( 6) C 8 0.00010 1.00677 170. RY ( 7) C 8 0.00004 4.18717 171. RY ( 8) C 8 0.00000 2.16597 172. RY ( 9) C 8 0.00000 2.04240 173. RY (10) C 8 0.00000 1.95052 174. RY ( 1) C 9 0.00475 1.25412 175. RY ( 2) C 9 0.00250 0.71201 176. RY ( 3) C 9 0.00059 1.87362 177. RY ( 4) C 9 0.00036 0.76686 178. RY ( 5) C 9 0.00015 1.25326 179. RY ( 6) C 9 0.00011 2.11488 180. RY ( 7) C 9 0.00004 4.16931 181. RY ( 8) C 9 0.00000 2.14065 182. RY ( 9) C 9 0.00000 1.96369 183. RY (10) C 9 0.00000 2.07217 184. RY ( 1) C 10 0.00488 1.22898 185. RY ( 2) C 10 0.00224 0.79912 186. RY ( 3) C 10 0.00078 1.50641 187. RY ( 4) C 10 0.00039 1.10613 188. RY ( 5) C 10 0.00019 1.07826 189. RY ( 6) C 10 0.00009 2.33360 190. RY ( 7) C 10 0.00004 3.83148 191. RY ( 8) C 10 0.00001 2.32141 192. RY ( 9) C 10 0.00001 2.27638 193. RY (10) C 10 0.00000 1.94007 194. RY ( 1) H 11 0.00088 0.57959 195. RY ( 1) H 12 0.00073 0.57122 196. RY ( 1) H 13 0.00071 0.57139 197. RY ( 1) H 14 0.00072 0.57076 198. RY ( 1) H 15 0.00123 0.59710 199. RY ( 1) C 16 0.00582 1.19610 200. RY ( 2) C 16 0.00444 1.24947 201. RY ( 3) C 16 0.00062 1.84253 202. RY ( 4) C 16 0.00036 0.88472 203. RY ( 5) C 16 0.00029 1.12691 204. RY ( 6) C 16 0.00024 1.72852 205. RY ( 7) C 16 0.00016 2.74485 206. RY ( 8) C 16 0.00007 2.77724 207. RY ( 9) C 16 0.00002 3.03877 208. RY (10) C 16 0.00000 2.27967 209. RY ( 1) C 17 0.00430 1.26145 210. RY ( 2) C 17 0.00225 0.82709 211. RY ( 3) C 17 0.00075 1.29083 212. RY ( 4) C 17 0.00031 1.25716 213. RY ( 5) C 17 0.00018 1.08080 214. RY ( 6) C 17 0.00009 2.33522 215. RY ( 7) C 17 0.00004 3.73254 216. RY ( 8) C 17 0.00002 2.47963 217. RY ( 9) C 17 0.00001 1.75191 218. RY (10) C 17 0.00000 2.27798 219. RY ( 1) C 18 0.00500 1.23038 220. RY ( 2) C 18 0.00249 0.69657 221. RY ( 3) C 18 0.00036 1.67172 222. RY ( 4) C 18 0.00028 0.91046 223. RY ( 5) C 18 0.00017 1.47894 224. RY ( 6) C 18 0.00010 1.83945 225. RY ( 7) C 18 0.00005 4.13816 226. RY ( 8) C 18 0.00000 2.13568 227. RY ( 9) C 18 0.00000 2.29055 228. RY (10) C 18 0.00000 1.69057 229. RY ( 1) C 19 0.00475 1.24440 230. RY ( 2) C 19 0.00210 0.70115 231. RY ( 3) C 19 0.00057 1.88911 232. RY ( 4) C 19 0.00018 0.71823 233. RY ( 5) C 19 0.00014 2.25821 234. RY ( 6) C 19 0.00010 1.20531 235. RY ( 7) C 19 0.00003 3.89911 236. RY ( 8) C 19 0.00000 2.11892 237. RY ( 9) C 19 0.00000 1.61848 238. RY (10) C 19 0.00000 2.29852 239. RY ( 1) C 20 0.00485 1.22916 240. RY ( 2) C 20 0.00253 0.68595 241. RY ( 3) C 20 0.00034 1.70164 242. RY ( 4) C 20 0.00030 0.87058 243. RY ( 5) C 20 0.00016 1.55536 244. RY ( 6) C 20 0.00010 1.82558 245. RY ( 7) C 20 0.00005 4.09247 246. RY ( 8) C 20 0.00000 2.11649 247. RY ( 9) C 20 0.00000 2.11383 248. RY (10) C 20 0.00000 1.86695 249. RY ( 1) C 21 0.00484 1.21854 250. RY ( 2) C 21 0.00234 0.81676 251. RY ( 3) C 21 0.00075 1.55287 252. RY ( 4) C 21 0.00027 1.02112 253. RY ( 5) C 21 0.00019 1.14833 254. RY ( 6) C 21 0.00008 2.40062 255. RY ( 7) C 21 0.00003 3.47170 256. RY ( 8) C 21 0.00001 2.57910 257. RY ( 9) C 21 0.00000 1.98623 258. RY (10) C 21 0.00000 1.94560 259. RY ( 1) H 22 0.00084 0.57176 260. RY ( 1) H 23 0.00064 0.55589 261. RY ( 1) H 24 0.00065 0.55310 262. RY ( 1) H 25 0.00065 0.55653 263. RY ( 1) H 26 0.00130 0.75249 264. RY ( 1) H 27 0.00156 0.59621 ------------------------------- Total Lewis 127.03081 ( 97.7160%) Valence non-Lewis 2.81614 ( 2.1663%) Rydberg non-Lewis 0.15305 ( 0.1177%) ------------------------------- Total unit 1 130.00000 (100.0000%) Charge unit 1 1.00000 $CHOOSE LONE 4 3 END BOND S 1 2 D 1 16 S 1 27 S 2 3 S 2 4 S 2 5 S 5 6 D 5 10 D 6 7 S 6 15 S 7 8 S 7 14 D 8 9 S 8 13 S 9 10 S 9 12 S 10 11 S 16 17 S 16 21 D 17 18 S 17 26 S 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END $END NATURAL RESONANCE THEORY ANALYSIS: Parent structure threshold: 50% of leading weight Delocalization list threshold: 1 kcal/mol Maximum search cycles: 3 C1 symmetry, 1 symmetry operator(s), 1 unique atom permutation(s) 22 initial TOPO matrices: NLS = 1; NBI = 21; SYM = 0 cycle structures D(w) kmax CHOOSE ION E2 SYM dbmax dbrms ------------------------------------------------------------------------------ 1 18/18 0.07516903 22 22 0 1139 0 1.577 1.238 2 189/957 0.07170659 216 1279 -66 464 0 0.368 0.077 3 232/1753 0.07162636 266 2832 -352 446 0 0.053 0.014 QPNRT(232/1753): D(0)=0.10606935; D(w)=0.07162636; dbmax=0.053; dbrms=0.014 Timing(sec): search=173.19; Gram matrix=192.18; minimize=20.84; other=5.62 TOPO matrix for the leading resonance structure: Atom 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 ---- --- --- --- --- --- --- --- --- --- --- --- --- --- --- --- --- --- 1. C 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 2. C 2 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 3. H 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4. Br 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 5. C 0 1 0 0 0 2 0 0 0 1 0 0 0 0 0 0 0 6. C 0 0 0 0 2 0 1 0 0 0 0 0 0 0 1 0 0 7. C 0 0 0 0 0 1 0 2 0 0 0 0 0 1 0 0 0 8. C 0 0 0 0 0 0 2 0 1 0 0 0 1 0 0 0 0 9. C 0 0 0 0 0 0 0 1 0 2 0 1 0 0 0 0 0 10. C 0 0 0 0 1 0 0 0 2 0 1 0 0 0 0 0 0 11. H 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 12. H 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 13. H 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 14. H 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 15. H 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 16. C 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 17. C 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 18. C 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 19. C 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 20. C 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 21. C 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 22. H 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 23. H 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 24. H 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 25. H 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 26. H 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 27. H 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Atom 18 19 20 21 22 23 24 25 26 27 ---- --- --- --- --- --- --- --- --- --- --- 1. C 0 0 0 0 0 0 0 0 0 1 2. C 0 0 0 0 0 0 0 0 0 0 3. H 0 0 0 0 0 0 0 0 0 0 4. Br 0 0 0 0 0 0 0 0 0 0 5. C 0 0 0 0 0 0 0 0 0 0 6. C 0 0 0 0 0 0 0 0 0 0 7. C 0 0 0 0 0 0 0 0 0 0 8. C 0 0 0 0 0 0 0 0 0 0 9. C 0 0 0 0 0 0 0 0 0 0 10. C 0 0 0 0 0 0 0 0 0 0 11. H 0 0 0 0 0 0 0 0 0 0 12. H 0 0 0 0 0 0 0 0 0 0 13. H 0 0 0 0 0 0 0 0 0 0 14. H 0 0 0 0 0 0 0 0 0 0 15. H 0 0 0 0 0 0 0 0 0 0 16. C 0 0 0 1 0 0 0 0 0 0 17. C 1 0 0 0 0 0 0 0 1 0 18. C 0 2 0 0 0 0 0 1 0 0 19. C 2 0 1 0 0 0 1 0 0 0 20. C 0 1 0 2 0 1 0 0 0 0 21. C 0 0 2 0 1 0 0 0 0 0 22. H 0 0 0 1 0 0 0 0 0 0 23. H 0 0 1 0 0 0 0 0 0 0 24. H 0 1 0 0 0 0 0 0 0 0 25. H 1 0 0 0 0 0 0 0 0 0 26. H 0 0 0 0 0 0 0 0 0 0 27. H 0 0 0 0 0 0 0 0 0 0 Resonance RS Weight(%) Added(Removed) --------------------------------------------------------------------------- 1 3.25 2 3.20 ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21) 3 3.05 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), (Br 4) 4 3.04 ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10) 5 3.00 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4) 6 2.99 ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21) 7 2.84 ( C 1- C 2), C 1-Br 4, C 2-Br 4, (Br 4) 8 2.83 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21) 9 2.80 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 18- C 19) 10 2.79 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4) 11 2.79 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17) 12 2.78 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21) 13 2.75 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 18- C 19) 14 2.74 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17) 15 1.28 ( C 1- C 2), C 1-Br 4, C 1- C 16, ( C 1- H 27), C 2-Br 4, ( C 16- C 17), (Br 4), C 17 16 1.24 ( C 1- C 2), C 1-Br 4, C 1- C 16, ( C 1- H 27), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), (Br 4), C 17 17 0.96 ( C 1- C 2), C 2-Br 4, ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), ( C 20- C 21), C 1 18 0.91 ( C 1- C 2), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), ( C 20- C 21), C 1 19 0.90 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 19- H 24), ( C 20- C 21), C 21 20 0.85 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 19- H 24), ( C 20- C 21), C 21 21 0.81 ( C 1- C 2), ( C 1- C 2), C 1- C 16, C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 16- C 21), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 21 22 0.79 ( C 1- C 2), ( C 2- H 3), C 2-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), C 1, (Br 4) 23 0.74 ( C 1- C 2), ( C 2- H 3), C 2-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 1, (Br 4) 24 0.70 ( C 1- C 2), ( C 1- C 2), C 1-Br 4, C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 21 25 0.64 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 16, C 17 26 0.63 ( C 1- C 2), C 2-Br 4, ( C 17- C 18), C 1 27 0.63 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), ( C 5- C 6), C 5- C 10, C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 9- C 10), C 2, (Br 4) 28 0.60 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), C 5- C 6, ( C 6- C 7), C 2, (Br 4) 29 0.59 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), C 16- C 17, ( C 17- C 18), C 1, (Br 4) 30 0.58 ( C 1- C 2), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 17- C 18), C 1 31 0.58 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), ( C 5- C 6), C 5- C 10, C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 2, (Br 4) 32 0.56 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 17- H 26), ( C 18- C 19), C 19 33 0.55 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), C 5- C 6, ( C 6- C 7), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 2, (Br 4) 34 0.53 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), ( C 5- C 6), C 5- C 10, C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 9- C 10), (Br 4), C 9 35 0.52 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), ( C 20- C 21), (Br 4), C 20 36 0.52 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), C 5- C 6, ( C 6- C 7), (Br 4), C 7 37 0.52 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, C 17- C 18, ( C 17- H 26), ( C 18- C 19), ( C 18- C 19), C 19 38 0.52 ( C 1- C 2), ( C 2- H 3), C 2-Br 4, C 2-Br 4, C 1, (Br 4) 39 0.51 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 10- H 11), (Br 4), C 6 40 0.51 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 17- H 26), ( C 18- C 19), C 19 41 0.51 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 18- C 19), ( C 21- H 22), C 19 42 0.51 ( C 1- C 2), ( C 2- H 3), C 2-Br 4, C 2-Br 4, C 1, (Br 4) 43 0.50 ( C 1- C 2), ( C 1- C 2), C 1- C 16, C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 16- C 21), C 2 44 0.49 ( C 1- C 2), C 1-Br 4, C 2- C 5, ( C 5- C 10) 45 0.49 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), ( C 5- C 6), C 5- C 10, C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 9 46 0.48 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), ( C 18- C 19), C 19- C 20, C 19- C 20, ( C 20- C 21), ( C 20- H 23), (Br 4), C 18 47 0.48 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), C 18- C 19, ( C 18- H 25), ( C 19- C 20), (Br 4), C 20 48 0.47 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), C 5- C 6, ( C 6- C 7), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 7 49 0.47 ( C 1- C 2), ( C 2- H 3), C 2-Br 4, C 2-Br 4, ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 1, (Br 4) 50 0.47 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, C 17- C 18, ( C 17- H 26), ( C 18- C 19), ( C 18- C 19), C 19 51 0.47 ( C 1- C 2), ( C 1- C 2), C 1- C 16, C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 21), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 21 52 0.46 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 10- H 11), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 6 53 0.46 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 18- C 19), ( C 21- H 22), C 19 54 0.46 ( C 1- C 2), ( C 2- H 3), C 2-Br 4, C 2-Br 4, ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 1, (Br 4) 55 0.44 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 16- C 17), ( C 16- C 21), C 16, C 17 56 0.44 ( C 1- C 2), ( C 1- C 2), C 1- C 16, C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 16- C 21), C 17- C 18, ( C 18- C 19), C 2 57 0.44 ( C 1- C 2), C 1-Br 4, C 2- C 5, ( C 5- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21) 58 0.43 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 9- C 10), ( C 9- H 12), (Br 4), C 7 59 0.43 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 16- C 17), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 16, C 17 60 0.43 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 1, (Br 4), C 16 61 0.43 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), C 2, (Br 4), C 5 62 0.42 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 10- H 11), (Br 4), H 11 63 0.41 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 21), (Br 4), C 16, C 21 64 0.40 ( C 1- C 2), C 1- C 16, C 1- C 16, ( C 1- H 27), C 2-Br 4, ( C 16- C 17), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), H 27 65 0.40 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, C 17- C 18, ( C 17- H 26), ( C 18- C 19), ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), H 26 66 0.39 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 19- C 20), C 20- C 21, ( C 21- H 22), (Br 4), C 19 67 0.39 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 17), ( C 16- C 21), C 16, C 17 68 0.38 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, C 16- C 17, ( C 17- C 18), C 1, (Br 4) 69 0.38 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 9- C 10), ( C 9- H 12), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 7 70 0.38 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 16- C 17), ( C 17- C 18), C 17, C 18 71 0.38 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 2, (Br 4), C 5 72 0.38 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, C 6- C 7, ( C 6- H 15), ( C 7- C 8), ( C 7- C 8), C 8- C 9, ( C 9- C 10), (Br 4), C 8 73 0.38 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 6- C 7, C 6- C 7, ( C 7- C 8), ( C 7- H 14), C 8- C 9, ( C 9- C 10), (Br 4), H 14 74 0.37 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 19- C 20), C 20- C 21, ( C 21- H 22), (Br 4), H 22 75 0.37 ( C 1- C 2), ( C 1- C 2), C 1-Br 4, C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 21 76 0.37 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 10- H 11), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), H 11 77 0.37 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 8- H 13), ( C 9- C 10), ( C 9- C 10), (Br 4), H 13 78 0.36 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 17- C 18), C 18- C 19, ( C 19- H 24), (Br 4), H 24 79 0.36 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 21 80 0.35 ( C 1- C 2), C 1- C 16, C 1- C 16, ( C 1- H 27), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), H 27 81 0.35 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), C 18- C 19, ( C 18- H 25), ( C 19- C 20), (Br 4), H 25 82 0.33 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, C 6- C 7, ( C 6- H 15), ( C 7- C 8), ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 8 83 0.33 ( C 1- C 2), C 1- C 16, C 1- C 16, ( C 1- H 27), C 2-Br 4, ( C 16- C 17), ( C 16- C 17), C 17- C 18, ( C 18- C 19), H 27 84 0.33 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 17), ( C 17- C 18), C 17, C 18 85 0.33 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 6- C 7, C 6- C 7, ( C 7- C 8), ( C 7- H 14), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), H 14 86 0.32 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 9- C 10), ( C 9- H 12), (Br 4), H 12 87 0.32 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 19- H 24), C 17 88 0.32 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 8- H 13), ( C 9- C 10), ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), H 13 89 0.31 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 16- C 17), C 16- C 21, C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), ( C 20- C 21), (Br 4), C 20 90 0.31 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 18- C 19), ( C 18- C 19), C 19- C 20, C 19- C 20, ( C 20- C 21), ( C 20- H 23), C 18 91 0.28 ( C 1- C 2), C 1- C 16, C 1- C 16, ( C 1- H 27), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 17), C 17- C 18, ( C 18- C 19), H 27 92 0.27 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 9- C 10), ( C 9- H 12), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), H 12 93 0.27 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 19- H 24), C 17 94 0.27 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), ( C 18- C 19), C 19- C 20, C 19- C 20, ( C 20- C 21), ( C 20- H 23), (Br 4), C 18 95 0.27 ( C 1- C 2), C 1-Br 4, C 2-Br 4, C 18- C 19, ( C 18- H 25), ( C 19- C 20), (Br 4), C 20 96 0.27 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 17), C 16- C 21, C 17- C 18, C 17- C 18, ( C 18- C 19), ( C 18- H 25), C 19- C 20, ( C 20- C 21), (Br 4), C 16 97 0.26 ( C 1- C 2), C 1-Br 4, C 2-Br 4, C 7- C 8, ( C 7- H 14), ( C 8- C 9), (Br 4), C 9 98 0.25 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 18- C 19), ( C 18- C 19), C 19- C 20, C 19- C 20, ( C 20- C 21), ( C 20- H 23), C 18 99 0.25 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 8- H 13), ( C 9- C 10), ( C 9- C 10), (Br 4), C 10 100 0.25 ( C 1- C 2), ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 1, C 2, (Br 4) 101 0.25 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 7- C 8, ( C 7- H 14), ( C 8- C 9), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 9 102 0.24 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, C 6- C 7, ( C 6- H 15), ( C 7- C 8), ( C 7- C 8), C 8- C 9, ( C 9- C 10), (Br 4), H 15 103 0.24 ( C 2- H 3), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10) 104 0.24 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 5- C 6, ( C 5- C 10), ( C 6- H 15), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 10 105 0.23 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, C 19- C 20, ( C 19- H 24), ( C 20- C 21), ( C 20- C 21), (Br 4), H 24 106 0.23 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 21 107 0.23 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 16- C 21), C 20- C 21, ( C 20- H 23), H 23 108 0.23 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 5- C 6, ( C 5- C 10), ( C 6- H 15), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), H 15 109 0.23 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 6- C 7, C 6- C 7, ( C 7- C 8), ( C 7- H 14), C 8- C 9, ( C 9- C 10), (Br 4), C 5 110 0.23 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 7- C 8, ( C 7- H 14), ( C 8- C 9), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 9 111 0.22 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 8- C 9), C 9- C 10, ( C 10- H 11), (Br 4), C 8 112 0.22 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 6- C 7), C 7- C 8, ( C 8- H 13), (Br 4), H 13 113 0.22 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, C 17- C 18, ( C 17- H 26), ( C 18- C 19), ( C 18- C 19), C 19- C 20, ( C 20- C 21), H 26 114 0.22 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), ( C 18- C 19), C 19- C 20, C 19- C 20, ( C 20- C 21), ( C 20- H 23), (Br 4), H 23 115 0.22 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 16- C 17), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 1, (Br 4), C 16 116 0.22 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 18- C 19, ( C 18- H 25), ( C 19- C 20), C 20 117 0.21 ( C 1- C 2), C 1-Br 4, C 2-Br 4, C 7- C 8, ( C 7- H 14), ( C 8- C 9), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 9 118 0.21 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 5- C 6, ( C 5- C 10), ( C 6- H 15), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 10 119 0.21 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 7- C 8, ( C 7- H 14), ( C 8- C 9), ( C 16- C 17), C 9 120 0.21 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 8- C 9), C 9- C 10, ( C 10- H 11), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 8 121 0.21 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 6- C 7), C 7- C 8, ( C 8- H 13), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), H 13 122 0.21 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 5- C 6, ( C 5- C 10), ( C 6- H 15), ( C 16- C 17), C 17- C 18, ( C 18- C 19), H 15 123 0.21 ( C 1- C 2), ( C 1- C 2), C 1- C 16, C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 16- C 21), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 2 124 0.21 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, C 19- C 20, ( C 19- H 24), ( C 20- C 21), ( C 20- C 21), (Br 4), C 21 125 0.21 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 8- H 13), ( C 9- C 10), ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 10 126 0.20 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 18- C 19), ( C 19- C 20), C 20- C 21, ( C 21- H 22), C 19 127 0.20 ( C 1- C 2), ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 1, C 2, (Br 4) 128 0.20 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 16- C 21), (Br 4), C 16, C 21 129 0.20 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 5- C 6, ( C 5- C 10), ( C 6- H 15), ( C 16- C 17), C 10 130 0.19 ( C 1- C 2), C 1-Br 4, C 2-Br 4, C 5- C 6, ( C 5- C 10), ( C 6- H 15), (Br 4), C 10 131 0.19 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, C 6- C 7, ( C 6- H 15), ( C 7- C 8), ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), H 15 132 0.19 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 5- C 6, ( C 5- C 10), ( C 6- H 15), ( C 16- C 17), H 15 133 0.19 ( C 2- H 3), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21) 134 0.19 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 10), C 9- C 10, ( C 9- H 12), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), H 12 135 0.19 ( C 1- C 2), C 1-Br 4, C 2-Br 4, C 5- C 6, ( C 5- C 10), ( C 6- H 15), (Br 4), H 15 136 0.19 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 21 137 0.19 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 16- C 17), C 16- C 21, C 17- C 18, C 17- C 18, ( C 17- H 26), ( C 18- C 19), ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), H 26 138 0.18 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 8- C 9), C 9- C 10, ( C 10- H 11), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 8 139 0.18 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 6- C 7), C 7- C 8, ( C 8- H 13), ( C 16- C 17), C 17- C 18, ( C 18- C 19), H 13 140 0.18 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 19- C 20), C 20- C 21, ( C 21- H 22), (Br 4), C 19 141 0.18 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 21), C 20- C 21, ( C 20- H 23), H 23 142 0.18 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 6- C 7, C 6- C 7, ( C 7- C 8), ( C 7- H 14), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 5 143 0.18 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 16- C 21), C 17- C 18, ( C 18- C 19), C 20- C 21, ( C 20- H 23), H 23 144 0.17 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 8- C 9), C 9- C 10, ( C 10- H 11), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 8 145 0.17 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 6- C 7), C 7- C 8, ( C 8- H 13), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), H 13 146 0.17 C 1-Br 4, ( C 1- H 27), C 2-Br 4, ( C 2- C 5), ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), (Br 4), C 5 147 0.17 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 8- C 9), C 9- C 10, ( C 10- H 11), ( C 16- C 17), C 8 148 0.17 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 6- C 7), C 7- C 8, ( C 8- H 13), ( C 16- C 17), H 13 149 0.17 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), (Br 4), C 5, C 6 150 0.17 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, C 17- C 18, ( C 17- H 26), ( C 18- C 19), ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 19 151 0.17 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, C 17- C 18, ( C 17- H 26), ( C 18- C 19), ( C 18- C 19), C 19- C 20, ( C 20- C 21), H 26 152 0.17 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 18- C 19, ( C 18- H 25), ( C 19- C 20), C 20 153 0.17 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 10), C 9- C 10, ( C 9- H 12), ( C 16- C 17), C 17- C 18, ( C 18- C 19), H 12 154 0.16 ( C 1- C 2), C 1-Br 4, C 2-Br 4, C 7- C 8, ( C 7- H 14), ( C 8- C 9), (Br 4), H 14 155 0.16 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 19- C 20), C 20- C 21, ( C 21- H 22), (Br 4), H 22 156 0.16 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 9- C 10), ( C 9- H 12), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 7 157 0.16 ( C 1- C 2), ( C 1- C 2), C 1- C 16, C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 21), C 2 158 0.16 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 17), C 16- C 21, C 17- C 18, C 17- C 18, ( C 18- C 19), ( C 18- H 25), C 19- C 20, ( C 20- C 21), (Br 4), H 25 159 0.15 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 16- C 21), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), ( C 20- C 21), C 20, C 21 160 0.15 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), ( C 5- C 10), (Br 4), C 5, C 10 161 0.15 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 7- C 8, ( C 7- H 14), ( C 8- C 9), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), H 14 162 0.15 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 18- C 19), ( C 19- C 20), C 20- C 21, ( C 21- H 22), C 19 163 0.15 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 10), C 9- C 10, ( C 9- H 12), ( C 16- C 17), H 12 164 0.15 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 17- C 18), C 18- C 19, ( C 19- H 24), (Br 4), H 24 165 0.15 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 21 166 0.15 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 10), C 9- C 10, ( C 9- H 12), (Br 4), H 12 167 0.15 ( C 1- C 2), C 1-Br 4, C 2-Br 4, C 5- C 6, ( C 5- C 10), ( C 6- H 15), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 10 168 0.15 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), C 16- C 17, ( C 16- C 21), ( C 17- H 26), (Br 4), H 26 169 0.14 ( C 2- H 3), C 2-Br 4 170 0.14 ( C 1- C 2), C 1-Br 4, C 2-Br 4, C 5- C 6, ( C 5- C 10), ( C 6- H 15), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), H 15 171 0.14 ( C 1- C 2), C 1-Br 4, C 2-Br 4, C 18- C 19, ( C 18- H 25), ( C 19- C 20), (Br 4), H 25 172 0.14 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 19- C 20), C 20- C 21, ( C 21- H 22), C 19 173 0.14 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 9- C 10), ( C 9- H 12), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 7 174 0.13 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 7- C 8, ( C 7- H 14), ( C 8- C 9), ( C 16- C 17), C 17- C 18, ( C 18- C 19), H 14 175 0.13 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 8- C 9), C 9- C 10, ( C 10- H 11), (Br 4), H 11 176 0.12 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), C 17- C 18, ( C 18- C 19), ( C 19- C 20), C 20- C 21, ( C 21- H 22), H 22 177 0.12 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 21), C 17- C 18, ( C 18- C 19), C 20- C 21, ( C 20- H 23), H 23 178 0.12 C 1-Br 4, ( C 1- H 27), C 2-Br 4, ( C 2- C 5), ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 5 179 0.12 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), ( C 7- C 8), C 8- C 9, C 8- C 9, ( C 9- C 10), ( C 9- H 12), ( C 16- C 17), C 7 180 0.12 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), ( C 5- C 6), ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 5, C 6 181 0.12 ( C 1- C 2), C 1-Br 4, C 2-Br 4, C 7- C 8, ( C 7- H 14), ( C 8- C 9), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), H 14 182 0.12 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 8- C 9), C 9- C 10, ( C 10- H 11), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), H 11 183 0.11 ( C 1- C 2), C 1- C 16, C 2-Br 4, C 7- C 8, ( C 7- H 14), ( C 8- C 9), ( C 16- C 17), H 14 184 0.11 ( C 1- C 2), C 1-Br 4, ( C 1- C 16), C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 16- C 21, C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), ( C 20- C 21), C 1, (Br 4) 185 0.11 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 16- C 17), ( C 19- C 20), C 20- C 21, ( C 21- H 22), H 22 186 0.11 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 6- C 7), C 7- C 8, ( C 8- H 13), (Br 4), C 6 187 0.11 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, C 6- C 7, ( C 6- H 15), ( C 7- C 8), ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 8 188 0.11 ( C 1- C 2), C 1-Br 4, C 2-Br 4, ( C 2- C 5), ( C 5- C 10), ( C 16- C 17), C 16- C 21, C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), (Br 4), C 5, C 10 189 0.10 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 21), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), ( C 20- C 21), C 20, C 21 190 0.10 ( C 1- C 2), ( C 1- C 2), C 1- C 16, C 1- C 16, C 2-Br 4, ( C 5- C 6), C 5- C 10, C 6- C 7, ( C 7- C 8), C 8- C 9, ( C 9- C 10), ( C 16- C 17), ( C 16- C 21), C 17- C 18, ( C 18- C 19), C 2 191 0.10 ( C 1- C 2), C 1- C 16, C 2-Br 4, ( C 6- C 7), C 7- C 8, ( C 8- H 13), ( C 16- C 17), C 17- C 18, ( C 18- C 19), C 19- C 20, ( C 20- C 21), C 6 others 2.44 --------------------------------------------------------------------------- 100.00 * Total * Natural Bond Order: (total/covalent/ionic) Atom 1 2 3 4 5 6 7 8 9 ---- ------ ------ ------ ------ ------ ------ ------ ------ ------ 1. C t 0.0878 1.0919 0.0000 0.4209 0.0000 0.0000 0.0000 0.0000 0.0000 c --- 1.0253 0.0000 0.0683 0.0000 0.0000 0.0000 0.0000 0.0000 i --- 0.0666 0.0000 0.3526 0.0000 0.0000 0.0000 0.0000 0.0000 2. C t 1.0919 0.0506 0.9585 0.9008 0.9491 0.0000 0.0000 0.0000 0.0000 c 1.0253 --- 0.6454 0.7729 0.9139 0.0000 0.0000 0.0000 0.0000 i 0.0666 --- 0.3132 0.1279 0.0352 0.0000 0.0000 0.0000 0.0000 3. H t 0.0000 0.9585 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.6454 --- 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.3132 --- 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 4. Br t 0.4209 0.9008 0.0000 2.5443 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0683 0.7729 0.0000 --- 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.3526 0.1279 0.0000 --- 0.0000 0.0000 0.0000 0.0000 0.0000 5. C t 0.0000 0.9491 0.0000 0.0000 0.0235 1.4976 0.0000 0.0000 0.0000 c 0.0000 0.9139 0.0000 0.0000 --- 1.4167 0.0000 0.0000 0.0000 i 0.0000 0.0352 0.0000 0.0000 --- 0.0809 0.0000 0.0000 0.0000 6. C t 0.0000 0.0000 0.0000 0.0000 1.4976 0.0167 1.4937 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 1.4167 --- 1.4585 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0809 --- 0.0352 0.0000 0.0000 7. C t 0.0000 0.0000 0.0000 0.0000 0.0000 1.4937 0.0223 1.4952 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 1.4585 --- 1.4611 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0352 --- 0.0341 0.0000 8. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.4952 0.0192 1.5036 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.4611 --- 1.4689 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0341 --- 0.0347 9. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.5036 0.0218 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.4689 --- i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0347 --- 10. C t 0.0000 0.0000 0.0000 0.0000 1.5016 0.0000 0.0000 0.0000 1.4854 c 0.0000 0.0000 0.0000 0.0000 1.4188 0.0000 0.0000 0.0000 1.4530 i 0.0000 0.0000 0.0000 0.0000 0.0828 0.0000 0.0000 0.0000 0.0324 11. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 12. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.9703 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.7196 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.2507 13. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.9727 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.7226 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.2500 0.0000 14. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.9705 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.7195 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.2510 0.0000 0.0000 15. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.9665 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.7110 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.2555 0.0000 0.0000 0.0000 16. C t 1.4116 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 1.2677 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.1439 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 17. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 18. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 19. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 20. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 21. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 22. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 23. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 24. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 25. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 26. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 27. H t 0.9577 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.6825 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.2752 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 Atom 10 11 12 13 14 15 16 17 18 ---- ------ ------ ------ ------ ------ ------ ------ ------ ------ 1. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.4116 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.2677 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.1439 0.0000 0.0000 2. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 3. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 4. Br t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 5. C t 1.5016 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 1.4188 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0828 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 6. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.9665 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.7110 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.2555 0.0000 0.0000 0.0000 7. C t 0.0000 0.0000 0.0000 0.0000 0.9705 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.7195 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.2510 0.0000 0.0000 0.0000 0.0000 8. C t 0.0000 0.0000 0.0000 0.9727 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.7226 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.2500 0.0000 0.0000 0.0000 0.0000 0.0000 9. C t 1.4854 0.0000 0.9703 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 1.4530 0.0000 0.7196 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0324 0.0000 0.2507 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 10. C t 0.0171 0.9679 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c --- 0.7178 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i --- 0.2502 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 11. H t 0.9679 0.0128 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.7178 --- 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.2502 --- 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 12. H t 0.0000 0.0000 0.0143 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 --- 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 --- 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 13. H t 0.0000 0.0000 0.0000 0.0186 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 --- 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 --- 0.0000 0.0000 0.0000 0.0000 0.0000 14. H t 0.0000 0.0000 0.0000 0.0000 0.0138 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 --- 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 --- 0.0000 0.0000 0.0000 0.0000 15. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0140 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 --- 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 --- 0.0000 0.0000 0.0000 16. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0363 1.2493 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 --- 1.1563 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 --- 0.0930 0.0000 17. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.2493 0.0579 1.5594 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.1563 --- 1.4870 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0930 --- 0.0725 18. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.5594 0.0202 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.4870 --- i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0725 --- 19. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.4179 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.3399 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0780 20. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 21. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.2466 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.1553 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0912 0.0000 0.0000 22. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 23. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 24. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 25. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.9779 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.7061 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.2718 26. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.9666 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.7004 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.2661 0.0000 27. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 Atom 19 20 21 22 23 24 25 26 27 ---- ------ ------ ------ ------ ------ ------ ------ ------ ------ 1. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.9577 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.6825 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.2752 2. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 3. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 4. Br t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 5. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 6. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 7. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 8. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 9. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 10. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 11. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 12. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 13. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 14. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 15. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 16. C t 0.0000 0.0000 1.2466 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 1.1553 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.0912 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 17. C t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.9666 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.7004 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.2661 0.0000 18. C t 1.4179 0.0000 0.0000 0.0000 0.0000 0.0000 0.9779 0.0000 0.0000 c 1.3399 0.0000 0.0000 0.0000 0.0000 0.0000 0.7061 0.0000 0.0000 i 0.0780 0.0000 0.0000 0.0000 0.0000 0.0000 0.2718 0.0000 0.0000 19. C t 0.0436 1.4285 0.0000 0.0000 0.0000 0.9638 0.0000 0.0000 0.0000 c --- 1.3493 0.0000 0.0000 0.0000 0.6988 0.0000 0.0000 0.0000 i --- 0.0793 0.0000 0.0000 0.0000 0.2650 0.0000 0.0000 0.0000 20. C t 1.4285 0.0222 1.5464 0.0000 0.9771 0.0000 0.0000 0.0000 0.0000 c 1.3493 --- 1.4684 0.0000 0.7043 0.0000 0.0000 0.0000 0.0000 i 0.0793 --- 0.0780 0.0000 0.2728 0.0000 0.0000 0.0000 0.0000 21. C t 0.0000 1.5464 0.0634 0.9697 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 1.4684 --- 0.7047 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0780 --- 0.2650 0.0000 0.0000 0.0000 0.0000 0.0000 22. H t 0.0000 0.0000 0.9697 0.0090 0.0000 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.0000 0.7047 --- 0.0000 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.0000 0.2650 --- 0.0000 0.0000 0.0000 0.0000 0.0000 23. H t 0.0000 0.9771 0.0000 0.0000 0.0099 0.0000 0.0000 0.0000 0.0000 c 0.0000 0.7043 0.0000 0.0000 --- 0.0000 0.0000 0.0000 0.0000 i 0.0000 0.2728 0.0000 0.0000 --- 0.0000 0.0000 0.0000 0.0000 24. H t 0.9638 0.0000 0.0000 0.0000 0.0000 0.0098 0.0000 0.0000 0.0000 c 0.6988 0.0000 0.0000 0.0000 0.0000 --- 0.0000 0.0000 0.0000 i 0.2650 0.0000 0.0000 0.0000 0.0000 --- 0.0000 0.0000 0.0000 25. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0076 0.0000 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 --- 0.0000 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 --- 0.0000 0.0000 26. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0111 0.0000 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 --- 0.0000 i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 --- 0.0000 27. H t 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0136 c 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 --- i 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 --- Natural Atomic Valencies and Electron Counts: Co- Electro- Electron Atom Valency Valency Valency Count ---- ------- ------- ------- ------- 1. C 3.8820 3.0438 0.8382 7.9398 2. C 3.9003 3.3575 0.5429 7.9018 3. H 0.9585 0.6454 0.3132 1.9171 4. Br 1.3217 0.8412 0.4804 7.7320 5. C 3.9484 3.7494 0.1990 7.9438 6. C 3.9578 3.5862 0.3716 7.9491 7. C 3.9594 3.6391 0.3202 7.9633 8. C 3.9715 3.6527 0.3188 7.9814 9. C 3.9594 3.6416 0.3178 7.9623 10. C 3.9550 3.5896 0.3654 7.9441 11. H 0.9679 0.7178 0.2502 1.9614 12. H 0.9703 0.7196 0.2507 1.9693 13. H 0.9727 0.7226 0.2500 1.9826 14. H 0.9705 0.7195 0.2510 1.9687 15. H 0.9665 0.7110 0.2555 1.9610 16. C 3.9074 3.5793 0.3281 7.8874 17. C 3.7752 3.3437 0.4316 7.6662 18. C 3.9552 3.5329 0.4223 7.9508 19. C 3.8102 3.3880 0.4223 7.7076 20. C 3.9520 3.5220 0.4300 7.9483 21. C 3.7627 3.3284 0.4343 7.6520 22. H 0.9697 0.7047 0.2650 1.9575 23. H 0.9771 0.7043 0.2728 1.9738 24. H 0.9638 0.6988 0.2650 1.9472 25. H 0.9779 0.7061 0.2718 1.9710 26. H 0.9666 0.7004 0.2661 1.9554 27. H 0.9577 0.6825 0.2752 1.9425 $NRTSTR STR ! Wgt=3.25%; rhoNL=4.02782; D(0)=0.12353 LONE 4 3 END BOND D 1 2 S 1 16 S 1 27 S 2 3 S 2 5 D 5 6 S 5 10 S 6 7 S 6 15 D 7 8 S 7 14 S 8 9 S 8 13 D 9 10 S 9 12 S 10 11 D 16 17 S 16 21 S 17 18 S 17 26 D 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END END STR ! Wgt=3.20%; rhoNL=4.00126; D(0)=0.12313 LONE 4 3 END BOND D 1 2 S 1 16 S 1 27 S 2 3 S 2 5 D 5 6 S 5 10 S 6 7 S 6 15 D 7 8 S 7 14 S 8 9 S 8 13 D 9 10 S 9 12 S 10 11 S 16 17 D 16 21 D 17 18 S 17 26 S 18 19 S 18 25 D 19 20 S 19 24 S 20 21 S 20 23 S 21 22 END END STR ! Wgt=3.05%; rhoNL=3.22230; D(0)=0.11050 LONE 4 2 END BOND S 1 2 S 1 4 S 1 16 S 1 27 S 2 3 S 2 4 S 2 5 S 5 6 D 5 10 D 6 7 S 6 15 S 7 8 S 7 14 D 8 9 S 8 13 S 9 10 S 9 12 S 10 11 D 16 17 S 16 21 S 17 18 S 17 26 D 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END END STR ! Wgt=3.04%; rhoNL=4.00539; D(0)=0.12319 LONE 4 3 END BOND D 1 2 S 1 16 S 1 27 S 2 3 S 2 5 S 5 6 D 5 10 D 6 7 S 6 15 S 7 8 S 7 14 D 8 9 S 8 13 S 9 10 S 9 12 S 10 11 D 16 17 S 16 21 S 17 18 S 17 26 D 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END END STR ! Wgt=3.00%; rhoNL=3.19575; D(0)=0.11004 LONE 4 2 END BOND S 1 2 S 1 4 S 1 16 S 1 27 S 2 3 S 2 4 S 2 5 S 5 6 D 5 10 D 6 7 S 6 15 S 7 8 S 7 14 D 8 9 S 8 13 S 9 10 S 9 12 S 10 11 S 16 17 D 16 21 D 17 18 S 17 26 S 18 19 S 18 25 D 19 20 S 19 24 S 20 21 S 20 23 S 21 22 END END STR ! Wgt=2.99%; rhoNL=3.97884; D(0)=0.12278 LONE 4 3 END BOND D 1 2 S 1 16 S 1 27 S 2 3 S 2 5 S 5 6 D 5 10 D 6 7 S 6 15 S 7 8 S 7 14 D 8 9 S 8 13 S 9 10 S 9 12 S 10 11 S 16 17 D 16 21 D 17 18 S 17 26 S 18 19 S 18 25 D 19 20 S 19 24 S 20 21 S 20 23 S 21 22 END END STR ! Wgt=2.84%; rhoNL=3.24474; D(0)=0.11088 LONE 4 2 END BOND S 1 2 S 1 4 S 1 16 S 1 27 S 2 3 S 2 4 S 2 5 D 5 6 S 5 10 S 6 7 S 6 15 D 7 8 S 7 14 S 8 9 S 8 13 D 9 10 S 9 12 S 10 11 D 16 17 S 16 21 S 17 18 S 17 26 D 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END END STR ! Wgt=2.83%; rhoNL=3.10875; D(0)=0.10853 LONE 4 3 END BOND S 1 2 D 1 16 S 1 27 S 2 3 S 2 4 S 2 5 D 5 6 S 5 10 S 6 7 S 6 15 D 7 8 S 7 14 S 8 9 S 8 13 D 9 10 S 9 12 S 10 11 S 16 17 S 16 21 D 17 18 S 17 26 S 18 19 S 18 25 D 19 20 S 19 24 S 20 21 S 20 23 S 21 22 END END STR ! Wgt=2.80%; rhoNL=2.99162; D(0)=0.10647 LONE 4 3 END BOND S 1 2 D 1 16 S 1 27 S 2 3 S 2 4 S 2 5 D 5 6 S 5 10 S 6 7 S 6 15 D 7 8 S 7 14 S 8 9 S 8 13 D 9 10 S 9 12 S 10 11 S 16 17 S 16 21 D 17 18 S 17 26 S 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END END STR ! Wgt=2.79%; rhoNL=3.21818; D(0)=0.11043 LONE 4 2 END BOND S 1 2 S 1 4 S 1 16 S 1 27 S 2 3 S 2 4 S 2 5 D 5 6 S 5 10 S 6 7 S 6 15 D 7 8 S 7 14 S 8 9 S 8 13 D 9 10 S 9 12 S 10 11 S 16 17 D 16 21 D 17 18 S 17 26 S 18 19 S 18 25 D 19 20 S 19 24 S 20 21 S 20 23 S 21 22 END END STR ! Wgt=2.79%; rhoNL=3.13767; D(0)=0.10904 LONE 4 3 END BOND S 1 2 D 1 16 S 1 27 S 2 3 S 2 4 S 2 5 D 5 6 S 5 10 S 6 7 S 6 15 D 7 8 S 7 14 S 8 9 S 8 13 D 9 10 S 9 12 S 10 11 S 16 17 S 16 21 S 17 18 S 17 26 D 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END END STR ! Wgt=2.78%; rhoNL=3.08632; D(0)=0.10814 LONE 4 3 END BOND S 1 2 D 1 16 S 1 27 S 2 3 S 2 4 S 2 5 S 5 6 D 5 10 D 6 7 S 6 15 S 7 8 S 7 14 D 8 9 S 8 13 S 9 10 S 9 12 S 10 11 S 16 17 S 16 21 D 17 18 S 17 26 S 18 19 S 18 25 D 19 20 S 19 24 S 20 21 S 20 23 S 21 22 END END STR ! Wgt=2.75%; rhoNL=2.96919; D(0)=0.10607 LONE 4 3 END BOND S 1 2 D 1 16 S 1 27 S 2 3 S 2 4 S 2 5 S 5 6 D 5 10 D 6 7 S 6 15 S 7 8 S 7 14 D 8 9 S 8 13 S 9 10 S 9 12 S 10 11 S 16 17 S 16 21 D 17 18 S 17 26 S 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END END STR ! Wgt=2.74%; rhoNL=3.11524; D(0)=0.10865 LONE 4 3 END BOND S 1 2 D 1 16 S 1 27 S 2 3 S 2 4 S 2 5 S 5 6 D 5 10 D 6 7 S 6 15 S 7 8 S 7 14 D 8 9 S 8 13 S 9 10 S 9 12 S 10 11 S 16 17 S 16 21 S 17 18 S 17 26 D 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END END STR ! Wgt=1.28%; rhoNL=4.25919; D(0)=0.12703 LONE 4 2 17 1 END BOND S 1 2 S 1 4 D 1 16 S 2 3 S 2 4 S 2 5 D 5 6 S 5 10 S 6 7 S 6 15 D 7 8 S 7 14 S 8 9 S 8 13 D 9 10 S 9 12 S 10 11 S 16 17 S 16 21 S 17 18 S 17 26 D 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END END STR ! Wgt=1.24%; rhoNL=4.23676; D(0)=0.12670 LONE 4 2 17 1 END BOND S 1 2 S 1 4 D 1 16 S 2 3 S 2 4 S 2 5 S 5 6 D 5 10 D 6 7 S 6 15 S 7 8 S 7 14 D 8 9 S 8 13 S 9 10 S 9 12 S 10 11 S 16 17 S 16 21 S 17 18 S 17 26 D 18 19 S 18 25 S 19 20 S 19 24 D 20 21 S 20 23 S 21 22 END END $END NBO analysis completed in 394.73 CPU seconds (397 wall seconds) Maximum scratch memory used by NBO was 65175127 words (497.25 MB) Maximum scratch memory used by G16NBO was 115014 words (0.88 MB) Opening RunExU unformatted file "/scratch/webmo-13362/515500/Gau-19700.EUF" Read unf file /scratch/webmo-13362/515500/Gau-19700.EUF: Label Gaussian matrix elements IVers= 2 NLab= 2 Version=ES64L-G16RevC.01 Title C14H12Br(+1) cis-stilbene bromonium cation (H2O solvent, C1) NAtoms= 27 NBasis= 264 NBsUse= 264 ICharg= 1 Multip= 1 NE= 130 Len12L=8 Len4L=8 IOpCl= 0 ICGU=111 GAUSSIAN SCALARS NI= 1 NR= 1 NTot= 1 LenBuf= 2 NRI=1 N= 1000 NPA CHARGES NI= 0 NR= 1 NTot= 27 LenBuf= 4000 NRI=1 N= 27 Recovered energy= -3112.21370533 dipole= 2.866408502791 -0.923764594564 0.826567212022 Unable to Open any file for archive entry. 1\1\GINC-COMPUTE-0-6\SP\RB3LYP\6-31G(d)\C14H12Br1(1+)\BESSELMAN\11-Sep -2020\0\\#N B3LYP/6-31G(d) SP GFINPUT POP=(FULL,NBO6Read) SCRF=(PCM,So lvent=Water) Geom=Connectivity\\C14H12Br(+1) cis-stilbene bromonium ca tion (H2O solvent, C1)\\1,1\C\C,1,1.485073259\H,2,1.091751677,1,107.89 39749\Br,1,2.636238923,2,50.11045924,3,-104.9370534,0\C,2,1.502108945, 1,123.815266,4,123.2444672,0\C,5,1.402134587,2,123.6666161,1,-82.29883 642,0\C,6,1.394020107,5,120.0687239,2,178.5049293,0\C,7,1.397973794,6, 120.2657325,5,0.2384107,0\C,8,1.39585926,7,119.8630712,6,0.45382784,0\ C,5,1.402849633,2,116.845583,1,97.48148502,0\H,10,1.086602174,5,119.97 76537,2,1.32813754,0\H,9,1.085783682,10,119.6134009,5,179.701827,0\H,8 ,1.08598974,9,120.0956934,10,-179.4169755,0\H,7,1.085821282,8,120.1891 333,9,-179.1491782,0\H,6,1.085195321,5,119.8337254,2,-2.15623188,0\C,1 ,1.395297148,2,133.0420931,3,143.2158618,0\C,16,1.433449452,1,125.3837 865,2,-3.73485615,0\C,17,1.378977365,16,119.7906674,1,-178.8985573,0\C ,18,1.40694257,17,120.1413064,16,0.09928799,0\C,19,1.403689467,18,121. 391947,17,0.17409551,0\C,20,1.379528973,19,119.2485764,18,-0.09044784, 0\H,21,1.085229789,20,120.4241465,19,-179.963642,0\H,20,1.084149623,19 ,120.2329541,18,179.8078938,0\H,19,1.08586223,18,119.2419189,17,179.83 61136,0\H,18,1.084307461,17,120.0606891,16,179.7457919,0\H,17,1.080432 437,16,120.1184353,1,0.49615299,0\H,1,1.08737482,2,111.7618186,3,-36.2 202144,0\\Version=ES64L-G16RevC.01\State=1-A\HF=-3112.2137053\RMSD=3.7 52e-09\Dipole=0.311212,-1.2337003,-2.8520138\Quadrupole=-4.6539251,-8. 8337887,13.4877137,5.4235477,0.7800021,-0.3448941\PG=C01 [X(C14H12Br1) ]\\@ The archive entry for this job was punched. It takes a long time to grow an old friend. -- John Leonard Job cpu time: 0 days 1 hours 25 minutes 17.9 seconds. Elapsed time: 0 days 0 hours 7 minutes 41.2 seconds. File lengths (MBytes): RWF= 123 Int= 0 D2E= 0 Chk= 5 Scr= 1 Normal termination of Gaussian 16 at Fri Sep 11 06:21:04 2020.