WebMO Job Summary

271779: C26H28O2N2 model Ugi product (MeOH) conformer 1, Natural Bond Orbitals - Gaussian

Calculated Quantities

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Overview

Quantity Value
Route #N B3LYP/6-311+G(2d,p) SP GFINPUT POP=(FULL,NBORead) SCRF=(PCM,Solvent=Methanol)
Method B3LYP
Stoichiometry C26H28N2O2
Symmetry C1
Basis 6-311+G(2d,p)
RB3LYP Energy -1268.0013958 Hartree
Dipole Moment 5.5556 Debye
Server class (272723)
CPU time 13163.9 sec

Rotational Constants

Constant Frequency (GHz) Frequency (cm-1)
a 0.1738885 0.00580029602
b 0.1149027 0.00383274152
c 0.1052413 0.00351047190

Partial Charges

Atom Symbol Charge
1 C 0.301736  
2 C -0.438255  
3 H 0.125994  
4 H 0.131866  
5 H 0.143311  
6 C -0.438183  
7 H 0.128474  
8 H 0.145818  
9 H 0.131436  
10 C -0.534979  
11 H 0.140001  
12 H 0.140821  
13 H 0.139677  
14 N -0.196830  
15 C 0.231131  
16 C -0.077053  
17 C 0.394350  
18 C -0.215184  
19 C -0.221847  
20 C -0.086104  
21 C -0.295930  
22 C -0.311030  
23 H 0.144562  
24 H 0.107419  
25 H 0.108170  
26 H 0.108256  
27 H 0.112075  
28 N 0.449259  
29 C -0.518442  
30 C 0.644934  
31 C -0.319327  
32 C -0.307811  
33 C -0.093083  
34 C -0.119558  
35 C -0.167410  
36 H 0.105504  
37 H 0.105374  
38 H 0.104902  
39 H 0.105206  
40 H 0.162237  
41 H 0.201391  
42 H 0.166133  
43 C -0.233139  
44 C 0.565209  
45 C -0.262744  
46 C -0.176359  
47 C -0.080993  
48 C -0.184867  
49 C -0.095727  
50 H 0.119988  
51 H 0.109400  
52 H 0.110042  
53 H 0.108965  
54 H 0.131443  
55 O -0.462933  
56 H 0.133580  
57 O -0.517179  
58 H 0.296302  

Molecular Orbitals

Orbital Symmetry Occupancy Spin Energy () Actions
1 - 2 - -19.10358
2 - 2 - -19.09407
3 - 2 - -14.36173
4 - 2 - -14.34025
5 - 2 - -10.28785
6 - 2 - -10.28294
7 - 2 - -10.2354
8 - 2 - -10.22623
9 - 2 - -10.22118
10 - 2 - -10.19745
11 - 2 - -10.1958
12 - 2 - -10.19148
13 - 2 - -10.18752
14 - 2 - -10.18676
15 - 2 - -10.18471
16 - 2 - -10.18446
17 - 2 - -10.18397
18 - 2 - -10.18369
19 - 2 - -10.18272
20 - 2 - -10.18237
21 - 2 - -10.18186
22 - 2 - -10.18136
23 - 2 - -10.17963
24 - 2 - -10.17882
25 - 2 - -10.17866
26 - 2 - -10.17719
27 - 2 - -10.17548
28 - 2 - -10.16423
29 - 2 - -10.15671
30 - 2 - -10.15606
31 - 2 - -1.05917
32 - 2 - -1.04286
33 - 2 - -0.95643
34 - 2 - -0.93577
35 - 2 - -0.87481
36 - 2 - -0.87129
37 - 2 - -0.86631
38 - 2 - -0.81223
39 - 2 - -0.78866
40 - 2 - -0.78096
41 - 2 - -0.76753
42 - 2 - -0.76136
43 - 2 - -0.75854
44 - 2 - -0.75432
45 - 2 - -0.72106
46 - 2 - -0.70246
47 - 2 - -0.69765
48 - 2 - -0.69147
49 - 2 - -0.64383
50 - 2 - -0.62488
51 - 2 - -0.62135
52 - 2 - -0.61738
53 - 2 - -0.61531
54 - 2 - -0.60417
55 - 2 - -0.60056
56 - 2 - -0.56746
57 - 2 - -0.56274
58 - 2 - -0.54411
59 - 2 - -0.53825
60 - 2 - -0.5236
61 - 2 - -0.50711
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63 - 2 - -0.48615
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65 - 2 - -0.47399
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716 - 0 - 3.07347
717 - 0 - 3.07846
718 - 0 - 3.09095
719 - 0 - 3.10392
720 - 0 - 3.11193
721 - 0 - 3.1129
722 - 0 - 3.11811
723 - 0 - 3.12804
724 - 0 - 3.13292
725 - 0 - 3.13462
726 - 0 - 3.1425
727 - 0 - 3.15635
728 - 0 - 3.16268
729 - 0 - 3.16897
730 - 0 - 3.17536
731 - 0 - 3.18855
732 - 0 - 3.19132
733 - 0 - 3.20063
734 - 0 - 3.21009
735 - 0 - 3.21552
736 - 0 - 3.21798
737 - 0 - 3.22738
738 - 0 - 3.233
739 - 0 - 3.23377
740 - 0 - 3.24129
741 - 0 - 3.246
742 - 0 - 3.24956
743 - 0 - 3.26091
744 - 0 - 3.27102
745 - 0 - 3.27423
746 - 0 - 3.28843
747 - 0 - 3.29405
748 - 0 - 3.29836
749 - 0 - 3.30018
750 - 0 - 3.30495
751 - 0 - 3.31468
752 - 0 - 3.3176
753 - 0 - 3.31833
754 - 0 - 3.32188
755 - 0 - 3.33075
756 - 0 - 3.33497
757 - 0 - 3.33999
758 - 0 - 3.34428
759 - 0 - 3.35196
760 - 0 - 3.35404
761 - 0 - 3.36242
762 - 0 - 3.36999
763 - 0 - 3.37153
764 - 0 - 3.37736
765 - 0 - 3.39103
766 - 0 - 3.40491
767 - 0 - 3.41472
768 - 0 - 3.4201
769 - 0 - 3.42373
770 - 0 - 3.43103
771 - 0 - 3.43872
772 - 0 - 3.44275
773 - 0 - 3.45178
774 - 0 - 3.46014
775 - 0 - 3.46314
776 - 0 - 3.46625
777 - 0 - 3.47708
778 - 0 - 3.48025
779 - 0 - 3.48798
780 - 0 - 3.49719
781 - 0 - 3.50057
782 - 0 - 3.51053
783 - 0 - 3.51918
784 - 0 - 3.52465
785 - 0 - 3.53115
786 - 0 - 3.54372
787 - 0 - 3.54434
788 - 0 - 3.54525
789 - 0 - 3.55632
790 - 0 - 3.56282
791 - 0 - 3.56608
792 - 0 - 3.57314
793 - 0 - 3.57915
794 - 0 - 3.58104
795 - 0 - 3.58236
796 - 0 - 3.5875
797 - 0 - 3.59104
798 - 0 - 3.59719
799 - 0 - 3.59827
800 - 0 - 3.60003
801 - 0 - 3.60231
802 - 0 - 3.61289
803 - 0 - 3.61657
804 - 0 - 3.6216
805 - 0 - 3.62514
806 - 0 - 3.63009
807 - 0 - 3.63211
808 - 0 - 3.64168
809 - 0 - 3.64635
810 - 0 - 3.65151
811 - 0 - 3.65508
812 - 0 - 3.65936
813 - 0 - 3.66208
814 - 0 - 3.6701
815 - 0 - 3.67717
816 - 0 - 3.68077
817 - 0 - 3.68748
818 - 0 - 3.69375
819 - 0 - 3.7048
820 - 0 - 3.70586
821 - 0 - 3.71319
822 - 0 - 3.71486
823 - 0 - 3.72719
824 - 0 - 3.73394
825 - 0 - 3.74351
826 - 0 - 3.74477
827 - 0 - 3.75159
828 - 0 - 3.75616
829 - 0 - 3.76303
830 - 0 - 3.76612
831 - 0 - 3.76932
832 - 0 - 3.77275
833 - 0 - 3.77704
834 - 0 - 3.77971
835 - 0 - 3.79071
836 - 0 - 3.79892
837 - 0 - 3.80439
838 - 0 - 3.80923
839 - 0 - 3.81668
840 - 0 - 3.83249
841 - 0 - 3.83618
842 - 0 - 3.85631
843 - 0 - 3.85705
844 - 0 - 3.86361
845 - 0 - 3.86996
846 - 0 - 3.87385
847 - 0 - 3.88545
848 - 0 - 3.89098
849 - 0 - 3.8942
850 - 0 - 3.90348
851 - 0 - 3.91226
852 - 0 - 3.91992
853 - 0 - 3.9286
854 - 0 - 3.93393
855 - 0 - 3.93459
856 - 0 - 3.94159
857 - 0 - 3.94583
858 - 0 - 3.95547
859 - 0 - 3.95853
860 - 0 - 3.9632
861 - 0 - 3.96974
862 - 0 - 3.97404
863 - 0 - 3.98457
864 - 0 - 3.98794
865 - 0 - 3.99323
866 - 0 - 4.00212
867 - 0 - 4.00997
868 - 0 - 4.02819
869 - 0 - 4.05315
870 - 0 - 4.05626
871 - 0 - 4.08724
872 - 0 - 4.09546
873 - 0 - 4.097
874 - 0 - 4.114
875 - 0 - 4.11709
876 - 0 - 4.13781
877 - 0 - 4.1512
878 - 0 - 4.15486
879 - 0 - 4.18488
880 - 0 - 4.22752
881 - 0 - 4.23051
882 - 0 - 4.23436
883 - 0 - 4.24138
884 - 0 - 4.25115
885 - 0 - 4.2577
886 - 0 - 4.2929
887 - 0 - 4.29832
888 - 0 - 4.30895
889 - 0 - 4.3333
890 - 0 - 4.34307
891 - 0 - 4.38585
892 - 0 - 4.41045
893 - 0 - 4.50343
894 - 0 - 4.52803
895 - 0 - 4.53199
896 - 0 - 4.53735
897 - 0 - 4.54142
898 - 0 - 4.55297
899 - 0 - 4.57486
900 - 0 - 4.60231
901 - 0 - 4.64591
902 - 0 - 4.66208
903 - 0 - 4.6702
904 - 0 - 4.82926
905 - 0 - 4.83723
906 - 0 - 4.8457
907 - 0 - 4.85563
908 - 0 - 4.8696
909 - 0 - 4.89186
910 - 0 - 5.02671
911 - 0 - 5.06961
912 - 0 - 5.12035
913 - 0 - 5.15224
914 - 0 - 5.16663
915 - 0 - 5.18536
916 - 0 - 5.19357
917 - 0 - 5.22181
918 - 0 - 5.26821
919 - 0 - 5.27666
920 - 0 - 5.28718
921 - 0 - 5.2931
922 - 0 - 5.30651
923 - 0 - 5.32284
924 - 0 - 5.36533
925 - 0 - 5.51336
926 - 0 - 5.5172
927 - 0 - 5.56163
928 - 0 - 5.64223
929 - 0 - 5.74827
930 - 0 - 5.91232
931 - 0 - 6.12502
932 - 0 - 6.18851
933 - 0 - 6.90287
934 - 0 - 6.92703
935 - 0 - 6.95801
936 - 0 - 6.97164
937 - 0 - 7.08709
938 - 0 - 7.12433
939 - 0 - 7.31852
940 - 0 - 7.33155
941 - 0 - 7.34459
942 - 0 - 7.35504
943 - 0 - 23.68386
944 - 0 - 23.70797
945 - 0 - 23.73176
946 - 0 - 23.82637
947 - 0 - 23.93242
948 - 0 - 23.97384
949 - 0 - 23.98517
950 - 0 - 24.00218
951 - 0 - 24.00633
952 - 0 - 24.0078
953 - 0 - 24.04904
954 - 0 - 24.05367
955 - 0 - 24.06025
956 - 0 - 24.06317
957 - 0 - 24.06775
958 - 0 - 24.08492
959 - 0 - 24.10914
960 - 0 - 24.11659
961 - 0 - 24.12
962 - 0 - 24.12071
963 - 0 - 24.12587
964 - 0 - 24.12645
965 - 0 - 24.17127
966 - 0 - 24.22941
967 - 0 - 24.25938
968 - 0 - 24.29572
969 - 0 - 35.66255
970 - 0 - 35.7221
971 - 0 - 50.10206
972 - 0 - 50.11547
Electron density
Electrostatic potential
Electrophilic (HOMO) frontier density
Nucleophilic (LUMO) frontier density
Radical frontier density

Natural Population Analysis

Atom Symbol Charge
1 C 0.11866  
2 C -0.57990  
3 H 0.20301  
4 H 0.20501  
5 H 0.21770  
6 C -0.57984  
7 H 0.20390  
8 H 0.21743  
9 H 0.20430  
10 C -0.57928  
11 H 0.20685  
12 H 0.21522  
13 H 0.20701  
14 N -0.63758  
15 C 0.72430  
16 C -0.09556  
17 C -0.07909  
18 C -0.19799  
19 C -0.20060  
20 C -0.20266  
21 C -0.19863  
22 C -0.20464  
23 H 0.22871  
24 H 0.21500  
25 H 0.21514  
26 H 0.21627  
27 H 0.21508  
28 N -0.48426  
29 C -0.18806  
30 C -0.05280  
31 C -0.23047  
32 C -0.19819  
33 C -0.21503  
34 C -0.20007  
35 C -0.20545  
36 H 0.21286  
37 H 0.21359  
38 H 0.21316  
39 H 0.21276  
40 H 0.23265  
41 H 0.23700  
42 H 0.21634  
43 C 0.70646  
44 C -0.13257  
45 C -0.19260  
46 C -0.20102  
47 C -0.19609  
48 C -0.20272  
49 C -0.17609  
50 H 0.22135  
51 H 0.21686  
52 H 0.21597  
53 H 0.21718  
54 H 0.22090  
55 O -0.67608  
56 H 0.24124  
57 O -0.69823  
58 H 0.41359  

Natural Atomic Orbitals

Orbital Description Occupancy Spin Energy () Actions
1 C1 Cor(1S) 1.999236116 - -10.094057994
2 C1 Val(2S) 0.907032726 - -0.209780622
3 C1 Ryd(3S) 0.001479800 - 0.797777032
4 C1 Ryd(4S) 0.000561741 - 1.142744552
5 C1 Ryd(5S) 0.000008168 - 23.382805327
6 C1 Val(2p) 0.956213489 - -0.089168033
7 C1 Ryd(3p) 0.004978745 - 0.833920446
8 C1 Ryd(4p) 0.000209278 - 1.955628666
9 C1 Ryd(5p) 0.000044776 - 2.153618767
10 C1 Val(2p) 1.057721156 - -0.104200580
11 C1 Ryd(3p) 0.002547696 - 0.801956993
12 C1 Ryd(5p) 0.000282831 - 1.993257760
13 C1 Ryd(4p) 0.000066307 - 1.957807276
14 C1 Val(2p) 0.941122110 - -0.086623845
15 C1 Ryd(3p) 0.003591645 - 0.760477288
16 C1 Ryd(4p) 0.000203277 - 1.927735002
17 C1 Ryd(5p) 0.000049428 - 2.139455498
18 C1 Ryd(4d) 0.000552019 - 2.529697484
19 C1 Ryd(3d) 0.000357243 - 2.340248263
20 C1 Ryd(3d) 0.001390197 - 2.632929482
21 C1 Ryd(4d) 0.000133970 - 2.676656504
22 C1 Ryd(3d) 0.001293615 - 2.536551171
23 C1 Ryd(4d) 0.000087018 - 2.702654482
24 C1 Ryd(3d) 0.001041342 - 2.542603329
25 C1 Ryd(4d) 0.000175275 - 2.662581666
26 C1 Ryd(4d) 0.000294304 - 2.604246388
27 C1 Ryd(3d) 0.000664598 - 2.413572227
28 C2 Cor(1S) 1.999258842 - -10.009570316
29 C2 Val(2S) 1.078027979 - -0.238117162
30 C2 Ryd(4S) 0.000528237 - 1.076263352
31 C2 Ryd(3S) 0.000054749 - 0.639306273
32 C2 Ryd(5S) 0.000002572 - 23.427555104
33 C2 Val(2p) 1.218072027 - -0.086610477
34 C2 Ryd(4p) 0.001984655 - 0.638176433
35 C2 Ryd(3p) 0.000072678 - 0.355749855
36 C2 Ryd(5p) 0.000024086 - 3.294294873
37 C2 Val(2p) 1.118015617 - -0.085800401
38 C2 Ryd(4p) 0.001904166 - 0.571691496
39 C2 Ryd(3p) 0.000240908 - 0.286971830
40 C2 Ryd(5p) 0.000043847 - 3.256166727
41 C2 Val(2p) 1.153391274 - -0.086371885
42 C2 Ryd(4p) 0.001992890 - 0.606180827
43 C2 Ryd(3p) 0.000213827 - 0.285813680
44 C2 Ryd(5p) 0.000048476 - 3.250699546
45 C2 Ryd(3d) 0.000606450 - 1.521474789
46 C2 Ryd(4d) 0.000086644 - 3.091235507
47 C2 Ryd(3d) 0.001528675 - 1.659729560
48 C2 Ryd(4d) 0.000061709 - 3.312234638
49 C2 Ryd(3d) 0.001758369 - 1.715176391
50 C2 Ryd(4d) 0.000032345 - 3.334104320
51 C2 Ryd(3d) 0.001456091 - 1.653068580
52 C2 Ryd(4d) 0.000053251 - 3.282185377
53 C2 Ryd(3d) 0.000323468 - 1.505432126
54 C2 Ryd(4d) 0.000113476 - 3.065720285
55 H3 Val(1S) 0.795748603 - 0.044411930
56 H3 Ryd(2S) 0.000581265 - 1.189026810
57 H3 Ryd(3S) 0.000207644 - 1.750520169
58 H3 Ryd(2p) 0.000129083 - 2.086615867
59 H3 Ryd(2p) 0.000204860 - 2.713937068
60 H3 Ryd(2p) 0.000116929 - 2.277142960
61 H4 Val(1S) 0.793858915 - 0.041625044
62 H4 Ryd(2S) 0.000462401 - 0.769705011
63 H4 Ryd(3S) 0.000203200 - 2.046158033
64 H4 Ryd(2p) 0.000144032 - 2.398206619
65 H4 Ryd(2p) 0.000122816 - 2.139015676
66 H4 Ryd(2p) 0.000198394 - 2.533808446
67 H5 Val(1S) 0.780759363 - 0.058487501
68 H5 Ryd(2S) 0.000904923 - 1.235612390
69 H5 Ryd(3S) 0.000172870 - 1.710595698
70 H5 Ryd(2p) 0.000208724 - 2.679291453
71 H5 Ryd(2p) 0.000127210 - 2.155833407
72 H5 Ryd(2p) 0.000131820 - 2.260149954
73 C6 Cor(1S) 1.999258669 - -10.008952308
74 C6 Val(2S) 1.078217567 - -0.237588973
75 C6 Ryd(4S) 0.000556228 - 1.081034477
76 C6 Ryd(3S) 0.000052966 - 0.663542422
77 C6 Ryd(5S) 0.000002408 - 23.421582780
78 C6 Val(2p) 1.209222945 - -0.085703589
79 C6 Ryd(4p) 0.001892724 - 0.642835929
80 C6 Ryd(3p) 0.000067674 - 0.385404430
81 C6 Ryd(5p) 0.000025500 - 3.298607122
82 C6 Val(2p) 1.102833514 - -0.084879202
83 C6 Ryd(4p) 0.001881698 - 0.564181105
84 C6 Ryd(3p) 0.000279896 - 0.261386790
85 C6 Ryd(5p) 0.000049166 - 3.241955721
86 C6 Val(2p) 1.177095462 - -0.085718680
87 C6 Ryd(4p) 0.002191809 - 0.625381285
88 C6 Ryd(3p) 0.000162536 - 0.308236862
89 C6 Ryd(5p) 0.000047930 - 3.277038312
90 C6 Ryd(3d) 0.000511453 - 1.518188143
91 C6 Ryd(4d) 0.000076909 - 3.081023852
92 C6 Ryd(3d) 0.001566183 - 1.666199515
93 C6 Ryd(4d) 0.000062362 - 3.306174399
94 C6 Ryd(3d) 0.001638504 - 1.707492241
95 C6 Ryd(4d) 0.000053226 - 3.338806833
96 C6 Ryd(3d) 0.001517692 - 1.680357818
97 C6 Ryd(4d) 0.000070895 - 3.308126292
98 C6 Ryd(3d) 0.000412508 - 1.498678309
99 C6 Ryd(4d) 0.000088281 - 3.046156473
100 H7 Val(1S) 0.794883681 - 0.045958255
101 H7 Ryd(2S) 0.000560808 - 1.176447400
102 H7 Ryd(3S) 0.000201737 - 1.775491396
103 H7 Ryd(2p) 0.000119942 - 2.026160679
104 H7 Ryd(2p) 0.000201995 - 2.673546724
105 H7 Ryd(2p) 0.000130639 - 2.381505128
106 H8 Val(1S) 0.780993233 - 0.058888889
107 H8 Ryd(2S) 0.000905515 - 1.302057670
108 H8 Ryd(3S) 0.000197761 - 1.652881609
109 H8 Ryd(2p) 0.000210821 - 2.722434250
110 H8 Ryd(2p) 0.000126514 - 2.161350622
111 H8 Ryd(2p) 0.000131197 - 2.229939671
112 H9 Val(1S) 0.794579716 - 0.041701313
113 H9 Ryd(2S) 0.000456812 - 0.782412632
114 H9 Ryd(3S) 0.000200907 - 2.038952053
115 H9 Ryd(2p) 0.000134968 - 2.387328809
116 H9 Ryd(2p) 0.000146944 - 2.184607473
117 H9 Ryd(2p) 0.000183283 - 2.506779405
118 C10 Cor(1S) 1.999270158 - -10.016944273
119 C10 Val(2S) 1.077486116 - -0.246045159
120 C10 Ryd(4S) 0.000380196 - 1.117868912
121 C10 Ryd(3S) 0.000053399 - 0.655167927
122 C10 Ryd(5S) 0.000002771 - 23.365847194
123 C10 Val(2p) 1.092419914 - -0.093436467
124 C10 Ryd(4p) 0.001632660 - 0.562500413
125 C10 Ryd(3p) 0.000287406 - 0.237618368
126 C10 Ryd(5p) 0.000055640 - 3.274491258
127 C10 Val(2p) 1.208401048 - -0.093092021
128 C10 Ryd(4p) 0.002657320 - 0.623288045
129 C10 Ryd(3p) 0.000105322 - 0.272431275
130 C10 Ryd(5p) 0.000021266 - 3.315368656
131 C10 Val(2p) 1.188257289 - -0.095282530
132 C10 Ryd(4p) 0.002192133 - 0.609008233
133 C10 Ryd(3p) 0.000072557 - 0.341062605
134 C10 Ryd(5p) 0.000021254 - 3.314396600
135 C10 Ryd(3d) 0.000511086 - 1.516950127
136 C10 Ryd(4d) 0.000130942 - 3.079536085
137 C10 Ryd(3d) 0.001314128 - 1.688457882
138 C10 Ryd(4d) 0.000059805 - 3.313346493
139 C10 Ryd(3d) 0.001748166 - 1.655513239
140 C10 Ryd(4d) 0.000042383 - 3.299977194
141 C10 Ryd(3d) 0.001561580 - 1.668638275
142 C10 Ryd(4d) 0.000054488 - 3.295588165
143 C10 Ryd(3d) 0.000473701 - 1.484098248
144 C10 Ryd(4d) 0.000064016 - 3.024498322
145 H11 Val(1S) 0.791941163 - 0.040089592
146 H11 Ryd(2S) 0.000592873 - 1.049946773
147 H11 Ryd(3S) 0.000189957 - 1.865328967
148 H11 Ryd(2p) 0.000098005 - 2.157917749
149 H11 Ryd(2p) 0.000166900 - 2.501519301
150 H11 Ryd(2p) 0.000161014 - 2.386988165
151 H12 Val(1S) 0.783736011 - 0.042227322
152 H12 Ryd(2S) 0.000363395 - 0.847718172
153 H12 Ryd(3S) 0.000194856 - 1.966175156
154 H12 Ryd(2p) 0.000216739 - 2.587093653
155 H12 Ryd(2p) 0.000117122 - 2.048614276
156 H12 Ryd(2p) 0.000149282 - 2.438822582
157 H13 Val(1S) 0.791782585 - 0.040543037
158 H13 Ryd(2S) 0.000576905 - 1.152739306
159 H13 Ryd(3S) 0.000206613 - 1.768969339
160 H13 Ryd(2p) 0.000115872 - 2.243351508
161 H13 Ryd(2p) 0.000165621 - 2.564029389
162 H13 Ryd(2p) 0.000146479 - 2.245975650
163 N14 Cor(1S) 1.999220290 - -14.161577086
164 N14 Val(2S) 1.253674181 - -0.532576545
165 N14 Ryd(4S) 0.000997729 - 1.670198080
166 N14 Ryd(3S) 0.000651366 - 1.526396235
167 N14 Ryd(5S) 0.000001659 - 34.938559676
168 N14 Val(2p) 1.336864010 - -0.248753450
169 N14 Ryd(4p) 0.002605482 - 1.372849603
170 N14 Ryd(3p) 0.000948469 - 1.167254095
171 N14 Ryd(5p) 0.000066575 - 4.325551932
172 N14 Val(2p) 1.645876251 - -0.252543311
173 N14 Ryd(3p) 0.007005111 - 0.660204358
174 N14 Ryd(4p) 0.000782991 - 0.830623226
175 N14 Ryd(5p) 0.000015752 - 4.019644585
176 N14 Val(2p) 1.377418541 - -0.239792784
177 N14 Ryd(3p) 0.003127099 - 1.185577275
178 N14 Ryd(4p) 0.000726125 - 1.228687297
179 N14 Ryd(5p) 0.000024723 - 4.296927129
180 N14 Ryd(3d) 0.000957350 - 1.565852093
181 N14 Ryd(4d) 0.000089164 - 4.991880850
182 N14 Ryd(3d) 0.001007263 - 1.855548892
183 N14 Ryd(4d) 0.000198304 - 5.169487317
184 N14 Ryd(3d) 0.000574467 - 1.429559973
185 N14 Ryd(4d) 0.000055956 - 4.906991207
186 N14 Ryd(3d) 0.002223611 - 1.870779900
187 N14 Ryd(4d) 0.000065771 - 5.077405286
188 N14 Ryd(3d) 0.002289556 - 1.842824526
189 N14 Ryd(4d) 0.000114854 - 5.117347431
190 C15 Cor(1S) 1.999273741 - -10.155985543
191 C15 Val(2S) 0.762312420 - -0.119583888
192 C15 Ryd(3S) 0.004544709 - 1.098601269
193 C15 Ryd(5S) 0.000043006 - 17.769199579
194 C15 Ryd(4S) 0.000009701 - 4.158163525
195 C15 Val(2p) 0.834556693 - -0.013946200
196 C15 Ryd(4p) 0.009079792 - 1.309180136
197 C15 Ryd(5p) 0.000163498 - 2.847428990
198 C15 Ryd(3p) 0.000039894 - 0.874479332
199 C15 Val(2p) 0.784537675 - -0.110063774
200 C15 Ryd(4p) 0.002145429 - 0.877682666
201 C15 Ryd(5p) 0.000114442 - 2.736154482
202 C15 Ryd(3p) 0.000145179 - 0.876913138
203 C15 Val(2p) 0.856778659 - -0.034000242
204 C15 Ryd(4p) 0.014822947 - 1.269867034
205 C15 Ryd(5p) 0.000176802 - 2.790987931
206 C15 Ryd(3p) 0.000074677 - 0.636413768
207 C15 Ryd(4d) 0.001221776 - 2.896714710
208 C15 Ryd(3d) 0.000141092 - 2.188121699
209 C15 Ryd(4d) 0.001053411 - 3.148934294
210 C15 Ryd(3d) 0.000553681 - 3.144994958
211 C15 Ryd(4d) 0.000905299 - 2.919509297
212 C15 Ryd(3d) 0.000122839 - 2.085948092
213 C15 Ryd(4d) 0.000843093 - 3.029823673
214 C15 Ryd(3d) 0.000266388 - 2.666084923
215 C15 Ryd(4d) 0.001571782 - 3.139155695
216 C15 Ryd(3d) 0.000203093 - 2.848498505
217 C16 Cor(1S) 1.998992407 - -10.097849689
218 C16 Val(2S) 0.949947417 - -0.219388487
219 C16 Ryd(3S) 0.002419950 - 1.642025841
220 C16 Ryd(4S) 0.001195777 - 2.342535787
221 C16 Ryd(5S) 0.000018624 - 20.939563489
222 C16 Val(2p) 0.901261872 - -0.086594303
223 C16 Ryd(3p) 0.005607176 - 0.845909487
224 C16 Ryd(5p) 0.000485519 - 2.221766304
225 C16 Ryd(4p) 0.000124069 - 1.347097038
226 C16 Val(2p) 1.144708485 - -0.118963338
227 C16 Ryd(3p) 0.010547023 - 0.966934065
228 C16 Ryd(5p) 0.000641045 - 1.991454185
229 C16 Ryd(4p) 0.000074973 - 1.910242977
230 C16 Val(2p) 1.067403198 - -0.111827906
231 C16 Ryd(3p) 0.003471600 - 0.895397756
232 C16 Ryd(4p) 0.001183320 - 1.778091567
233 C16 Ryd(5p) 0.000152968 - 1.880642579
234 C16 Ryd(3d) 0.000714558 - 1.805753552
235 C16 Ryd(4d) 0.000434216 - 3.499532995
236 C16 Ryd(3d) 0.001704517 - 1.958729009
237 C16 Ryd(4d) 0.000383938 - 3.636644629
238 C16 Ryd(3d) 0.000681211 - 1.685266700
239 C16 Ryd(4d) 0.000280834 - 3.293838619
240 C16 Ryd(3d) 0.001258456 - 1.822349051
241 C16 Ryd(4d) 0.000318790 - 3.586285602
242 C16 Ryd(3d) 0.001298879 - 1.920909116
243 C16 Ryd(4d) 0.000246004 - 3.605058807
244 C17 Cor(1S) 1.998972301 - -10.047112237
245 C17 Val(2S) 0.884860506 - -0.151681744
246 C17 Ryd(4S) 0.001256920 - 1.201337305
247 C17 Ryd(5S) 0.000015497 - 22.016227922
248 C17 Ryd(3S) 0.000005098 - 1.022896425
249 C17 Val(2p) 1.039541709 - -0.103548758
250 C17 Ryd(4p) 0.003749821 - 0.807184455
251 C17 Ryd(3p) 0.000963882 - 0.598856731
252 C17 Ryd(5p) 0.000042044 - 3.297122889
253 C17 Val(2p) 1.085621474 - -0.071652014
254 C17 Ryd(4p) 0.004053287 - 1.019486200
255 C17 Ryd(3p) 0.001084329 - 0.835759664
256 C17 Ryd(5p) 0.000167196 - 3.746490869
257 C17 Val(2p) 1.046261222 - -0.079557805
258 C17 Ryd(4p) 0.006364019 - 1.048968918
259 C17 Ryd(3p) 0.001015245 - 0.609954223
260 C17 Ryd(5p) 0.000075442 - 3.601891522
261 C17 Ryd(3d) 0.000527372 - 1.972182692
262 C17 Ryd(4d) 0.000259309 - 3.205370329
263 C17 Ryd(3d) 0.000676337 - 2.016100876
264 C17 Ryd(4d) 0.000308482 - 3.397895007
265 C17 Ryd(3d) 0.000598011 - 2.192202620
266 C17 Ryd(4d) 0.000513168 - 3.495648646
267 C17 Ryd(3d) 0.000666422 - 2.340703877
268 C17 Ryd(4d) 0.000454661 - 3.247357611
269 C17 Ryd(3d) 0.000600474 - 2.022174105
270 C17 Ryd(4d) 0.000436741 - 3.317599128
271 C18 Cor(1S) 1.999026232 - -10.033473473
272 C18 Val(2S) 0.941703359 - -0.167555975
273 C18 Ryd(4S) 0.001125609 - 1.369222498
274 C18 Ryd(3S) 0.000012974 - 0.897343717
275 C18 Ryd(5S) 0.000010485 - 21.577116581
276 C18 Val(2p) 1.017380099 - -0.099998047
277 C18 Ryd(4p) 0.001961027 - 0.719403826
278 C18 Ryd(3p) 0.000194342 - 0.606065263
279 C18 Ryd(5p) 0.000065465 - 3.069303959
280 C18 Val(2p) 1.146340086 - -0.065042127
281 C18 Ryd(4p) 0.005597462 - 1.066624554
282 C18 Ryd(3p) 0.000135066 - 0.470608730
283 C18 Ryd(5p) 0.000077279 - 3.463047346
284 C18 Val(2p) 1.075324840 - -0.078603595
285 C18 Ryd(4p) 0.003904202 - 0.973637609
286 C18 Ryd(3p) 0.000139602 - 0.653577402
287 C18 Ryd(5p) 0.000107782 - 3.334358289
288 C18 Ryd(3d) 0.000605802 - 1.690861691
289 C18 Ryd(4d) 0.000193991 - 3.246408398
290 C18 Ryd(3d) 0.001050887 - 2.005628903
291 C18 Ryd(4d) 0.000150104 - 3.398470380
292 C18 Ryd(3d) 0.000687659 - 1.875830737
293 C18 Ryd(4d) 0.000537741 - 3.501898991
294 C18 Ryd(3d) 0.000733557 - 1.727736790
295 C18 Ryd(4d) 0.000273492 - 3.398889349
296 C18 Ryd(3d) 0.000447394 - 1.718672749
297 C18 Ryd(4d) 0.000206824 - 3.299480512
298 C19 Cor(1S) 1.999143680 - -10.035096353
299 C19 Val(2S) 0.951237026 - -0.172537422
300 C19 Ryd(4S) 0.001018204 - 1.477738529
301 C19 Ryd(3S) 0.000053288 - 1.207162766
302 C19 Ryd(5S) 0.000007969 - 20.856196188
303 C19 Val(2p) 1.032258437 - -0.097700766
304 C19 Ryd(4p) 0.002569157 - 0.687802022
305 C19 Ryd(3p) 0.000282460 - 0.431076923
306 C19 Ryd(5p) 0.000047338 - 2.934661218
307 C19 Val(2p) 1.142808958 - -0.062840805
308 C19 Ryd(4p) 0.006359494 - 1.038307721
309 C19 Ryd(3p) 0.000171626 - 0.527463722
310 C19 Ryd(5p) 0.000084465 - 3.329274854
311 C19 Val(2p) 1.055619478 - -0.071867276
312 C19 Ryd(4p) 0.003743753 - 0.794287058
313 C19 Ryd(3p) 0.000270437 - 0.544222913
314 C19 Ryd(5p) 0.000129516 - 3.163283164
315 C19 Ryd(3d) 0.000446229 - 1.666365526
316 C19 Ryd(4d) 0.000314048 - 3.108072795
317 C19 Ryd(3d) 0.000996731 - 1.980838972
318 C19 Ryd(4d) 0.000139123 - 3.248934633
319 C19 Ryd(3d) 0.000674795 - 2.127492088
320 C19 Ryd(4d) 0.000430144 - 3.356975475
321 C19 Ryd(3d) 0.000814909 - 1.785970720
322 C19 Ryd(4d) 0.000206957 - 3.214245541
323 C19 Ryd(3d) 0.000493133 - 1.831377071
324 C19 Ryd(4d) 0.000277446 - 3.197818976
325 C20 Cor(1S) 1.999148700 - -10.034996018
326 C20 Val(2S) 0.954648590 - -0.173487962
327 C20 Ryd(3S) 0.001010544 - 1.265010965
328 C20 Ryd(4S) 0.000052241 - 3.062653481
329 C20 Ryd(5S) 0.000006802 - 19.275758854
330 C20 Val(2p) 1.044537139 - -0.098408199
331 C20 Ryd(4p) 0.002889029 - 0.702854859
332 C20 Ryd(3p) 0.000266096 - 0.355883549
333 C20 Ryd(5p) 0.000032710 - 2.969704158
334 C20 Val(2p) 1.059009985 - -0.057710899
335 C20 Ryd(4p) 0.004503959 - 0.790695443
336 C20 Ryd(3p) 0.000361603 - 0.572440916
337 C20 Ryd(5p) 0.000187198 - 3.380696628
338 C20 Val(2p) 1.125650054 - -0.075676112
339 C20 Ryd(4p) 0.005251373 - 0.962563824
340 C20 Ryd(3p) 0.000274158 - 0.367303370
341 C20 Ryd(5p) 0.000042637 - 3.246590369
342 C20 Ryd(3d) 0.000481749 - 1.790597809
343 C20 Ryd(4d) 0.000199143 - 3.124894191
344 C20 Ryd(3d) 0.000864897 - 1.690042560
345 C20 Ryd(4d) 0.000293289 - 3.167079685
346 C20 Ryd(3d) 0.000664147 - 1.958910742
347 C20 Ryd(4d) 0.000284527 - 3.301071960
348 C20 Ryd(3d) 0.000844565 - 2.169060976
349 C20 Ryd(4d) 0.000304064 - 3.263016242
350 C20 Ryd(3d) 0.000502281 - 1.772409818
351 C20 Ryd(4d) 0.000352090 - 3.112707108
352 C21 Cor(1S) 1.999148216 - -10.035007524
353 C21 Val(2S) 0.951615941 - -0.172745026
354 C21 Ryd(4S) 0.001032470 - 1.471174666
355 C21 Ryd(3S) 0.000064273 - 0.840219316
356 C21 Ryd(5S) 0.000011860 - 21.186293474
357 C21 Val(2p) 1.014380319 - -0.095961533
358 C21 Ryd(4p) 0.002170487 - 0.634909900
359 C21 Ryd(3p) 0.000296427 - 0.480411577
360 C21 Ryd(5p) 0.000072925 - 2.918082368
361 C21 Val(2p) 1.146609000 - -0.062146859
362 C21 Ryd(4p) 0.006440645 - 1.050782695
363 C21 Ryd(3p) 0.000186082 - 0.525551177
364 C21 Ryd(5p) 0.000079975 - 3.326504345
365 C21 Val(2p) 1.067386182 - -0.070749172
366 C21 Ryd(4p) 0.003961992 - 0.833901453
367 C21 Ryd(3p) 0.000276685 - 0.568173718
368 C21 Ryd(5p) 0.000129325 - 3.141250846
369 C21 Ryd(3d) 0.000558219 - 1.795786853
370 C21 Ryd(4d) 0.000154216 - 3.100958594
371 C21 Ryd(3d) 0.001018340 - 2.106790935
372 C21 Ryd(4d) 0.000152628 - 3.257402018
373 C21 Ryd(3d) 0.000578120 - 1.998926878
374 C21 Ryd(4d) 0.000512259 - 3.353857008
375 C21 Ryd(3d) 0.000719685 - 1.773351933
376 C21 Ryd(4d) 0.000320469 - 3.232075804
377 C21 Ryd(3d) 0.000556611 - 1.806609724
378 C21 Ryd(4d) 0.000192651 - 3.176022922
379 C22 Cor(1S) 1.999011532 - -10.029946310
380 C22 Val(2S) 0.943345547 - -0.164506783
381 C22 Ryd(4S) 0.001376504 - 1.273545923
382 C22 Ryd(3S) 0.000031681 - 0.946155294
383 C22 Ryd(5S) 0.000004984 - 21.631411550
384 C22 Val(2p) 1.030987203 - -0.098991936
385 C22 Ryd(4p) 0.002211126 - 0.855014738
386 C22 Ryd(3p) 0.000234465 - 0.726926030
387 C22 Ryd(5p) 0.000049872 - 3.023736831
388 C22 Val(2p) 1.151335662 - -0.060456789
389 C22 Ryd(4p) 0.005255515 - 1.198272490
390 C22 Ryd(3p) 0.000187586 - 0.641544703
391 C22 Ryd(5p) 0.000078996 - 3.216389355
392 C22 Val(2p) 1.061831741 - -0.074243567
393 C22 Ryd(4p) 0.003351365 - 1.046512653
394 C22 Ryd(3p) 0.000190628 - 0.754980136
395 C22 Ryd(5p) 0.000120817 - 3.244566736
396 C22 Ryd(3d) 0.000624586 - 1.613761032
397 C22 Ryd(4d) 0.000232860 - 3.267678521
398 C22 Ryd(3d) 0.001024488 - 1.958687114
399 C22 Ryd(4d) 0.000130613 - 3.393890888
400 C22 Ryd(3d) 0.000773870 - 2.014658130
401 C22 Ryd(4d) 0.000491400 - 3.509869849
402 C22 Ryd(3d) 0.000839947 - 1.794676565
403 C22 Ryd(4d) 0.000162408 - 3.369771591
404 C22 Ryd(3d) 0.000514845 - 1.798295452
405 C22 Ryd(4d) 0.000242503 - 3.347956550
406 H23 Val(1S) 0.769063029 - 0.067772382
407 H23 Ryd(2S) 0.001339121 - 1.058887218
408 H23 Ryd(3S) 0.000332560 - 2.431030017
409 H23 Ryd(2p) 0.000189211 - 2.281659550
410 H23 Ryd(2p) 0.000230653 - 2.937606336
411 H23 Ryd(2p) 0.000139468 - 2.521400414
412 H24 Val(1S) 0.783650655 - 0.051924233
413 H24 Ryd(2S) 0.000553860 - 1.157199276
414 H24 Ryd(3S) 0.000155854 - 1.930109328
415 H24 Ryd(2p) 0.000159646 - 2.134702321
416 H24 Ryd(2p) 0.000309033 - 2.795169900
417 H24 Ryd(2p) 0.000172786 - 2.489636597
418 H25 Val(1S) 0.783631492 - 0.051873969
419 H25 Ryd(2S) 0.000426692 - 1.106712692
420 H25 Ryd(3S) 0.000154623 - 1.933612145
421 H25 Ryd(2p) 0.000255940 - 2.220589719
422 H25 Ryd(2p) 0.000052685 - 2.528331991
423 H25 Ryd(2p) 0.000339340 - 2.640928996
424 H26 Val(1S) 0.782454174 - 0.051274605
425 H26 Ryd(2S) 0.000470402 - 1.192944585
426 H26 Ryd(3S) 0.000157319 - 1.848498613
427 H26 Ryd(2p) 0.000217616 - 2.184607277
428 H26 Ryd(2p) 0.000293016 - 2.778967359
429 H26 Ryd(2p) 0.000133713 - 2.435491184
430 H27 Val(1S) 0.783610402 - 0.049784638
431 H27 Ryd(2S) 0.000564201 - 1.621166108
432 H27 Ryd(3S) 0.000106130 - 1.683102812
433 H27 Ryd(2p) 0.000158155 - 2.180445880
434 H27 Ryd(2p) 0.000314987 - 2.874891629
435 H27 Ryd(2p) 0.000163724 - 2.523773348
436 N28 Cor(1S) 1.999237503 - -14.191057717
437 N28 Val(2S) 1.212969974 - -0.525958343
438 N28 Ryd(3S) 0.001474781 - 1.750661596
439 N28 Ryd(4S) 0.000530257 - 1.822908927
440 N28 Ryd(5S) 0.000003456 - 34.628412201
441 N28 Val(2p) 1.305038829 - -0.247141233
442 N28 Ryd(4p) 0.003743603 - 1.428441411
443 N28 Ryd(3p) 0.000901205 - 1.258595432
444 N28 Ryd(5p) 0.000034614 - 3.674744566
445 N28 Val(2p) 1.339610350 - -0.265525718
446 N28 Ryd(4p) 0.003160130 - 1.400380661
447 N28 Ryd(3p) 0.001125147 - 1.085614974
448 N28 Ryd(5p) 0.000030637 - 3.806866742
449 N28 Val(2p) 1.602697479 - -0.259308888
450 N28 Ryd(3p) 0.006710998 - 0.914203509
451 N28 Ryd(4p) 0.000849943 - 0.920495731
452 N28 Ryd(5p) 0.000017605 - 3.953356075
453 N28 Ryd(3d) 0.000755848 - 1.937953522
454 N28 Ryd(4d) 0.000297196 - 5.113712598
455 N28 Ryd(3d) 0.000622644 - 1.730083003
456 N28 Ryd(4d) 0.000135096 - 5.002598782
457 N28 Ryd(3d) 0.000945428 - 1.686138204
458 N28 Ryd(4d) 0.000116105 - 4.968272052
459 N28 Ryd(3d) 0.001658069 - 1.995436735
460 N28 Ryd(4d) 0.000208626 - 5.140347834
461 N28 Ryd(3d) 0.001294811 - 1.781427254
462 N28 Ryd(4d) 0.000093917 - 4.970684009
463 C29 Cor(1S) 1.999132872 - -10.081141057
464 C29 Val(2S) 0.988022655 - -0.221653296
465 C29 Ryd(4S) 0.001465261 - 1.372474248
466 C29 Ryd(3S) 0.000010442 - 0.849504641
467 C29 Ryd(5S) 0.000009004 - 23.228053361
468 C29 Val(2p) 1.036344958 - -0.096879674
469 C29 Ryd(3p) 0.003281454 - 0.753398796
470 C29 Ryd(4p) 0.000768024 - 0.972891336
471 C29 Ryd(5p) 0.000077702 - 2.786028405
472 C29 Val(2p) 1.049894348 - -0.098802602
473 C29 Ryd(3p) 0.004089426 - 0.864370835
474 C29 Ryd(4p) 0.001182921 - 1.108030907
475 C29 Ryd(5p) 0.000084233 - 2.685317356
476 C29 Val(2p) 1.093201585 - -0.108179740
477 C29 Ryd(4p) 0.003289970 - 0.711151433
478 C29 Ryd(3p) 0.000630243 - 0.661458689
479 C29 Ryd(5p) 0.000104417 - 2.940018492
480 C29 Ryd(3d) 0.001699271 - 2.029603881
481 C29 Ryd(4d) 0.000150391 - 3.451303339
482 C29 Ryd(3d) 0.001091270 - 1.922614335
483 C29 Ryd(4d) 0.000098761 - 3.220558902
484 C29 Ryd(3d) 0.001282342 - 1.973329279
485 C29 Ryd(4d) 0.000154308 - 3.344851626
486 C29 Ryd(3d) 0.000547560 - 1.877414518
487 C29 Ryd(4d) 0.000288176 - 3.043976972
488 C29 Ryd(3d) 0.000962447 - 1.860334016
489 C29 Ryd(4d) 0.000193642 - 3.169776832
490 C30 Cor(1S) 1.998984243 - -10.043930546
491 C30 Val(2S) 0.891179692 - -0.148719496
492 C30 Ryd(3S) 0.000832802 - 1.163694987
493 C30 Ryd(4S) 0.000024836 - 2.035509712
494 C30 Ryd(5S) 0.000011510 - 20.598281656
495 C30 Val(2p) 1.023853756 - -0.098741877
496 C30 Ryd(4p) 0.002699144 - 0.729890218
497 C30 Ryd(3p) 0.000931890 - 0.495786265
498 C30 Ryd(5p) 0.000040883 - 3.139115503
499 C30 Val(2p) 1.038937800 - -0.073059645
500 C30 Ryd(4p) 0.004859462 - 1.051014227
501 C30 Ryd(3p) 0.000919497 - 0.555247940
502 C30 Ryd(5p) 0.000079986 - 3.461177612
503 C30 Val(2p) 1.079452452 - -0.063032390
504 C30 Ryd(4p) 0.003809734 - 1.051445181
505 C30 Ryd(3p) 0.001095097 - 0.636585616
506 C30 Ryd(5p) 0.000134570 - 3.729010172
507 C30 Ryd(3d) 0.000766566 - 1.953647693
508 C30 Ryd(4d) 0.000206743 - 3.457957312
509 C30 Ryd(3d) 0.000491703 - 1.865167922
510 C30 Ryd(4d) 0.000330043 - 3.281268542
511 C30 Ryd(3d) 0.000585787 - 2.034844404
512 C30 Ryd(4d) 0.000598736 - 3.577047399
513 C30 Ryd(3d) 0.000412854 - 1.666057678
514 C30 Ryd(4d) 0.000212791 - 3.227026779
515 C30 Ryd(3d) 0.000732673 - 2.324350209
516 C30 Ryd(4d) 0.000612968 - 3.588126074
517 C31 Cor(1S) 1.999017133 - -10.024443581
518 C31 Val(2S) 0.944398347 - -0.160289281
519 C31 Ryd(4S) 0.001458395 - 1.264927321
520 C31 Ryd(3S) 0.000031949 - 1.020425605
521 C31 Ryd(5S) 0.000004907 - 21.412653764
522 C31 Val(2p) 1.060183539 - -0.095670249
523 C31 Ryd(4p) 0.002402242 - 0.861618371
524 C31 Ryd(3p) 0.000224643 - 0.844491839
525 C31 Ryd(5p) 0.000056293 - 2.917878704
526 C31 Val(2p) 1.114073219 - -0.073357098
527 C31 Ryd(4p) 0.004086346 - 1.146058397
528 C31 Ryd(3p) 0.000121035 - 0.863583956
529 C31 Ryd(5p) 0.000074325 - 3.228568272
530 C31 Val(2p) 1.094768719 - -0.054257186
531 C31 Ryd(4p) 0.004110621 - 1.098397064
532 C31 Ryd(3p) 0.000240860 - 0.740687819
533 C31 Ryd(5p) 0.000086251 - 3.175828843
534 C31 Ryd(3d) 0.001081930 - 1.716657122
535 C31 Ryd(4d) 0.000164128 - 3.390957902
536 C31 Ryd(3d) 0.000556765 - 1.661471303
537 C31 Ryd(4d) 0.000161763 - 3.314707759
538 C31 Ryd(3d) 0.000754093 - 2.068039520
539 C31 Ryd(4d) 0.000382324 - 3.544247163
540 C31 Ryd(3d) 0.000529939 - 1.524851971
541 C31 Ryd(4d) 0.000099063 - 3.160700675
542 C31 Ryd(3d) 0.001006813 - 2.190820909
543 C31 Ryd(4d) 0.000397979 - 3.571451624
544 C32 Cor(1S) 1.999149885 - -10.031212527
545 C32 Val(2S) 0.950687986 - -0.168843837
546 C32 Ryd(3S) 0.001032925 - 1.466299484
547 C32 Ryd(4S) 0.000057455 - 1.601084120
548 C32 Ryd(5S) 0.000011346 - 20.412744077
549 C32 Val(2p) 1.015306272 - -0.093882901
550 C32 Ryd(4p) 0.002273721 - 0.630811058
551 C32 Ryd(3p) 0.000367994 - 0.450775893
552 C32 Ryd(5p) 0.000067764 - 2.950113047
553 C32 Val(2p) 1.043648110 - -0.066093358
554 C32 Ryd(4p) 0.003612141 - 0.743608391
555 C32 Ryd(3p) 0.000330748 - 0.557086951
556 C32 Ryd(5p) 0.000148864 - 3.177413317
557 C32 Val(2p) 1.169645618 - -0.058190528
558 C32 Ryd(4p) 0.006818346 - 1.127732276
559 C32 Ryd(3p) 0.000249541 - 0.467741698
560 C32 Ryd(5p) 0.000062755 - 3.337109884
561 C32 Ryd(3d) 0.000977105 - 2.187914928
562 C32 Ryd(4d) 0.000182535 - 3.264474673
563 C32 Ryd(3d) 0.000551520 - 1.691013173
564 C32 Ryd(4d) 0.000142285 - 3.046033448
565 C32 Ryd(3d) 0.000722833 - 1.987719365
566 C32 Ryd(4d) 0.000222691 - 3.298445369
567 C32 Ryd(3d) 0.000438285 - 1.748679696
568 C32 Ryd(4d) 0.000131368 - 3.047031258
569 C32 Ryd(3d) 0.000690486 - 1.946379046
570 C32 Ryd(4d) 0.000658845 - 3.370085318
571 C33 Cor(1S) 1.999146738 - -10.030176880
572 C33 Val(2S) 0.953356043 - -0.169015854
573 C33 Ryd(3S) 0.001040485 - 1.271353712
574 C33 Ryd(4S) 0.000062430 - 2.856175481
575 C33 Ryd(5S) 0.000004819 - 19.461630860
576 C33 Val(2p) 1.037289327 - -0.095472901
577 C33 Ryd(4p) 0.002685517 - 0.641548655
578 C33 Ryd(3p) 0.000392624 - 0.400301305
579 C33 Ryd(5p) 0.000046522 - 2.944727455
580 C33 Val(2p) 1.118012760 - -0.071314222
581 C33 Ryd(4p) 0.005082604 - 0.920988771
582 C33 Ryd(3p) 0.000342080 - 0.418416336
583 C33 Ryd(5p) 0.000059584 - 3.225789622
584 C33 Val(2p) 1.087142396 - -0.055239460
585 C33 Ryd(4p) 0.005085577 - 0.862174353
586 C33 Ryd(3p) 0.000365925 - 0.544493508
587 C33 Ryd(5p) 0.000156050 - 3.361396313
588 C33 Ryd(3d) 0.000927692 - 1.798367019
589 C33 Ryd(4d) 0.000167893 - 3.154161145
590 C33 Ryd(3d) 0.000478436 - 1.870461844
591 C33 Ryd(4d) 0.000277651 - 3.109650301
592 C33 Ryd(3d) 0.000593356 - 2.006976290
593 C33 Ryd(4d) 0.000525020 - 3.330081628
594 C33 Ryd(3d) 0.000445082 - 1.553549744
595 C33 Ryd(4d) 0.000139152 - 2.954728669
596 C33 Ryd(3d) 0.000883143 - 2.195603072
597 C33 Ryd(4d) 0.000323395 - 3.373893042
598 C34 Cor(1S) 1.999151114 - -10.032096175
599 C34 Val(2S) 0.951465289 - -0.169529974
600 C34 Ryd(4S) 0.001035467 - 1.401656140
601 C34 Ryd(3S) 0.000049119 - 0.945302562
602 C34 Ryd(5S) 0.000007798 - 21.222143808
603 C34 Val(2p) 1.044854536 - -0.096438749
604 C34 Ryd(4p) 0.002745439 - 0.710843286
605 C34 Ryd(3p) 0.000330612 - 0.389993805
606 C34 Ryd(5p) 0.000027328 - 2.943514751
607 C34 Val(2p) 1.096021006 - -0.069830669
608 C34 Ryd(4p) 0.004680801 - 0.900226728
609 C34 Ryd(3p) 0.000284029 - 0.447163122
610 C34 Ryd(5p) 0.000082221 - 3.214966041
611 C34 Val(2p) 1.089117500 - -0.055639228
612 C34 Ryd(4p) 0.005098369 - 0.889059263
613 C34 Ryd(3p) 0.000225316 - 0.535835750
614 C34 Ryd(5p) 0.000139829 - 3.358899976
615 C34 Ryd(3d) 0.000883313 - 1.768415167
616 C34 Ryd(4d) 0.000203535 - 3.184806776
617 C34 Ryd(3d) 0.000425074 - 1.703405261
618 C34 Ryd(4d) 0.000265934 - 3.102784220
619 C34 Ryd(3d) 0.000660586 - 2.192483316
620 C34 Ryd(4d) 0.000556203 - 3.376884312
621 C34 Ryd(3d) 0.000519391 - 1.597130730
622 C34 Ryd(4d) 0.000076984 - 2.961510931
623 C34 Ryd(3d) 0.000879945 - 2.188170710
624 C34 Ryd(4d) 0.000287059 - 3.389602955
625 C35 Cor(1S) 1.999036443 - -10.028699096
626 C35 Val(2S) 0.939562938 - -0.161828937
627 C35 Ryd(4S) 0.001145398 - 1.350669804
628 C35 Ryd(3S) 0.000014255 - 0.875217892
629 C35 Ryd(5S) 0.000012337 - 21.645204366
630 C35 Val(2p) 1.024060285 - -0.096658796
631 C35 Ryd(4p) 0.001768378 - 0.682222940
632 C35 Ryd(3p) 0.000230325 - 0.435565997
633 C35 Ryd(5p) 0.000064014 - 3.023601049
634 C35 Val(2p) 1.051290676 - -0.071126798
635 C35 Ryd(4p) 0.002972327 - 0.861807518
636 C35 Ryd(3p) 0.000177666 - 0.544536757
637 C35 Ryd(5p) 0.000139904 - 3.305102005
638 C35 Val(2p) 1.173464837 - -0.063166285
639 C35 Ryd(4p) 0.006490574 - 1.178024774
640 C35 Ryd(3p) 0.000096694 - 0.470447963
641 C35 Ryd(5p) 0.000058954 - 3.517329368
642 C35 Ryd(3d) 0.001023992 - 2.081011709
643 C35 Ryd(4d) 0.000206315 - 3.380626279
644 C35 Ryd(3d) 0.000574074 - 1.601121867
645 C35 Ryd(4d) 0.000137120 - 3.164237671
646 C35 Ryd(3d) 0.000715448 - 1.906178434
647 C35 Ryd(4d) 0.000239593 - 3.410587760
648 C35 Ryd(3d) 0.000459880 - 1.657662935
649 C35 Ryd(4d) 0.000134207 - 3.173606852
650 C35 Ryd(3d) 0.000757404 - 1.860112262
651 C35 Ryd(4d) 0.000617815 - 3.486186907
652 H36 Val(1S) 0.785814945 - 0.049370867
653 H36 Ryd(3S) 0.000565907 - 1.563092859
654 H36 Ryd(2S) 0.000124364 - 1.532783437
655 H36 Ryd(2p) 0.000171165 - 2.147531976
656 H36 Ryd(2p) 0.000093899 - 2.431457224
657 H36 Ryd(2p) 0.000370049 - 2.931494031
658 H37 Val(1S) 0.785147018 - 0.052929337
659 H37 Ryd(2S) 0.000461503 - 1.155068980
660 H37 Ryd(3S) 0.000158525 - 1.863729199
661 H37 Ryd(2p) 0.000252867 - 2.206808192
662 H37 Ryd(2p) 0.000252411 - 2.561624543
663 H37 Ryd(2p) 0.000140877 - 2.622870286
664 H38 Val(1S) 0.785593283 - 0.053713154
665 H38 Ryd(2S) 0.000453851 - 1.082627760
666 H38 Ryd(3S) 0.000150780 - 1.960410050
667 H38 Ryd(2p) 0.000205743 - 2.160434937
668 H38 Ryd(2p) 0.000298767 - 2.605583666
669 H38 Ryd(2p) 0.000133757 - 2.617579721
670 H39 Val(1S) 0.785950085 - 0.053911257
671 H39 Ryd(2S) 0.000516408 - 1.216275633
672 H39 Ryd(3S) 0.000144465 - 1.905342969
673 H39 Ryd(2p) 0.000162239 - 2.128646634
674 H39 Ryd(2p) 0.000089886 - 2.416206403
675 H39 Ryd(2p) 0.000380804 - 2.874642265
676 H40 Val(1S) 0.764594282 - 0.074045436
677 H40 Ryd(2S) 0.001848788 - 0.962509542
678 H40 Ryd(3S) 0.000350864 - 2.419643979
679 H40 Ryd(2p) 0.000256169 - 2.346528018
680 H40 Ryd(2p) 0.000189374 - 2.657612342
681 H40 Ryd(2p) 0.000108213 - 2.737689776
682 H41 Val(1S) 0.761734460 - 0.033951987
683 H41 Ryd(3S) 0.000615779 - 1.685036805
684 H41 Ryd(2S) 0.000071066 - 1.483485853
685 H41 Ryd(2p) 0.000239568 - 2.762658403
686 H41 Ryd(2p) 0.000170389 - 2.528231894
687 H41 Ryd(2p) 0.000164324 - 2.305442362
688 H42 Val(1S) 0.782292824 - 0.028064292
689 H42 Ryd(3S) 0.000741504 - 1.659933498
690 H42 Ryd(2S) 0.000066713 - 1.516244890
691 H42 Ryd(2p) 0.000117295 - 2.377752598
692 H42 Ryd(2p) 0.000131498 - 2.366173329
693 H42 Ryd(2p) 0.000312169 - 2.916767503
694 C43 Cor(1S) 1.999137970 - -10.156401361
695 C43 Val(2S) 0.757226130 - -0.117927072
696 C43 Ryd(3S) 0.003935735 - 1.509773694
697 C43 Ryd(4S) 0.001646024 - 1.551939123
698 C43 Ryd(5S) 0.000048154 - 19.383347640
699 C43 Val(2p) 0.906535853 - -0.045794936
700 C43 Ryd(4p) 0.012068105 - 1.416076050
701 C43 Ryd(3p) 0.000772059 - 1.328024752
702 C43 Ryd(5p) 0.000114759 - 2.107178512
703 C43 Val(2p) 0.811797482 - -0.016015983
704 C43 Ryd(3p) 0.008837822 - 1.147979130
705 C43 Ryd(4p) 0.000550222 - 1.587596214
706 C43 Ryd(5p) 0.000184832 - 1.910709451
707 C43 Val(2p) 0.777491712 - -0.116261191
708 C43 Ryd(3p) 0.003942884 - 0.777401996
709 C43 Ryd(4p) 0.000735999 - 0.927739438
710 C43 Ryd(5p) 0.000164279 - 2.247275446
711 C43 Ryd(3d) 0.000858955 - 2.766799665
712 C43 Ryd(4d) 0.000775671 - 3.715052791
713 C43 Ryd(3d) 0.001018164 - 2.411908487
714 C43 Ryd(4d) 0.000140261 - 2.611149221
715 C43 Ryd(3d) 0.001565237 - 2.499156400
716 C43 Ryd(4d) 0.000154486 - 2.764531342
717 C43 Ryd(3d) 0.002499176 - 2.682546395
718 C43 Ryd(4d) 0.000252274 - 3.496926429
719 C43 Ryd(3d) 0.000850297 - 2.640424596
720 C43 Ryd(4d) 0.000238142 - 2.868003590
721 C44 Cor(1S) 1.998906586 - -10.051332062
722 C44 Val(2S) 0.900448720 - -0.157568204
723 C44 Ryd(4S) 0.001476653 - 1.279578622
724 C44 Ryd(3S) 0.000026884 - 1.219211519
725 C44 Ryd(5S) 0.000012726 - 21.222231446
726 C44 Val(2p) 1.063204834 - -0.075837498
727 C44 Ryd(3p) 0.006828416 - 1.420797846
728 C44 Ryd(5p) 0.000077179 - 2.957068843
729 C44 Ryd(4p) 0.000069417 - 1.428139595
730 C44 Val(2p) 1.082762422 - -0.091644873
731 C44 Ryd(3p) 0.004896466 - 1.160110436
732 C44 Ryd(5p) 0.000104234 - 2.772231838
733 C44 Ryd(4p) 0.000049807 - 1.512324236
734 C44 Val(2p) 1.065955672 - -0.104977739
735 C44 Ryd(3p) 0.001810173 - 0.819714098
736 C44 Ryd(5p) 0.000132998 - 2.462432097
737 C44 Ryd(4p) 0.000124215 - 1.550361601
738 C44 Ryd(3d) 0.001138578 - 1.995237358
739 C44 Ryd(4d) 0.000545374 - 3.595238449
740 C44 Ryd(3d) 0.000552312 - 1.819214613
741 C44 Ryd(4d) 0.000260523 - 3.532168179
742 C44 Ryd(3d) 0.000905908 - 2.110408168
743 C44 Ryd(4d) 0.000282053 - 3.484671365
744 C44 Ryd(3d) 0.000694429 - 2.096001778
745 C44 Ryd(4d) 0.000486136 - 3.638729200
746 C44 Ryd(3d) 0.000551828 - 1.554379272
747 C44 Ryd(4d) 0.000260943 - 3.410686739
748 C45 Cor(1S) 1.999040790 - -10.037468756
749 C45 Val(2S) 0.943039360 - -0.170128326
750 C45 Ryd(4S) 0.001270598 - 1.313012936
751 C45 Ryd(3S) 0.000068791 - 0.870338546
752 C45 Ryd(5S) 0.000008782 - 21.607193154
753 C45 Val(2p) 1.055189490 - -0.067211915
754 C45 Ryd(4p) 0.003231720 - 1.048708059
755 C45 Ryd(3p) 0.000276748 - 0.782828758
756 C45 Ryd(5p) 0.000132296 - 3.216428221
757 C45 Val(2p) 1.124316122 - -0.082874626
758 C45 Ryd(4p) 0.004587549 - 1.146173343
759 C45 Ryd(3p) 0.000099476 - 0.790942607
760 C45 Ryd(5p) 0.000072715 - 3.111452621
761 C45 Val(2p) 1.053193180 - -0.095136179
762 C45 Ryd(4p) 0.002727072 - 0.880167637
763 C45 Ryd(3p) 0.000269481 - 0.676547110
764 C45 Ryd(5p) 0.000066823 - 2.937192266
765 C45 Ryd(3d) 0.000750470 - 1.919673898
766 C45 Ryd(4d) 0.000256865 - 3.458164484
767 C45 Ryd(3d) 0.000690112 - 1.905822563
768 C45 Ryd(4d) 0.000328327 - 3.393391488
769 C45 Ryd(3d) 0.001015147 - 1.692234495
770 C45 Ryd(4d) 0.000191446 - 3.438193433
771 C45 Ryd(3d) 0.000667452 - 1.952314166
772 C45 Ryd(4d) 0.000464738 - 3.469395584
773 C45 Ryd(3d) 0.000566541 - 1.599793807
774 C45 Ryd(4d) 0.000080587 - 3.190810029
775 C46 Cor(1S) 1.999144623 - -10.036867589
776 C46 Val(2S) 0.952260491 - -0.174880201
777 C46 Ryd(4S) 0.001159235 - 1.326922768
778 C46 Ryd(3S) 0.000109766 - 1.127677939
779 C46 Ryd(5S) 0.000009552 - 21.018694186
780 C46 Val(2p) 1.110386615 - -0.065212537
781 C46 Ryd(4p) 0.005195251 - 0.969984400
782 C46 Ryd(3p) 0.000308973 - 0.480772227
783 C46 Ryd(5p) 0.000114557 - 3.295921046
784 C46 Val(2p) 1.057719394 - -0.076879544
785 C46 Ryd(4p) 0.003856625 - 0.784973480
786 C46 Ryd(3p) 0.000224749 - 0.460988013
787 C46 Ryd(5p) 0.000116975 - 3.202841725
788 C46 Val(2p) 1.061911093 - -0.094308975
789 C46 Ryd(4p) 0.003480679 - 0.760885264
790 C46 Ryd(3p) 0.000265837 - 0.378613723
791 C46 Ryd(5p) 0.000043455 - 3.050248696
792 C46 Ryd(3d) 0.000723168 - 2.188103941
793 C46 Ryd(4d) 0.000464042 - 3.326917477
794 C46 Ryd(3d) 0.000549709 - 1.751597713
795 C46 Ryd(4d) 0.000377319 - 3.181642985
796 C46 Ryd(3d) 0.000971696 - 1.932067727
797 C46 Ryd(4d) 0.000139517 - 3.233560835
798 C46 Ryd(3d) 0.000593081 - 1.919098230
799 C46 Ryd(4d) 0.000229027 - 3.267064276
800 C46 Ryd(3d) 0.000548713 - 1.698004786
801 C46 Ryd(4d) 0.000118908 - 2.982099436
802 C47 Cor(1S) 1.999150709 - -10.037494820
803 C47 Val(2S) 0.955688168 - -0.175914287
804 C47 Ryd(3S) 0.001098324 - 1.234326192
805 C47 Ryd(4S) 0.000111670 - 1.830124609
806 C47 Ryd(5S) 0.000004274 - 20.520292548
807 C47 Val(2p) 1.145297781 - -0.067281491
808 C47 Ryd(4p) 0.005981407 - 1.017057189
809 C47 Ryd(3p) 0.000297931 - 0.380595228
810 C47 Ryd(5p) 0.000064589 - 3.372716625
811 C47 Val(2p) 1.061269834 - -0.076465950
812 C47 Ryd(4p) 0.004008051 - 0.775739405
813 C47 Ryd(3p) 0.000371780 - 0.425107769
814 C47 Ryd(5p) 0.000115711 - 3.223116916
815 C47 Val(2p) 1.014694624 - -0.092072253
816 C47 Ryd(4p) 0.002627091 - 0.630802466
817 C47 Ryd(3p) 0.000374544 - 0.404335597
818 C47 Ryd(5p) 0.000091605 - 3.024482925
819 C47 Ryd(3d) 0.000617913 - 1.866733620
820 C47 Ryd(4d) 0.000465483 - 3.298462667
821 C47 Ryd(3d) 0.000721710 - 1.804484201
822 C47 Ryd(4d) 0.000166025 - 3.146601122
823 C47 Ryd(3d) 0.001079234 - 2.153339042
824 C47 Ryd(4d) 0.000214990 - 3.260273172
825 C47 Ryd(3d) 0.000610411 - 1.844412283
826 C47 Ryd(4d) 0.000362414 - 3.243873899
827 C47 Ryd(3d) 0.000373403 - 1.590684010
828 C47 Ryd(4d) 0.000231279 - 3.060499507
829 C48 Cor(1S) 1.999147561 - -10.036780088
830 C48 Val(2S) 0.952947811 - -0.174755862
831 C48 Ryd(4S) 0.001099421 - 1.336199674
832 C48 Ryd(3S) 0.000116974 - 1.160344009
833 C48 Ryd(5S) 0.000008088 - 20.991136210
834 C48 Val(2p) 1.057101907 - -0.062480054
835 C48 Ryd(4p) 0.004150762 - 0.807799274
836 C48 Ryd(3p) 0.000359913 - 0.511342087
837 C48 Ryd(5p) 0.000181794 - 3.340652524
838 C48 Val(2p) 1.119557298 - -0.079253882
839 C48 Ryd(4p) 0.005078601 - 0.951709079
840 C48 Ryd(3p) 0.000258996 - 0.361773747
841 C48 Ryd(5p) 0.000045382 - 3.232035226
842 C48 Val(2p) 1.054316068 - -0.094515829
843 C48 Ryd(4p) 0.003186641 - 0.732116180
844 C48 Ryd(3p) 0.000273902 - 0.373810369
845 C48 Ryd(5p) 0.000051812 - 3.034032553
846 C48 Ryd(3d) 0.000697499 - 1.922183657
847 C48 Ryd(4d) 0.000245485 - 3.311382000
848 C48 Ryd(3d) 0.000673166 - 1.948940468
849 C48 Ryd(4d) 0.000230245 - 3.233551995
850 C48 Ryd(3d) 0.000884236 - 1.702904615
851 C48 Ryd(4d) 0.000314857 - 3.223862392
852 C48 Ryd(3d) 0.000660515 - 2.100157345
853 C48 Ryd(4d) 0.000488855 - 3.331446025
854 C48 Ryd(3d) 0.000532722 - 1.643267718
855 C48 Ryd(4d) 0.000105311 - 3.025515096
856 C49 Cor(1S) 1.999049415 - -10.036995469
857 C49 Val(2S) 0.943249811 - -0.168140237
858 C49 Ryd(4S) 0.001198323 - 1.374355370
859 C49 Ryd(3S) 0.000062826 - 0.968670424
860 C49 Ryd(5S) 0.000012782 - 21.360424785
861 C49 Val(2p) 1.123526640 - -0.068999388
862 C49 Ryd(4p) 0.005062213 - 1.157612962
863 C49 Ryd(3p) 0.000201976 - 0.649480588
864 C49 Ryd(5p) 0.000101628 - 3.420099472
865 C49 Val(2p) 1.042961207 - -0.075999481
866 C49 Ryd(4p) 0.003182855 - 0.835773787
867 C49 Ryd(3p) 0.000300074 - 0.532216252
868 C49 Ryd(5p) 0.000117797 - 3.249984950
869 C49 Val(2p) 1.048820762 - -0.095451499
870 C49 Ryd(4p) 0.003012041 - 0.798129726
871 C49 Ryd(3p) 0.000274007 - 0.590100441
872 C49 Ryd(5p) 0.000052442 - 3.083833532
873 C49 Ryd(3d) 0.000679767 - 2.076532415
874 C49 Ryd(4d) 0.000424213 - 3.495338579
875 C49 Ryd(3d) 0.000633234 - 1.590749596
876 C49 Ryd(4d) 0.000376285 - 3.319584075
877 C49 Ryd(3d) 0.000957837 - 1.810236140
878 C49 Ryd(4d) 0.000165661 - 3.380241421
879 C49 Ryd(3d) 0.000687131 - 1.828027825
880 C49 Ryd(4d) 0.000330169 - 3.454516674
881 C49 Ryd(3d) 0.000573345 - 1.603139398
882 C49 Ryd(4d) 0.000076512 - 3.206150647
883 H50 Val(1S) 0.777314171 - 0.052940417
884 H50 Ryd(3S) 0.000581359 - 1.675517931
885 H50 Ryd(2S) 0.000139462 - 1.510605399
886 H50 Ryd(2p) 0.000233453 - 2.747477369
887 H50 Ryd(2p) 0.000142704 - 2.471964438
888 H50 Ryd(2p) 0.000242316 - 2.340318333
889 H51 Val(1S) 0.781844884 - 0.050841675
890 H51 Ryd(2S) 0.000495948 - 1.117232720
891 H51 Ryd(3S) 0.000156134 - 1.939562255
892 H51 Ryd(2p) 0.000074992 - 2.509422190
893 H51 Ryd(2p) 0.000328131 - 2.600134698
894 H51 Ryd(2p) 0.000237296 - 2.277703109
895 H52 Val(1S) 0.782807037 - 0.051045721
896 H52 Ryd(2S) 0.000434847 - 1.069939613
897 H52 Ryd(3S) 0.000155797 - 1.981362617
898 H52 Ryd(2p) 0.000332946 - 2.765455074
899 H52 Ryd(2p) 0.000163227 - 2.429360008
900 H52 Ryd(2p) 0.000136633 - 2.181345212
901 H53 Val(1S) 0.781504280 - 0.051100002
902 H53 Ryd(2S) 0.000521238 - 1.168662388
903 H53 Ryd(3S) 0.000152005 - 1.939897920
904 H53 Ryd(2p) 0.000238156 - 2.682012641
905 H53 Ryd(2p) 0.000147676 - 2.416710861
906 H53 Ryd(2p) 0.000253588 - 2.308124186
907 H54 Val(1S) 0.776840825 - 0.055388988
908 H54 Ryd(2S) 0.001395480 - 0.745540810
909 H54 Ryd(3S) 0.000306541 - 2.396564537
910 H54 Ryd(2p) 0.000068131 - 2.555269497
911 H54 Ryd(2p) 0.000269656 - 2.699269537
912 H54 Ryd(2p) 0.000218497 - 2.419883006
913 O55 Cor(1S) 1.999758604 - -18.845454044
914 O55 Val(2S) 1.699577304 - -0.885114739
915 O55 Ryd(4S) 0.000249548 - 2.843396790
916 O55 Ryd(3S) 0.000033779 - 1.295453611
917 O55 Ryd(5S) 0.000000362 - 49.295001757
918 O55 Val(2p) 1.674708477 - -0.283932418
919 O55 Ryd(3p) 0.001993520 - 0.649778219
920 O55 Ryd(4p) 0.000265220 - 1.559338464
921 O55 Ryd(5p) 0.000041508 - 5.346682806
922 O55 Val(2p) 1.738069044 - -0.277340415
923 O55 Ryd(3p) 0.001586765 - 0.746602442
924 O55 Ryd(4p) 0.000696638 - 1.275790421
925 O55 Ryd(5p) 0.000032059 - 5.330216920
926 O55 Val(2p) 1.541149784 - -0.258007429
927 O55 Ryd(3p) 0.001817695 - 0.575834484
928 O55 Ryd(4p) 0.000180259 - 1.211878234
929 O55 Ryd(5p) 0.000009312 - 5.113296461
930 O55 Ryd(3d) 0.004535956 - 2.095741229
931 O55 Ryd(4d) 0.000027931 - 7.068104515
932 O55 Ryd(3d) 0.003013622 - 1.810890659
933 O55 Ryd(4d) 0.000019336 - 6.963874908
934 O55 Ryd(3d) 0.001878270 - 1.771254861
935 O55 Ryd(4d) 0.000014303 - 6.939088671
936 O55 Ryd(3d) 0.004471322 - 1.996409039
937 O55 Ryd(4d) 0.000073627 - 7.121951252
938 O55 Ryd(3d) 0.001864726 - 1.830442243
939 O55 Ryd(4d) 0.000009402 - 6.940459046
940 H56 Val(1S) 0.756684130 - 0.031348843
941 H56 Ryd(2S) 0.001190189 - 0.891432526
942 H56 Ryd(3S) 0.000194022 - 2.404735050
943 H56 Ryd(2p) 0.000136358 - 2.572604740
944 H56 Ryd(2p) 0.000406402 - 3.103735542
945 H56 Ryd(2p) 0.000147360 - 2.552252748
946 O57 Cor(1S) 1.999744997 - -18.833648934
947 O57 Val(2S) 1.694625463 - -0.876508446
948 O57 Ryd(4S) 0.000353592 - 2.255160611
949 O57 Ryd(3S) 0.000056243 - 1.775437567
950 O57 Ryd(5S) 0.000000668 - 49.506047276
951 O57 Val(2p) 1.772670198 - -0.264329665
952 O57 Ryd(3p) 0.001331088 - 1.009258104
953 O57 Ryd(4p) 0.000289879 - 1.606870722
954 O57 Ryd(5p) 0.000022355 - 5.341045983
955 O57 Val(2p) 1.565587906 - -0.247880709
956 O57 Ryd(3p) 0.001712170 - 0.676962198
957 O57 Ryd(4p) 0.000142922 - 1.460316223
958 O57 Ryd(5p) 0.000002786 - 5.064185679
959 O57 Val(2p) 1.641696297 - -0.284498888
960 O57 Ryd(3p) 0.001489111 - 0.772095799
961 O57 Ryd(4p) 0.000190111 - 1.559003555
962 O57 Ryd(5p) 0.000044372 - 5.472690714
963 O57 Ryd(3d) 0.001288816 - 1.691878235
964 O57 Ryd(4d) 0.000007751 - 6.892176776
965 O57 Ryd(3d) 0.005580337 - 2.066758783
966 O57 Ryd(4d) 0.000030212 - 7.078360074
967 O57 Ryd(3d) 0.003902470 - 1.790363059
968 O57 Ryd(4d) 0.000026991 - 6.997661134
969 O57 Ryd(3d) 0.001375197 - 1.738854845
970 O57 Ryd(4d) 0.000014625 - 6.923351409
971 O57 Ryd(3d) 0.005992944 - 2.025197818
972 O57 Ryd(4d) 0.000050845 - 7.108574511
973 H58 Val(1S) 0.584317936 - 0.094384360
974 H58 Ryd(2S) 0.000709743 - 1.185190619
975 H58 Ryd(3S) 0.000283394 - 2.142191168
976 H58 Ryd(2p) 0.000178693 - 2.679366603
977 H58 Ryd(2p) 0.000601507 - 2.095196327
978 H58 Ryd(2p) 0.000314789 - 3.010622334

Natural Hybrid Orbitals

Orbital Description Occupancy Spin Energy () Actions
1 BD(1)C1(C2) 1s(26.97%)p2.71(72.97%)d0.00(0.06%) 1.036208828 - -0.134774064
2 BD(1)C2(C1) 2s(29.57%)p2.38(70.30%)d0.00(0.13%) 0.967079079 - -0.100098504
3 BD(1)C1(C6) 1s(27.02%)p2.70(72.92%)d0.00(0.06%) 1.036749369 - -0.134615607
4 BD(1)C6(C1) 6s(29.55%)p2.38(70.32%)d0.00(0.13%) 0.967412402 - -0.099424278
5 BD(1)C1(C10) 1s(26.06%)p2.83(73.87%)d0.00(0.07%) 1.031917412 - -0.133323396
6 BD(1)C10(C1) 10s(29.99%)p2.33(69.88%)d0.00(0.13%) 0.963885895 - -0.106537926
7 BD(1)C1(N14) 1s(19.96%)p4.00(79.90%)d0.01(0.14%) 0.760304420 - -0.071282377
8 BD(1)N14(C1) 14s(35.73%)p1.80(64.20%)d0.00(0.07%) 1.272300184 - -0.336960115
9 BD(1)C2(H3) 2s(23.26%)p3.29(76.63%)d0.00(0.10%) 1.197532132 - -0.127570238
10 BD(1)H3(C2) 3s(99.98%)p0.00(0.02%) 0.795915839 - 0.045684469
11 BD(1)C2(H4) 2s(23.16%)p3.31(76.73%)d0.00(0.11%) 1.195433460 - -0.127384754
12 BD(1)H4(C2) 4s(99.98%)p0.00(0.02%) 0.794040833 - 0.042971461
13 BD(1)C2(H5) 2s(23.95%)p3.17(75.94%)d0.00(0.11%) 1.214088167 - -0.128090824
14 BD(1)H5(C2) 5s(99.98%)p0.00(0.02%) 0.780930264 - 0.060148252
15 BD(1)C6(H7) 6s(23.30%)p3.29(76.60%)d0.00(0.10%) 1.198275462 - -0.126711460
16 BD(1)H7(C6) 7s(99.98%)p0.00(0.02%) 0.795051897 - 0.047210983
17 BD(1)C6(H8) 6s(23.93%)p3.17(75.96%)d0.00(0.10%) 1.213603953 - -0.127259909
18 BD(1)H8(C6) 8s(99.98%)p0.00(0.02%) 0.781160168 - 0.060544990
19 BD(1)C6(H9) 6s(23.16%)p3.31(76.74%)d0.00(0.10%) 1.194651504 - -0.126720461
20 BD(1)H9(C6) 9s(99.98%)p0.00(0.02%) 0.794762345 - 0.043063182
21 BD(1)C10(H11) 10s(23.30%)p3.29(76.59%)d0.00(0.11%) 1.202033425 - -0.136180231
22 BD(1)H11(C10) 11s(99.98%)p0.00(0.02%) 0.792098222 - 0.041413071
23 BD(1)C10(H12) 10s(23.32%)p3.28(76.59%)d0.00(0.10%) 1.205210765 - -0.135607308
24 BD(1)H12(C10) 12s(99.98%)p0.00(0.02%) 0.783927924 - 0.043450958
25 BD(1)C10(H13) 10s(23.33%)p3.28(76.57%)d0.00(0.11%) 1.202303615 - -0.136049897
26 BD(1)H13(C10) 13s(99.98%)p0.00(0.02%) 0.791944954 - 0.041903663
27 BD(1)N14(C15) 14s(36.84%)p1.71(63.00%)d0.00(0.17%) 1.268603545 - -0.335380231
28 BD(1)C15(N14) 15s(33.53%)p1.98(66.39%)d0.00(0.08%) 0.785019126 - -0.016296902
29 BD(1)N14(H58) 14s(27.13%)p2.68(72.75%)d0.00(0.12%) 1.413014193 - -0.340347360
30 BD(1)H58(N14) 58s(99.96%)p0.00(0.04%) 0.584559317 - 0.099951280
31 BD(1)C15(C16) 15s(33.83%)p1.95(66.11%)d0.00(0.06%) 0.976759842 - -0.127859515
32 BD(1)C16(C15) 16s(25.86%)p2.86(74.04%)d0.00(0.11%) 1.072189715 - -0.159401268
33 BD(1)C15(O57) 15s(24.32%)p3.11(75.58%)d0.00(0.11%) 0.727399540 - -0.030714314
34 BD(1)O57(C15) 57s(29.95%)p2.33(69.63%)d0.01(0.42%) 1.368683641 - -0.418193247
35 BD(2)C15(O57) 15s(8.24%)p11.11(91.62%)d0.02(0.14%) 0.755366961 - -0.079336145
36 BD(2)O57(C15) 57s(11.70%)p7.52(87.93%)d0.03(0.37%) 1.482994969 - -0.317290185
37 BD(1)C16(C17) 16s(30.98%)p2.23(68.96%)d0.00(0.06%) 1.012634018 - -0.125657659
38 BD(1)C17(C16) 17s(30.85%)p2.24(69.09%)d0.00(0.06%) 0.994152154 - -0.115316762
39 BD(1)C16(N28) 16s(22.45%)p3.45(77.47%)d0.00(0.08%) 0.768261553 - -0.080144274
40 BD(1)N28(C16) 28s(31.18%)p2.20(68.73%)d0.00(0.09%) 1.248265548 - -0.335489034
41 BD(1)C16(H56) 16s(20.80%)p3.80(79.10%)d0.00(0.10%) 1.216322391 - -0.153200437
42 BD(1)H56(C16) 56s(99.95%)p0.00(0.05%) 0.757065577 - 0.033695136
43 BD(1)C17(C18) 17s(34.47%)p1.90(65.46%)d0.00(0.07%) 1.012173726 - -0.078366427
44 BD(1)C18(C17) 18s(36.04%)p1.77(63.86%)d0.00(0.10%) 0.983041692 - -0.064106214
45 BD(2)C17(C18) 17s(0.02%)p99.99(99.96%)d1.67(0.03%) 1.039730274 - -0.122444485
46 BD(2)C18(C17) 18s(0.00%)p1.00(99.96%)d0.00(0.04%) 0.990678978 - -0.118098319
47 BD(1)C17(C22) 17s(34.59%)p1.89(65.34%)d0.00(0.08%) 1.013997531 - -0.080839641
48 BD(1)C22(C17) 22s(35.58%)p1.81(64.33%)d0.00(0.09%) 0.983327982 - -0.060188552
49 BD(1)C18(C19) 18s(35.72%)p1.80(64.18%)d0.00(0.10%) 1.004057685 - -0.074109609
50 BD(1)C19(C18) 19s(35.63%)p1.80(64.25%)d0.00(0.11%) 0.988659071 - -0.064742575
51 BD(1)C18(H27) 18s(28.10%)p2.56(71.85%)d0.00(0.05%) 1.209016487 - -0.138158135
52 BD(1)H27(C18) 27s(99.96%)p0.00(0.04%) 0.783921470 - 0.052351088
53 BD(1)C19(C20) 19s(35.72%)p1.80(64.17%)d0.00(0.11%) 0.999396992 - -0.069432794
54 BD(1)C20(C19) 20s(35.60%)p1.81(64.29%)d0.00(0.11%) 0.995826929 - -0.067085826
55 BD(2)C19(C20) 19s(0.00%)p1.00(99.97%)d0.00(0.03%) 0.992159179 - -0.116921826
56 BD(2)C20(C19) 20s(0.00%)p1.00(99.97%)d0.00(0.03%) 0.990245351 - -0.116874363
57 BD(1)C19(H26) 19s(28.50%)p2.51(71.45%)d0.00(0.04%) 1.209629783 - -0.136812774
58 BD(1)H26(C19) 26s(99.96%)p0.00(0.04%) 0.782783844 - 0.053452037
59 BD(1)C20(C21) 20s(35.59%)p1.81(64.31%)d0.00(0.11%) 0.996850577 - -0.067893862
60 BD(1)C21(C20) 21s(35.70%)p1.80(64.19%)d0.00(0.11%) 0.998827427 - -0.069530100
61 BD(1)C20(H25) 20s(28.68%)p2.48(71.27%)d0.00(0.05%) 1.209112951 - -0.136166039
62 BD(1)H25(C20) 25s(99.96%)p0.00(0.04%) 0.783963747 - 0.053927815
63 BD(1)C21(C22) 21s(35.76%)p1.79(64.13%)d0.00(0.11%) 0.989051706 - -0.063265557
64 BD(1)C22(C21) 22s(35.59%)p1.81(64.32%)d0.00(0.09%) 1.003951852 - -0.069658988
65 BD(2)C21(C22) 21s(0.00%)p1.00(99.97%)d0.00(0.03%) 0.991229292 - -0.116557894
66 BD(2)C22(C21) 22s(0.00%)p1.00(99.97%)d0.00(0.03%) 0.981619608 - -0.116186842
67 BD(1)C21(H24) 21s(28.40%)p2.52(71.55%)d0.00(0.04%) 1.208781577 - -0.135534651
68 BD(1)H24(C21) 24s(99.96%)p0.00(0.04%) 0.783983979 - 0.054121047
69 BD(1)C22(H23) 22s(28.72%)p2.48(71.21%)d0.00(0.07%) 1.224938667 - -0.134509359
70 BD(1)H23(C22) 23s(99.97%)p0.00(0.03%) 0.769287871 - 0.070524504
71 BD(1)N28(C29) 28s(32.18%)p2.11(67.75%)d0.00(0.07%) 1.262260554 - -0.342017107
72 BD(1)C29(N28) 29s(22.71%)p3.40(77.16%)d0.01(0.12%) 0.743038197 - -0.069684146
73 BD(1)N28(C43) 28s(35.79%)p1.79(64.08%)d0.00(0.13%) 1.285138104 - -0.352834313
74 BD(1)C43(N28) 43s(31.87%)p2.13(68.03%)d0.00(0.09%) 0.777845264 - -0.026563505
75 BD(1)C29(C30) 29s(30.80%)p2.24(69.12%)d0.00(0.08%) 1.002588415 - -0.120268322
76 BD(1)C30(C29) 30s(30.50%)p2.28(69.45%)d0.00(0.05%) 1.004925080 - -0.115901894
77 BD(1)C29(H41) 29s(23.51%)p3.25(76.39%)d0.00(0.10%) 1.218970881 - -0.158358012
78 BD(1)H41(C29) 41s(99.97%)p0.00(0.03%) 0.762001086 - 0.036013176
79 BD(1)C29(H42) 29s(23.03%)p3.34(76.87%)d0.00(0.10%) 1.209966881 - -0.154783235
80 BD(1)H42(C29) 42s(99.97%)p0.00(0.03%) 0.782569472 - 0.030552049
81 BD(1)C30(C31) 30s(34.98%)p1.86(64.95%)d0.00(0.07%) 1.014798905 - -0.073427291
82 BD(1)C31(C30) 31s(35.31%)p1.83(64.58%)d0.00(0.10%) 0.981923388 - -0.053537739
83 BD(2)C30(C31) 30s(0.00%)p1.00(99.96%)d0.00(0.03%) 1.003276885 - -0.111822795
84 BD(2)C31(C30) 31s(0.00%)p1.00(99.96%)d0.00(0.04%) 1.002383526 - -0.113061863
85 BD(1)C30(C35) 30s(34.43%)p1.90(65.50%)d0.00(0.08%) 1.013340753 - -0.073351694
86 BD(1)C35(C30) 35s(35.74%)p1.80(64.15%)d0.00(0.12%) 0.981637945 - -0.058462249
87 BD(1)C31(C32) 31s(35.59%)p1.81(64.32%)d0.00(0.09%) 1.003653831 - -0.065674866
88 BD(1)C32(C31) 32s(35.72%)p1.80(64.16%)d0.00(0.11%) 0.989517965 - -0.060587543
89 BD(1)C31(H40) 31s(29.00%)p2.45(70.93%)d0.00(0.07%) 1.231949398 - -0.132866837
90 BD(1)H40(C31) 40s(99.97%)p0.00(0.03%) 0.764806975 - 0.077450607
91 BD(1)C32(C33) 32s(35.80%)p1.79(64.09%)d0.00(0.11%) 0.998811994 - -0.064850581
92 BD(1)C33(C32) 33s(35.70%)p1.80(64.19%)d0.00(0.11%) 0.996803589 - -0.063105543
93 BD(2)C32(C33) 32s(0.00%)p1.00(99.97%)d0.00(0.03%) 0.992126885 - -0.112865851
94 BD(2)C33(C32) 33s(0.00%)p1.00(99.97%)d0.00(0.03%) 1.003974015 - -0.113847826
95 BD(1)C32(H39) 32s(28.34%)p2.53(71.62%)d0.00(0.04%) 1.206824396 - -0.131779942
96 BD(1)H39(C32) 39s(99.96%)p0.00(0.04%) 0.786284952 - 0.056109724
97 BD(1)C33(C34) 33s(35.51%)p1.81(64.38%)d0.00(0.11%) 0.996140106 - -0.064484651
98 BD(1)C34(C33) 34s(35.71%)p1.80(64.18%)d0.00(0.11%) 0.999132236 - -0.066411771
99 BD(1)C33(H38) 33s(28.67%)p2.49(71.29%)d0.00(0.04%) 1.207335363 - -0.132309412
100 BD(1)H38(C33) 38s(99.96%)p0.00(0.04%) 0.785925606 - 0.055768621
101 BD(1)C34(C35) 34s(35.71%)p1.80(64.18%)d0.00(0.11%) 0.989096723 - -0.060704783
102 BD(1)C35(C34) 35s(36.00%)p1.77(63.90%)d0.00(0.10%) 1.003503458 - -0.068331426
103 BD(2)C34(C35) 34s(0.00%)p1.00(99.97%)d0.00(0.03%) 0.993887845 - -0.114192554
104 BD(2)C35(C34) 35s(0.00%)p1.00(99.97%)d0.00(0.03%) 1.002797913 - -0.114465645
105 BD(1)C34(H37) 34s(28.45%)p2.51(71.51%)d0.00(0.04%) 1.207257800 - -0.133008385
106 BD(1)H37(C34) 37s(99.96%)p0.00(0.04%) 0.785481657 - 0.055082983
107 BD(1)C35(H36) 35s(28.12%)p2.55(71.83%)d0.00(0.05%) 1.206762840 - -0.134875330
108 BD(1)H36(C35) 36s(99.96%)p0.00(0.04%) 0.786126293 - 0.051871899
109 BD(1)C43(C44) 43s(36.43%)p1.74(63.52%)d0.00(0.05%) 0.994522942 - -0.118680975
110 BD(1)C44(C43) 44s(29.42%)p2.40(70.48%)d0.00(0.10%) 1.038267017 - -0.129004426
111 BD(1)C43(O55) 43s(26.77%)p2.73(73.12%)d0.00(0.11%) 0.721706740 - -0.024691065
112 BD(1)O55(C43) 55s(34.58%)p1.88(65.05%)d0.01(0.38%) 1.336111121 - -0.450004907
113 BD(2)C43(O55) 43s(4.90%)p19.37(94.91%)d0.04(0.19%) 0.764770764 - -0.101644732
114 BD(2)O55(C43) 55s(6.11%)p15.32(93.58%)d0.05(0.31%) 1.488733665 - -0.291175514
115 BD(1)C44(C45) 44s(35.61%)p1.81(64.32%)d0.00(0.07%) 1.019510179 - -0.086562668
116 BD(1)C45(C44) 45s(35.29%)p1.83(64.61%)d0.00(0.09%) 0.975307756 - -0.063741342
117 BD(2)C44(C45) 44s(0.01%)p99.99(99.97%)d1.50(0.02%) 1.038102160 - -0.121304865
118 BD(2)C45(C44) 45s(0.03%)p99.99(99.93%)d1.50(0.04%) 0.985455436 - -0.120240781
119 BD(1)C44(C49) 44s(34.87%)p1.87(65.06%)d0.00(0.07%) 1.020357961 - -0.084559004
120 BD(1)C49(C44) 49s(35.31%)p1.83(64.59%)d0.00(0.11%) 0.972749827 - -0.062643923
121 BD(1)C45(C46) 45s(35.93%)p1.78(63.97%)d0.00(0.09%) 1.004515110 - -0.073496157
122 BD(1)C46(C45) 46s(35.58%)p1.81(64.30%)d0.00(0.12%) 0.988812439 - -0.066939871
123 BD(1)C45(H54) 45s(28.63%)p2.49(71.31%)d0.00(0.07%) 1.216599222 - -0.140092345
124 BD(1)H54(C45) 54s(99.97%)p0.00(0.03%) 0.777075013 - 0.057938816
125 BD(1)C46(C47) 46s(35.72%)p1.80(64.17%)d0.00(0.11%) 0.999602336 - -0.071312091
126 BD(1)C47(C46) 47s(35.62%)p1.80(64.27%)d0.00(0.11%) 0.995915571 - -0.069044055
127 BD(2)C46(C47) 46s(0.00%)p1.00(99.97%)d0.00(0.03%) 0.991406441 - -0.118002702
128 BD(2)C47(C46) 47s(0.00%)p1.00(99.97%)d0.00(0.03%) 0.983073861 - -0.118182719
129 BD(1)C46(H53) 46s(28.56%)p2.50(71.39%)d0.00(0.04%) 1.210510055 - -0.138102085
130 BD(1)H53(C46) 53s(99.96%)p0.00(0.04%) 0.781841390 - 0.053254202
131 BD(1)C47(C48) 47s(35.58%)p1.81(64.31%)d0.00(0.11%) 0.996512810 - -0.069610520
132 BD(1)C48(C47) 48s(35.67%)p1.80(64.22%)d0.00(0.11%) 0.999070360 - -0.071169658
133 BD(1)C47(H52) 47s(28.68%)p2.49(71.27%)d0.00(0.05%) 1.209896750 - -0.137503996
134 BD(1)H52(C47) 52s(99.96%)p0.00(0.04%) 0.783140046 - 0.053058496
135 BD(1)C48(C49) 48s(35.62%)p1.80(64.26%)d0.00(0.12%) 0.990238044 - -0.066520615
136 BD(1)C49(C48) 49s(35.98%)p1.78(63.92%)d0.00(0.10%) 1.003022570 - -0.072387283
137 BD(2)C48(C49) 48s(0.00%)p1.00(99.96%)d0.00(0.03%) 0.992601695 - -0.118265652
138 BD(2)C49(C48) 49s(0.00%)p1.00(99.97%)d0.00(0.03%) 0.974720853 - -0.117458306
139 BD(1)C48(H51) 48s(28.58%)p2.50(71.38%)d0.00(0.04%) 1.210251425 - -0.137885590
140 BD(1)H51(C48) 51s(99.96%)p0.00(0.04%) 0.782179181 - 0.052955056
141 BD(1)C49(H50) 49s(28.58%)p2.50(71.37%)d0.00(0.05%) 1.214319282 - -0.139488926
142 BD(1)H50(C49) 50s(99.96%)p0.00(0.04%) 0.777620628 - 0.055321943
143 CR(1)C1 s(100.00%) 1.999237278 - -10.093833316
144 CR(1)C2 s(100.00%)p0.00(0.00%) 1.999256385 - -10.009446121
145 CR(1)C6 s(100.00%)p0.00(0.00%) 1.999256210 - -10.008826426
146 CR(1)C10 s(100.00%)p0.00(0.00%) 1.999267821 - -10.016788555
147 CR(1)N14 s(100.00%)p0.00(0.00%) 1.999219388 - -14.162228354
148 CR(1)C15 s(100.00%)p0.00(0.00%) 1.999273810 - -10.155830297
149 CR(1)C16 s(100.00%)p0.00(0.00%) 1.998989046 - -10.097957180
150 CR(1)C17 s(100.00%) 1.998971661 - -10.047064344
151 CR(1)C18 s(100.00%)p0.00(0.00%) 1.999029336 - -10.033761591
152 CR(1)C19 s(100.00%)p0.00(0.00%) 1.999146345 - -10.035341892
153 CR(1)C20 s(100.00%)p0.00(0.00%) 1.999151339 - -10.035267388
154 CR(1)C21 s(100.00%)p0.00(0.00%) 1.999150720 - -10.035255826
155 CR(1)C22 s(100.00%)p0.00(0.00%) 1.999014084 - -10.030183269
156 CR(1)N28 s(100.00%)p0.00(0.00%) 1.999237239 - -14.191385299
157 CR(1)C29 s(100.00%)p0.00(0.00%) 1.999127755 - -10.081207945
158 CR(1)C30 s(100.00%) 1.998984231 - -10.043877749
159 CR(1)C31 s(100.00%)p0.00(0.00%) 1.999019634 - -10.024685556
160 CR(1)C32 s(100.00%)p0.00(0.00%) 1.999152424 - -10.031466158
161 CR(1)C33 s(100.00%)p0.00(0.00%) 1.999149395 - -10.030448555
162 CR(1)C34 s(100.00%)p0.00(0.00%) 1.999153699 - -10.032344909
163 CR(1)C35 s(100.00%)p0.00(0.00%) 1.999039325 - -10.028974593
164 CR(1)C43 s(100.00%) 1.999138754 - -10.156475673
165 CR(1)C44 s(100.00%) 1.998905137 - -10.051349055
166 CR(1)C45 s(100.00%)p0.00(0.00%) 1.999043226 - -10.037655144
167 CR(1)C46 s(100.00%)p0.00(0.00%) 1.999147215 - -10.037114705
168 CR(1)C47 s(100.00%)p0.00(0.00%) 1.999153244 - -10.037762137
169 CR(1)C48 s(100.00%)p0.00(0.00%) 1.999150141 - -10.037027992
170 CR(1)C49 s(100.00%)p0.00(0.00%) 1.999052155 - -10.037204059
171 CR(1)O55 s(100.00%)p0.00(0.00%) 1.999757089 - -18.846550085
172 CR(1)O57 s(100.00%)p0.00(0.00%) 1.999743332 - -18.834877078
173 LP(1)N14 s(0.13%)p99.99(99.84%)d0.26(0.03%) 1.666864841 - -0.253425388
174 LP(1)N28 s(0.72%)p99.99(99.25%)d0.04(0.03%) 1.669269406 - -0.264019875
175 LP(1)O55 s(58.99%)p0.69(40.95%)d0.00(0.06%) 1.977603143 - -0.697918675
176 LP(2)O55 s(0.27%)p99.99(99.48%)d0.89(0.24%) 1.867586015 - -0.268540548
177 LP(1)O57 s(58.31%)p0.71(41.61%)d0.00(0.09%) 1.975660429 - -0.685545386
178 LP(2)O57 s(0.01%)p1.00(99.72%)d0.00(0.27%) 1.865948360 - -0.257966597
179 RY*(1)C1 s(2.00%)p47.45(95.03%)d1.48(2.96%) 0.006805676 - 0.930960859
180 RY*(2)C1 s(0.07%)p99.99(91.48%)d99.99(8.45%) 0.002675036 - 1.004521188
181 RY*(3)C1 s(5.59%)p15.25(85.25%)d1.64(9.16%) 0.001917237 - 0.876172371
182 RY*(4)C1 s(73.93%)p0.19(13.97%)d0.16(12.11%) 0.001649185 - 1.095945858
183 RY*(5)C1 s(1.02%)p6.29(6.39%)d91.19(92.59%) 0.000871719 - 2.857770995
184 RY*(6)C1 s(0.04%)p99.99(20.64%)d99.99(79.32%) 0.000792528 - 2.604763479
185 RY*(7)C1 s(0.18%)p83.63(15.13%)d99.99(84.69%) 0.000709619 - 2.759168388
186 RY*(8)C1 s(56.79%)p0.13(7.61%)d0.63(35.60%) 0.000560805 - 1.782038270
187 RY*(9)C1 s(1.39%)p36.75(51.14%)d34.11(47.47%) 0.000321288 - 2.619512603
188 RY*(10)C1 s(50.97%)p0.31(15.97%)d0.65(33.06%) 0.000210008 - 1.361601463
189 RY*(11)C1 s(0.44%)p99.99(71.08%)d64.19(28.47%) 0.000160426 - 1.485864105
190 RY*(12)C1 s(2.95%)p16.19(47.77%)d16.70(49.27%) 0.000108994 - 2.274962061
191 RY*(13)C1 s(3.28%)p12.17(39.88%)d17.35(56.84%) 0.000038003 - 2.859274812
192 RY*(14)C1 s(0.40%)p32.04(12.92%)d99.99(86.68%) 0.000041011 - 1.695325719
193 RY*(15)C1 s(93.63%)p0.00(0.40%)d0.06(5.97%) 0.000003947 - 22.150428036
194 RY*(16)C1 s(1.14%)p1.49(1.70%)d85.13(97.16%) 0.000003303 - 2.818201030
195 RY*(17)C1 s(2.24%)p21.15(47.29%)d22.58(50.48%) 0.000012211 - 2.823258797
196 RY*(18)C1 s(0.10%)p44.76(4.59%)d99.99(95.31%) 0.000005954 - 2.914384129
197 RY*(19)C1 s(1.34%)p68.11(91.00%)d5.73(7.66%) 0.000008645 - 1.904869125
198 RY*(20)C1 s(0.80%)p99.99(92.41%)d8.53(6.79%) 0.000008157 - 2.272859294
199 RY*(21)C1 s(1.67%)p1.04(1.73%)d57.90(96.60%) 0.000012640 - 2.127154250
200 RY*(22)C1 s(0.04%)p99.99(86.94%)d99.99(13.02%) 0.000005176 - 2.253886457
201 RY*(1)C2 s(0.42%)p99.99(94.85%)d11.39(4.74%) 0.002868865 - 0.737678338
202 RY*(2)C2 s(10.47%)p8.00(83.72%)d0.56(5.81%) 0.001674411 - 0.786900315
203 RY*(3)C2 s(25.36%)p2.60(66.04%)d0.34(8.61%) 0.000762077 - 0.773552185
204 RY*(4)C2 s(14.91%)p0.82(12.16%)d4.89(72.94%) 0.000371858 - 1.171050091
205 RY*(5)C2 s(12.13%)p2.56(31.05%)d4.68(56.82%) 0.000255189 - 1.036027777
206 RY*(6)C2 s(28.87%)p1.52(44.01%)d0.94(27.12%) 0.000184424 - 1.445475436
207 RY*(7)C2 s(7.24%)p5.48(39.68%)d7.34(53.08%) 0.000109675 - 1.769652922
208 RY*(8)C2 s(3.79%)p12.21(46.31%)d13.16(49.90%) 0.000079729 - 1.057748876
209 RY*(9)C2 s(2.08%)p6.79(14.09%)d40.39(83.83%) 0.000072262 - 1.120160905
210 RY*(10)C2 s(4.57%)p9.27(42.39%)d11.60(53.04%) 0.000034361 - 1.208682803
211 RY*(11)C2 s(12.65%)p3.28(41.50%)d3.63(45.85%) 0.000036921 - 0.876668019
212 RY*(12)C2 s(2.31%)p29.26(67.53%)d13.07(30.16%) 0.000018587 - 0.941381919
213 RY*(13)C2 s(7.25%)p10.99(79.62%)d1.81(13.13%) 0.000010950 - 2.518995757
214 RY*(14)C2 s(0.04%)p59.14(2.61%)d99.99(97.35%) 0.000001479 - 3.391406710
215 RY*(15)C2 s(99.19%)p0.01(0.64%)d0.00(0.16%) 0.000000240 - 23.121216409
216 RY*(16)C2 s(0.09%)p99.99(8.61%)d99.99(91.31%) 0.000004396 - 3.518262012
217 RY*(17)C2 s(0.31%)p99.99(93.07%)d21.57(6.62%) 0.000004083 - 2.861469990
218 RY*(18)C2 s(0.81%)p1.30(1.06%)d99.99(98.13%) 0.000000999 - 3.584144513
219 RY*(19)C2 s(63.39%)p0.47(29.89%)d0.11(6.72%) 0.000005212 - 0.607565864
220 RY*(20)C2 s(0.03%)p99.99(3.53%)d99.99(96.44%) 0.000003276 - 3.514242609
221 RY*(21)C2 s(4.15%)p20.94(86.89%)d2.16(8.96%) 0.000004476 - 2.561456603
222 RY*(22)C2 s(0.01%)p1.00(11.14%)d7.98(88.85%) 0.000004615 - 3.211611719
223 RY*(1)H3 s(96.40%)p0.04(3.60%) 0.000601793 - 1.254249038
224 RY*(2)H3 s(82.72%)p0.21(17.28%) 0.000234141 - 1.849830860
225 RY*(3)H3 s(0.14%)p99.99(99.86%) 0.000118424 - 2.050124008
226 RY*(4)H3 s(14.58%)p5.86(85.42%) 0.000094403 - 2.319880802
227 RY*(5)H3 s(6.18%)p15.17(93.82%) 0.000023785 - 2.541885627
228 RY*(1)H4 s(95.15%)p0.05(4.85%) 0.000484648 - 0.916520759
229 RY*(2)H4 s(79.07%)p0.26(20.93%) 0.000224893 - 2.004420105
230 RY*(3)H4 s(20.43%)p3.89(79.57%) 0.000125372 - 2.327692240
231 RY*(4)H4 s(0.52%)p99.99(99.48%) 0.000096744 - 2.028088621
232 RY*(5)H4 s(4.85%)p19.60(95.15%) 0.000017268 - 2.608825643
233 RY*(1)H5 s(98.48%)p0.02(1.52%) 0.000919041 - 1.261873100
234 RY*(2)H5 s(81.18%)p0.23(18.82%) 0.000192515 - 1.902287049
235 RY*(3)H5 s(10.22%)p8.79(89.78%) 0.000112262 - 2.212878177
236 RY*(4)H5 s(2.92%)p33.19(97.08%) 0.000113962 - 2.112395875
237 RY*(5)H5 s(7.22%)p12.85(92.78%) 0.000036868 - 2.550387948
238 RY*(1)C6 s(0.39%)p99.99(94.99%)d11.88(4.62%) 0.002895817 - 0.737523862
239 RY*(2)C6 s(9.04%)p9.42(85.12%)d0.65(5.84%) 0.001682522 - 0.790654702
240 RY*(3)C6 s(28.55%)p2.23(63.60%)d0.28(7.85%) 0.000853589 - 0.777843312
241 RY*(4)C6 s(14.50%)p0.74(10.79%)d5.15(74.71%) 0.000361071 - 1.167274957
242 RY*(5)C6 s(16.95%)p1.94(32.82%)d2.96(50.23%) 0.000259459 - 1.004267859
243 RY*(6)C6 s(24.12%)p1.89(45.54%)d1.26(30.34%) 0.000189774 - 1.450790236
244 RY*(7)C6 s(6.46%)p5.33(34.44%)d9.14(59.09%) 0.000105953 - 1.933153620
245 RY*(8)C6 s(1.41%)p22.94(32.29%)d47.10(66.30%) 0.000073136 - 1.038275214
246 RY*(9)C6 s(5.78%)p4.16(24.04%)d12.14(70.17%) 0.000077417 - 1.044929990
247 RY*(10)C6 s(0.30%)p99.99(47.00%)d99.99(52.71%) 0.000032563 - 1.336517164
248 RY*(11)C6 s(7.29%)p5.22(38.04%)d7.50(54.67%) 0.000038110 - 1.114055625
249 RY*(12)C6 s(2.70%)p20.78(56.21%)d15.19(41.09%) 0.000018566 - 1.702891338
250 RY*(13)C6 s(8.55%)p9.33(79.72%)d1.37(11.73%) 0.000011413 - 2.384382354
251 RY*(14)C6 s(0.02%)p99.99(8.72%)d99.99(91.26%) 0.000004380 - 3.117005211
252 RY*(15)C6 s(99.32%)p0.01(0.55%)d0.00(0.12%) 0.000000218 - 23.145842549
253 RY*(16)C6 s(0.27%)p54.34(14.69%)d99.99(85.04%) 0.000002646 - 3.376009196
254 RY*(17)C6 s(0.47%)p99.99(93.65%)d12.39(5.88%) 0.000007988 - 2.559908927
255 RY*(18)C6 s(0.07%)p99.99(13.82%)d99.99(86.11%) 0.000005023 - 3.250201149
256 RY*(19)C6 s(69.80%)p0.32(22.31%)d0.11(7.90%) 0.000006194 - 0.676556282
257 RY*(20)C6 s(0.07%)p52.79(3.71%)d99.99(96.22%) 0.000001151 - 3.584510295
258 RY*(21)C6 s(2.37%)p37.25(88.16%)d4.00(9.48%) 0.000005569 - 2.528676083
259 RY*(22)C6 s(1.63%)p6.25(10.17%)d54.18(88.20%) 0.000004615 - 3.187220967
260 RY*(1)H7 s(96.23%)p0.04(3.77%) 0.000581569 - 1.244623985
261 RY*(2)H7 s(80.80%)p0.24(19.20%) 0.000230744 - 1.879164907
262 RY*(3)H7 s(0.18%)p99.99(99.82%) 0.000118529 - 2.059769430
263 RY*(4)H7 s(16.15%)p5.19(83.85%) 0.000092758 - 2.314909994
264 RY*(5)H7 s(6.66%)p14.01(93.34%) 0.000023304 - 2.533430282
265 RY*(1)H8 s(98.32%)p0.02(1.68%) 0.000921122 - 1.325915644
266 RY*(2)H8 s(86.35%)p0.16(13.65%) 0.000214873 - 1.821445678
267 RY*(3)H8 s(8.76%)p10.42(91.24%) 0.000113041 - 2.235146103
268 RY*(4)H8 s(0.94%)p99.99(99.06%) 0.000116892 - 2.086469846
269 RY*(5)H8 s(5.65%)p16.68(94.35%) 0.000038944 - 2.598030450
270 RY*(1)H9 s(95.40%)p0.05(4.60%) 0.000477644 - 0.922297436
271 RY*(2)H9 s(77.03%)p0.30(22.97%) 0.000224079 - 1.995063446
272 RY*(3)H9 s(22.71%)p3.40(77.29%) 0.000126181 - 2.319709658
273 RY*(4)H9 s(0.38%)p99.99(99.62%) 0.000095706 - 2.027671265
274 RY*(5)H9 s(4.51%)p21.19(95.49%) 0.000016674 - 2.633976699
275 RY*(1)C10 s(0.00%)p1.00(94.79%)d0.05(5.21%) 0.002720886 - 0.742372760
276 RY*(2)C10 s(1.34%)p71.17(95.07%)d2.69(3.60%) 0.002222292 - 0.733519401
277 RY*(3)C10 s(44.56%)p1.01(44.88%)d0.24(10.56%) 0.000579194 - 0.898263673
278 RY*(4)C10 s(0.07%)p82.84(5.57%)d99.99(94.37%) 0.000323010 - 1.199507860
279 RY*(5)C10 s(27.32%)p1.46(40.02%)d1.20(32.67%) 0.000238949 - 0.775076074
280 RY*(6)C10 s(18.75%)p2.40(45.00%)d1.93(36.25%) 0.000166503 - 1.572905530
281 RY*(7)C10 s(0.01%)p1.00(49.14%)d1.03(50.85%) 0.000089322 - 0.806361346
282 RY*(8)C10 s(3.97%)p8.59(34.11%)d15.59(61.91%) 0.000072419 - 2.070987578
283 RY*(9)C10 s(4.00%)p2.70(10.80%)d21.32(85.21%) 0.000040732 - 1.328345672
284 RY*(10)C10 s(0.32%)p99.99(50.01%)d99.99(49.67%) 0.000048284 - 0.835277847
285 RY*(11)C10 s(62.81%)p0.02(1.45%)d0.57(35.75%) 0.000018264 - 1.291748161
286 RY*(12)C10 s(0.71%)p99.99(87.57%)d16.40(11.72%) 0.000015559 - 0.795042884
287 RY*(13)C10 s(12.49%)p6.18(77.16%)d0.83(10.35%) 0.000008600 - 2.077049433
288 RY*(14)C10 s(15.55%)p3.71(57.72%)d1.72(26.73%) 0.000012249 - 0.744066773
289 RY*(15)C10 s(99.42%)p0.00(0.42%)d0.00(0.16%) 0.000000526 - 22.946436052
290 RY*(16)C10 s(4.00%)p1.30(5.19%)d22.71(90.81%) 0.000005701 - 3.415832938
291 RY*(17)C10 s(0.29%)p99.99(92.53%)d24.34(7.17%) 0.000001283 - 3.091191460
292 RY*(18)C10 s(0.48%)p6.94(3.32%)d99.99(96.20%) 0.000000551 - 3.583436395
293 RY*(19)C10 s(1.89%)p46.55(88.20%)d5.23(9.90%) 0.000003872 - 2.792229943
294 RY*(20)C10 s(0.09%)p44.66(4.05%)d99.99(95.86%) 0.000002846 - 3.522394177
295 RY*(21)C10 s(0.40%)p18.15(7.31%)d99.99(92.29%) 0.000001716 - 3.271574722
296 RY*(22)C10 s(1.59%)p3.81(6.08%)d57.94(92.33%) 0.000002471 - 3.208396303
297 RY*(1)H11 s(96.62%)p0.03(3.38%) 0.000612729 - 1.122680365
298 RY*(2)H11 s(74.60%)p0.34(25.40%) 0.000229680 - 1.926281149
299 RY*(3)H11 s(4.33%)p22.12(95.67%) 0.000101808 - 2.020306059
300 RY*(4)H11 s(16.52%)p5.05(83.48%) 0.000082345 - 2.428699730
301 RY*(5)H11 s(7.96%)p11.57(92.04%) 0.000025128 - 2.462410173
302 RY*(1)H12 s(94.30%)p0.06(5.70%) 0.000383330 - 1.016559447
303 RY*(2)H12 s(72.54%)p0.38(27.46%) 0.000226336 - 1.923753264
304 RY*(3)H12 s(27.58%)p2.63(72.42%) 0.000113982 - 2.332739265
305 RY*(4)H12 s(0.30%)p99.99(99.70%) 0.000110155 - 2.010989971
306 RY*(5)H12 s(5.30%)p17.88(94.70%) 0.000015680 - 2.603158256
307 RY*(1)H13 s(96.59%)p0.04(3.41%) 0.000596350 - 1.216392097
308 RY*(2)H13 s(78.69%)p0.27(21.31%) 0.000241578 - 1.843709437
309 RY*(3)H13 s(5.04%)p18.85(94.96%) 0.000089534 - 2.257771016
310 RY*(4)H13 s(12.86%)p6.77(87.14%) 0.000096964 - 2.158645174
311 RY*(5)H13 s(6.83%)p13.64(93.17%) 0.000024695 - 2.497186840
312 RY*(1)N14 s(0.22%)p99.99(95.98%)d17.25(3.80%) 0.007190024 - 0.622002052
313 RY*(2)N14 s(8.30%)p9.91(82.30%)d1.13(9.40%) 0.004036957 - 1.264511205
314 RY*(3)N14 s(4.99%)p17.69(88.26%)d1.35(6.76%) 0.001414912 - 1.591497479
315 RY*(4)N14 s(21.79%)p2.87(62.47%)d0.72(15.74%) 0.001143096 - 1.337199732
316 RY*(5)N14 s(49.86%)p0.63(31.26%)d0.38(18.87%) 0.000861610 - 1.414959653
317 RY*(6)N14 s(30.29%)p1.85(56.06%)d0.45(13.65%) 0.000797276 - 1.265824122
318 RY*(7)N14 s(25.65%)p1.06(27.07%)d1.84(47.29%) 0.000672480 - 1.952431042
319 RY*(8)N14 s(1.97%)p43.11(84.98%)d6.62(13.05%) 0.000460616 - 1.304081670
320 RY*(9)N14 s(9.79%)p1.01(9.86%)d8.21(80.36%) 0.000267551 - 1.943182891
321 RY*(10)N14 s(2.44%)p3.19(7.77%)d36.84(89.80%) 0.000249316 - 2.052715847
322 RY*(11)N14 s(22.59%)p1.50(33.78%)d1.93(43.63%) 0.000160466 - 1.466852957
323 RY*(12)N14 s(7.99%)p0.50(4.01%)d11.01(88.00%) 0.000088966 - 3.440613862
324 RY*(13)N14 s(0.51%)p46.33(23.56%)d99.99(75.93%) 0.000061444 - 4.230087421
325 RY*(14)N14 s(3.34%)p4.32(14.44%)d24.58(82.21%) 0.000059545 - 1.821137667
326 RY*(15)N14 s(4.65%)p0.89(4.13%)d19.60(91.21%) 0.000054337 - 4.263332509
327 RY*(16)N14 s(0.23%)p99.99(52.59%)d99.99(47.18%) 0.000037552 - 4.114187867
328 RY*(17)N14 s(0.11%)p99.99(98.16%)d15.31(1.73%) 0.000004078 - 3.988606059
329 RY*(18)N14 s(0.02%)p29.70(0.74%)d99.99(99.24%) 0.000001486 - 4.768449703
330 RY*(19)N14 s(0.37%)p99.99(97.29%)d6.31(2.34%) 0.000007633 - 4.304273094
331 RY*(20)N14 s(2.10%)p1.02(2.14%)d45.58(95.76%) 0.000003664 - 4.691929666
332 RY*(21)N14 s(99.44%)p0.00(0.37%)d0.00(0.19%) 0.000000452 - 34.819463507
333 RY*(22)N14 s(3.51%)p6.55(23.01%)d20.91(73.48%) 0.000007039 - 4.385909232
334 RY*(1)C15 s(9.60%)p9.33(89.52%)d0.09(0.88%) 0.016312003 - 1.110691614
335 RY*(2)C15 s(7.26%)p11.85(86.00%)d0.93(6.74%) 0.005889484 - 1.336856610
336 RY*(3)C15 s(1.67%)p13.38(22.29%)d45.66(76.05%) 0.002913125 - 2.195436568
337 RY*(4)C15 s(12.73%)p3.01(38.38%)d3.84(48.89%) 0.002245676 - 2.021979923
338 RY*(5)C15 s(20.21%)p0.77(15.49%)d3.18(64.30%) 0.001787222 - 2.190587106
339 RY*(6)C15 s(27.54%)p1.72(47.46%)d0.91(25.01%) 0.001220557 - 1.599939832
340 RY*(7)C15 s(11.84%)p0.93(10.97%)d6.52(77.18%) 0.000453811 - 3.007323226
341 RY*(8)C15 s(6.39%)p2.27(14.48%)d12.38(79.13%) 0.000253050 - 2.372750703
342 RY*(9)C15 s(0.83%)p17.47(14.51%)d99.99(84.66%) 0.000228950 - 1.915772498
343 RY*(10)C15 s(1.90%)p3.03(5.75%)d48.66(92.36%) 0.000166628 - 2.742896184
344 RY*(11)C15 s(6.19%)p6.03(37.32%)d9.13(56.49%) 0.000112226 - 3.225960892
345 RY*(12)C15 s(0.64%)p44.07(28.08%)d99.99(71.28%) 0.000057082 - 1.931420474
346 RY*(13)C15 s(3.58%)p20.25(72.57%)d6.65(23.85%) 0.000062369 - 3.242224115
347 RY*(14)C15 s(7.49%)p2.44(18.30%)d9.91(74.21%) 0.000027426 - 4.562600570
348 RY*(15)C15 s(17.58%)p3.81(67.06%)d0.87(15.36%) 0.000034714 - 4.674590283
349 RY*(16)C15 s(11.94%)p2.14(25.58%)d5.23(62.48%) 0.000033561 - 4.411477749
350 RY*(17)C15 s(10.17%)p5.96(60.64%)d2.87(29.19%) 0.000034292 - 3.922802156
351 RY*(18)C15 s(26.93%)p1.21(32.61%)d1.50(40.45%) 0.000015169 - 6.851997755
352 RY*(19)C15 s(2.83%)p21.10(59.63%)d13.29(37.54%) 0.000013117 - 2.635648604
353 RY*(20)C15 s(2.03%)p40.60(82.44%)d7.65(15.53%) 0.000008022 - 2.192802540
354 RY*(21)C15 s(96.28%)p0.02(1.53%)d0.02(2.19%) 0.000003376 - 2.877740772
355 RY*(22)C15 s(14.45%)p4.82(69.69%)d1.10(15.86%) 0.000010578 - 4.265815048
356 RY*(1)C16 s(0.23%)p99.99(98.43%)d5.74(1.33%) 0.010481624 - 1.000291285
357 RY*(2)C16 s(0.49%)p99.99(94.62%)d10.07(4.89%) 0.005997859 - 0.925655103
358 RY*(3)C16 s(10.71%)p7.16(76.65%)d1.18(12.64%) 0.003142714 - 1.132293386
359 RY*(4)C16 s(64.32%)p0.22(14.08%)d0.34(21.59%) 0.001693194 - 1.741145223
360 RY*(5)C16 s(21.25%)p2.41(51.16%)d1.30(27.60%) 0.001271095 - 1.718034699
361 RY*(6)C16 s(21.82%)p2.38(52.02%)d1.20(26.17%) 0.000949352 - 1.563006490
362 RY*(7)C16 s(3.81%)p2.98(11.35%)d22.26(84.84%) 0.000769975 - 2.193023656
363 RY*(8)C16 s(23.10%)p1.98(45.62%)d1.35(31.28%) 0.000648048 - 2.682194420
364 RY*(9)C16 s(19.67%)p1.29(25.40%)d2.79(54.92%) 0.000536622 - 1.787691791
365 RY*(10)C16 s(3.68%)p2.68(9.87%)d23.47(86.45%) 0.000421642 - 1.859710780
366 RY*(11)C16 s(10.13%)p4.74(47.98%)d4.14(41.90%) 0.000344583 - 2.443385011
367 RY*(12)C16 s(0.38%)p87.41(32.80%)d99.99(66.83%) 0.000196216 - 2.772817158
368 RY*(13)C16 s(13.39%)p2.82(37.79%)d3.65(48.82%) 0.000191937 - 2.196255469
369 RY*(14)C16 s(1.80%)p16.16(29.04%)d38.48(69.16%) 0.000157880 - 2.730102714
370 RY*(15)C16 s(2.56%)p6.67(17.04%)d31.47(80.41%) 0.000102107 - 2.959592567
371 RY*(16)C16 s(3.82%)p9.20(35.16%)d15.96(61.02%) 0.000080852 - 2.336240809
372 RY*(17)C16 s(1.73%)p30.25(52.41%)d26.47(45.86%) 0.000041781 - 2.817885338
373 RY*(18)C16 s(1.49%)p13.59(20.24%)d52.54(78.27%) 0.000047970 - 2.635994354
374 RY*(19)C16 s(1.06%)p73.35(77.91%)d19.79(21.02%) 0.000028974 - 2.523392373
375 RY*(20)C16 s(1.60%)p7.50(11.97%)d54.15(86.43%) 0.000024509 - 3.283385338
376 RY*(21)C16 s(0.51%)p99.99(54.36%)d88.27(45.13%) 0.000023493 - 2.361947002
377 RY*(22)C16 s(92.37%)p0.05(4.53%)d0.03(3.10%) 0.000007674 - 19.893721286
378 RY*(1)C17 s(1.48%)p63.28(93.47%)d3.42(5.06%) 0.008001720 - 1.219535627
379 RY*(2)C17 s(0.36%)p99.99(97.04%)d7.18(2.60%) 0.003489217 - 1.086431818
380 RY*(3)C17 s(1.78%)p52.48(93.50%)d2.65(4.72%) 0.002439754 - 0.847911192
381 RY*(4)C17 s(9.59%)p6.42(61.55%)d3.01(28.86%) 0.001611820 - 1.137153392
382 RY*(5)C17 s(9.06%)p9.64(87.35%)d0.40(3.60%) 0.000997935 - 0.912875592
383 RY*(6)C17 s(14.12%)p4.11(58.01%)d1.97(27.87%) 0.000887580 - 1.159532819
384 RY*(7)C17 s(46.35%)p0.52(24.24%)d0.63(29.41%) 0.000693659 - 1.629214690
385 RY*(8)C17 s(10.59%)p2.64(27.90%)d5.81(61.52%) 0.000523328 - 3.301708278
386 RY*(9)C17 s(1.70%)p6.01(10.23%)d51.74(88.07%) 0.000436470 - 2.535856314
387 RY*(10)C17 s(1.72%)p21.76(37.40%)d35.42(60.88%) 0.000294407 - 2.780708903
388 RY*(11)C17 s(2.34%)p4.66(10.88%)d37.13(86.78%) 0.000178340 - 2.522584300
389 RY*(12)C17 s(0.82%)p10.92(8.93%)d99.99(90.25%) 0.000124555 - 2.831662883
390 RY*(13)C17 s(0.07%)p99.99(21.74%)d99.99(78.19%) 0.000104161 - 1.660159056
391 RY*(14)C17 s(0.03%)p99.99(8.39%)d99.99(91.59%) 0.000090822 - 2.487375615
392 RY*(15)C17 s(2.34%)p17.84(41.80%)d23.84(55.86%) 0.000063498 - 3.023011992
393 RY*(16)C17 s(0.77%)p82.75(64.06%)d45.41(35.16%) 0.000046988 - 3.726713959
394 RY*(17)C17 s(3.66%)p8.03(29.36%)d18.32(66.98%) 0.000027692 - 3.148631133
395 RY*(18)C17 s(3.88%)p4.30(16.68%)d20.46(79.43%) 0.000029276 - 2.894164634
396 RY*(19)C17 s(95.85%)p0.02(2.29%)d0.02(1.87%) 0.000001265 - 1.161070654
397 RY*(20)C17 s(0.18%)p99.99(96.11%)d20.43(3.71%) 0.000004695 - 3.135178331
398 RY*(21)C17 s(93.01%)p0.01(0.98%)d0.06(6.02%) 0.000008069 - 20.257220336
399 RY*(22)C17 s(0.39%)p21.09(8.26%)d99.99(91.35%) 0.000010377 - 3.545189595
400 RY*(1)C18 s(0.12%)p99.99(91.43%)d73.28(8.46%) 0.006327558 - 1.343089090
401 RY*(2)C18 s(0.06%)p99.99(96.33%)d61.25(3.61%) 0.002100249 - 1.126751944
402 RY*(3)C18 s(0.50%)p99.99(85.90%)d27.17(13.59%) 0.001328008 - 0.661232383
403 RY*(4)C18 s(46.12%)p0.12(5.71%)d1.04(48.18%) 0.000724129 - 1.890587995
404 RY*(5)C18 s(0.06%)p99.99(26.78%)d99.99(73.16%) 0.000513841 - 2.032363060
405 RY*(6)C18 s(6.91%)p5.04(34.85%)d8.43(58.24%) 0.000405137 - 2.664745314
406 RY*(7)C18 s(20.13%)p0.31(6.18%)d3.66(73.69%) 0.000320068 - 1.579152316
407 RY*(8)C18 s(10.41%)p2.40(24.95%)d6.21(64.64%) 0.000146117 - 2.493006887
408 RY*(9)C18 s(10.55%)p1.86(19.58%)d6.62(69.87%) 0.000066053 - 2.383924855
409 RY*(10)C18 s(6.41%)p10.85(69.54%)d3.75(24.06%) 0.000050940 - 2.442621618
410 RY*(11)C18 s(3.66%)p5.83(21.32%)d20.51(75.02%) 0.000058019 - 2.280685640
411 RY*(12)C18 s(0.99%)p51.46(51.03%)d48.37(47.98%) 0.000031803 - 2.032159219
412 RY*(13)C18 s(0.61%)p46.07(27.95%)d99.99(71.45%) 0.000030687 - 1.965064654
413 RY*(14)C18 s(7.99%)p10.40(83.04%)d1.12(8.98%) 0.000017386 - 4.071127373
414 RY*(15)C18 s(92.83%)p0.06(5.93%)d0.01(1.24%) 0.000003590 - 0.902081218
415 RY*(16)C18 s(0.42%)p6.48(2.75%)d99.99(96.83%) 0.000002978 - 3.438826085
416 RY*(17)C18 s(0.39%)p37.26(14.41%)d99.99(85.21%) 0.000003914 - 2.896617803
417 RY*(18)C18 s(0.21%)p99.99(90.06%)d45.80(9.73%) 0.000004398 - 2.920711763
418 RY*(19)C18 s(0.33%)p90.32(29.65%)d99.99(70.03%) 0.000009795 - 1.802357676
419 RY*(20)C18 s(0.79%)p69.75(55.09%)d55.86(44.12%) 0.000009985 - 2.010186142
420 RY*(21)C18 s(3.34%)p14.35(47.99%)d14.56(48.67%) 0.000012797 - 2.156508922
421 RY*(22)C18 s(87.32%)p0.11(9.69%)d0.03(2.99%) 0.000001732 - 18.953946967
422 RY*(1)C19 s(0.49%)p99.99(90.06%)d19.19(9.45%) 0.006548236 - 1.254239358
423 RY*(2)C19 s(0.12%)p99.99(99.77%)d0.95(0.11%) 0.002177068 - 1.281174704
424 RY*(3)C19 s(0.17%)p99.99(82.92%)d99.99(16.92%) 0.001027200 - 0.437208335
425 RY*(4)C19 s(53.28%)p0.07(3.59%)d0.81(43.13%) 0.000661500 - 2.106290460
426 RY*(5)C19 s(2.14%)p15.11(32.38%)d30.54(65.47%) 0.000410158 - 2.125348608
427 RY*(6)C19 s(0.02%)p99.99(2.38%)d99.99(97.60%) 0.000370551 - 2.823367877
428 RY*(7)C19 s(19.00%)p0.24(4.63%)d4.02(76.36%) 0.000119638 - 1.696771905
429 RY*(8)C19 s(17.81%)p1.84(32.75%)d2.78(49.44%) 0.000092014 - 4.295118660
430 RY*(9)C19 s(7.81%)p8.78(68.57%)d3.03(23.62%) 0.000058986 - 1.962793665
431 RY*(10)C19 s(2.26%)p7.31(16.50%)d36.03(81.25%) 0.000032859 - 2.983396621
432 RY*(11)C19 s(21.08%)p0.91(19.10%)d2.84(59.82%) 0.000034391 - 1.397048773
433 RY*(12)C19 s(0.56%)p99.99(71.25%)d50.14(28.18%) 0.000008830 - 1.271925532
434 RY*(13)C19 s(0.19%)p99.99(88.08%)d61.50(11.73%) 0.000003121 - 2.771929033
435 RY*(14)C19 s(1.80%)p5.55(9.99%)d49.04(88.21%) 0.000004559 - 1.976697153
436 RY*(15)C19 s(4.43%)p1.40(6.19%)d20.16(89.38%) 0.000005466 - 3.275163836
437 RY*(16)C19 s(2.99%)p5.43(16.22%)d27.04(80.79%) 0.000012907 - 2.232655381
438 RY*(17)C19 s(6.10%)p14.10(85.94%)d1.31(7.96%) 0.000009403 - 1.420783081
439 RY*(18)C19 s(6.92%)p10.43(72.19%)d3.02(20.89%) 0.000008014 - 2.961020520
440 RY*(19)C19 s(92.44%)p0.01(0.51%)d0.08(7.05%) 0.000002512 - 17.988290691
441 RY*(20)C19 s(0.61%)p62.13(38.11%)d99.89(61.27%) 0.000004587 - 2.421675664
442 RY*(21)C19 s(59.63%)p0.13(7.74%)d0.55(32.63%) 0.000007879 - 1.676548370
443 RY*(22)C19 s(0.31%)p99.99(51.27%)d99.99(48.41%) 0.000007548 - 2.133329887
444 RY*(1)C20 s(0.97%)p92.12(89.44%)d9.87(9.59%) 0.006268618 - 1.264835935
445 RY*(2)C20 s(0.00%)p1.00(99.78%)d0.00(0.22%) 0.002186002 - 1.305139093
446 RY*(3)C20 s(0.04%)p99.99(83.67%)d99.99(16.29%) 0.001045509 - 0.425227066
447 RY*(4)C20 s(45.35%)p0.08(3.68%)d1.12(50.97%) 0.000676117 - 1.979176387
448 RY*(5)C20 s(0.52%)p90.41(46.93%)d99.99(52.55%) 0.000569536 - 1.626668405
449 RY*(6)C20 s(0.10%)p5.56(0.58%)d99.99(99.31%) 0.000357560 - 3.004869270
450 RY*(7)C20 s(34.90%)p0.23(8.08%)d1.63(57.03%) 0.000125047 - 1.454257230
451 RY*(8)C20 s(17.19%)p1.78(30.57%)d3.04(52.24%) 0.000094749 - 4.305247264
452 RY*(9)C20 s(0.47%)p99.99(79.42%)d42.98(20.11%) 0.000052120 - 2.469736235
453 RY*(10)C20 s(2.01%)p12.36(24.85%)d36.39(73.14%) 0.000023534 - 2.837011749
454 RY*(11)C20 s(0.86%)p20.48(17.67%)d94.39(81.46%) 0.000033465 - 3.033102172
455 RY*(12)C20 s(28.05%)p1.27(35.70%)d1.29(36.24%) 0.000015853 - 1.828640514
456 RY*(13)C20 s(0.03%)p99.99(10.60%)d99.99(89.36%) 0.000001395 - 1.762415874
457 RY*(14)C20 s(92.71%)p0.01(0.81%)d0.07(6.49%) 0.000002564 - 17.706506894
458 RY*(15)C20 s(59.65%)p0.56(33.68%)d0.11(6.67%) 0.000004297 - 1.981572669
459 RY*(16)C20 s(0.34%)p4.55(1.56%)d99.99(98.10%) 0.000000310 - 3.281283435
460 RY*(17)C20 s(0.44%)p96.95(43.08%)d99.99(56.48%) 0.000002373 - 1.832643789
461 RY*(18)C20 s(2.82%)p32.14(90.63%)d2.32(6.55%) 0.000001575 - 2.640085325
462 RY*(19)C20 s(5.95%)p15.05(89.56%)d0.75(4.49%) 0.000009916 - 0.698590762
463 RY*(20)C20 s(2.30%)p3.55(8.16%)d38.91(89.54%) 0.000001566 - 3.077053951
464 RY*(21)C20 s(0.20%)p80.04(16.01%)d99.99(83.79%) 0.000001548 - 1.300221187
465 RY*(22)C20 s(5.22%)p16.42(85.72%)d1.74(9.06%) 0.000002767 - 2.470670587
466 RY*(1)C21 s(0.52%)p99.99(90.09%)d18.15(9.39%) 0.006505958 - 1.257380857
467 RY*(2)C21 s(0.06%)p99.99(99.69%)d3.95(0.25%) 0.002151017 - 1.304266766
468 RY*(3)C21 s(0.20%)p99.99(83.60%)d81.11(16.20%) 0.001045085 - 0.447488667
469 RY*(4)C21 s(51.48%)p0.10(5.06%)d0.84(43.46%) 0.000679720 - 2.107573826
470 RY*(5)C21 s(6.03%)p5.15(31.07%)d10.43(62.90%) 0.000385252 - 2.167423093
471 RY*(6)C21 s(0.26%)p23.22(5.94%)d99.99(93.80%) 0.000383016 - 2.615630381
472 RY*(7)C21 s(15.04%)p0.27(4.09%)d5.38(80.87%) 0.000130374 - 2.009887846
473 RY*(8)C21 s(18.71%)p2.55(47.66%)d1.80(33.62%) 0.000084127 - 4.791442819
474 RY*(9)C21 s(18.76%)p3.13(58.73%)d1.20(22.51%) 0.000046295 - 0.951713684
475 RY*(10)C21 s(18.04%)p1.06(19.15%)d3.48(62.81%) 0.000038078 - 1.667644144
476 RY*(11)C21 s(14.52%)p1.22(17.68%)d4.67(67.80%) 0.000035063 - 2.275231132
477 RY*(12)C21 s(2.11%)p21.78(45.93%)d24.65(51.97%) 0.000042630 - 2.793196745
478 RY*(13)C21 s(1.44%)p19.04(27.43%)d49.37(71.13%) 0.000005809 - 1.932108706
479 RY*(14)C21 s(0.50%)p21.50(10.82%)d99.99(88.68%) 0.000002561 - 2.816608977
480 RY*(15)C21 s(7.79%)p1.76(13.75%)d10.07(78.47%) 0.000008174 - 2.596762273
481 RY*(16)C21 s(5.92%)p3.19(18.88%)d12.71(75.20%) 0.000005923 - 3.309061723
482 RY*(17)C21 s(2.98%)p19.35(57.75%)d13.16(39.27%) 0.000011860 - 2.615581030
483 RY*(18)C21 s(45.06%)p0.98(44.28%)d0.24(10.66%) 0.000005750 - 0.914064788
484 RY*(19)C21 s(86.18%)p0.04(3.55%)d0.12(10.27%) 0.000001401 - 18.310515439
485 RY*(20)C21 s(1.07%)p54.20(58.22%)d37.91(40.71%) 0.000008587 - 1.509815169
486 RY*(21)C21 s(2.95%)p21.61(63.67%)d11.33(33.38%) 0.000006633 - 1.391501945
487 RY*(22)C21 s(0.52%)p99.99(93.13%)d12.14(6.35%) 0.000001966 - 2.777672108
488 RY*(1)C22 s(0.42%)p99.99(91.35%)d19.66(8.23%) 0.005813000 - 1.422557915
489 RY*(2)C22 s(0.07%)p99.99(95.86%)d55.90(4.06%) 0.002176007 - 1.205811887
490 RY*(3)C22 s(0.49%)p99.99(85.68%)d28.50(13.84%) 0.001256278 - 0.717144789
491 RY*(4)C22 s(47.91%)p0.14(6.56%)d0.95(45.53%) 0.000690869 - 1.905589015
492 RY*(5)C22 s(0.64%)p53.39(34.15%)d99.99(65.22%) 0.000551568 - 2.127706666
493 RY*(6)C22 s(3.95%)p8.94(35.30%)d15.39(60.75%) 0.000480686 - 2.368806772
494 RY*(7)C22 s(29.40%)p0.15(4.29%)d2.26(66.31%) 0.000301139 - 1.424174055
495 RY*(8)C22 s(8.99%)p1.21(10.87%)d8.92(80.14%) 0.000172345 - 2.273927791
496 RY*(9)C22 s(9.82%)p3.36(32.99%)d5.83(57.19%) 0.000089008 - 1.904363465
497 RY*(10)C22 s(0.81%)p37.31(30.34%)d84.65(68.85%) 0.000066126 - 1.913960934
498 RY*(11)C22 s(1.38%)p21.26(29.38%)d50.09(69.24%) 0.000044727 - 2.173336139
499 RY*(12)C22 s(8.21%)p8.34(68.45%)d2.84(23.33%) 0.000038401 - 2.434962353
500 RY*(13)C22 s(2.86%)p9.82(28.11%)d24.12(69.03%) 0.000024698 - 2.672504416
501 RY*(14)C22 s(1.54%)p58.40(89.77%)d5.65(8.69%) 0.000019477 - 1.127835562
502 RY*(15)C22 s(6.38%)p3.97(25.33%)d10.70(68.28%) 0.000018764 - 2.219396512
503 RY*(16)C22 s(0.15%)p75.21(11.31%)d99.99(88.54%) 0.000004154 - 3.499026563
504 RY*(17)C22 s(94.52%)p0.03(2.76%)d0.03(2.72%) 0.000002143 - 20.035275983
505 RY*(18)C22 s(1.42%)p16.76(23.80%)d52.66(74.78%) 0.000012083 - 2.602666538
506 RY*(19)C22 s(3.46%)p3.02(10.44%)d24.89(86.10%) 0.000003950 - 2.994425439
507 RY*(20)C22 s(72.13%)p0.20(14.35%)d0.19(13.52%) 0.000009676 - 1.389313669
508 RY*(21)C22 s(5.41%)p16.27(88.07%)d1.20(6.51%) 0.000010011 - 3.116435426
509 RY*(22)C22 s(0.15%)p99.99(81.01%)d99.99(18.84%) 0.000005442 - 3.081661866
510 RY*(1)H23 s(99.22%)p0.01(0.78%) 0.001350581 - 1.077709504
511 RY*(2)H23 s(92.28%)p0.08(7.72%) 0.000354163 - 2.474183893
512 RY*(3)H23 s(2.87%)p33.80(97.13%) 0.000193553 - 2.039164167
513 RY*(4)H23 s(0.64%)p99.99(99.36%) 0.000062174 - 2.876554898
514 RY*(5)H23 s(5.01%)p18.95(94.99%) 0.000045700 - 2.760218951
515 RY*(1)H24 s(99.69%)p0.00(0.31%) 0.000556472 - 1.180917246
516 RY*(2)H24 s(0.69%)p99.99(99.31%) 0.000204471 - 1.922525558
517 RY*(3)H24 s(94.99%)p0.05(5.01%) 0.000160905 - 2.037566902
518 RY*(4)H24 s(2.58%)p37.74(97.42%) 0.000043721 - 2.716051815
519 RY*(5)H24 s(2.09%)p46.94(97.91%) 0.000052286 - 2.647559087
520 RY*(1)H25 s(98.63%)p0.01(1.37%) 0.000432240 - 1.186655611
521 RY*(2)H25 s(1.62%)p60.69(98.38%) 0.000215044 - 1.924077269
522 RY*(3)H25 s(92.43%)p0.08(7.57%) 0.000161667 - 2.089397394
523 RY*(4)H25 s(0.01%)p1.00(99.99%) 0.000045835 - 2.553361315
524 RY*(5)H25 s(7.35%)p12.61(92.65%) 0.000042239 - 2.674630109
525 RY*(1)H26 s(99.35%)p0.01(0.65%) 0.000473855 - 1.231664548
526 RY*(2)H26 s(2.79%)p34.84(97.21%) 0.000209539 - 1.925363616
527 RY*(3)H26 s(89.26%)p0.12(10.74%) 0.000166638 - 2.041930422
528 RY*(4)H26 s(7.21%)p12.86(92.79%) 0.000043601 - 2.657508080
529 RY*(5)H26 s(1.42%)p69.28(98.58%) 0.000048762 - 2.581864920
530 RY*(1)H27 s(99.87%)p0.00(0.13%) 0.000567260 - 1.623232005
531 RY*(2)H27 s(0.19%)p99.99(99.81%) 0.000211894 - 1.971496497
532 RY*(3)H27 s(82.20%)p0.22(17.80%) 0.000115971 - 2.079556122
533 RY*(4)H27 s(17.30%)p4.78(82.70%) 0.000061161 - 2.502090247
534 RY*(5)H27 s(0.48%)p99.99(99.52%) 0.000039844 - 2.704438457
535 RY*(1)N28 s(0.44%)p99.99(98.53%)d2.32(1.03%) 0.008648095 - 0.897714566
536 RY*(2)N28 s(1.44%)p64.20(92.36%)d4.31(6.21%) 0.003329937 - 1.583964013
537 RY*(3)N28 s(13.75%)p5.63(77.48%)d0.64(8.77%) 0.002516068 - 1.267878156
538 RY*(4)N28 s(55.71%)p0.66(36.60%)d0.14(7.69%) 0.001525734 - 1.598415947
539 RY*(5)N28 s(26.51%)p2.38(63.11%)d0.39(10.37%) 0.000866779 - 1.627927652
540 RY*(6)N28 s(13.86%)p5.36(74.24%)d0.86(11.90%) 0.000782410 - 1.332615258
541 RY*(7)N28 s(4.73%)p17.55(83.02%)d2.59(12.25%) 0.000723259 - 1.430987583
542 RY*(8)N28 s(40.11%)p0.47(18.99%)d1.02(40.90%) 0.000404237 - 1.842615459
543 RY*(9)N28 s(10.06%)p1.88(18.86%)d7.07(71.08%) 0.000357600 - 2.283971019
544 RY*(10)N28 s(0.76%)p6.68(5.05%)d99.99(94.19%) 0.000220581 - 2.287615997
545 RY*(11)N28 s(0.69%)p9.24(6.40%)d99.99(92.90%) 0.000202594 - 2.381036466
546 RY*(12)N28 s(8.95%)p0.28(2.51%)d9.90(88.54%) 0.000121897 - 2.655055371
547 RY*(13)N28 s(5.70%)p3.25(18.52%)d13.31(75.78%) 0.000092045 - 3.873583489
548 RY*(14)N28 s(6.32%)p0.82(5.17%)d14.00(88.51%) 0.000101288 - 2.313516463
549 RY*(15)N28 s(1.82%)p3.19(5.82%)d50.64(92.36%) 0.000065273 - 4.554683922
550 RY*(16)N28 s(0.93%)p10.06(9.34%)d96.64(89.73%) 0.000049806 - 3.899490822
551 RY*(17)N28 s(4.99%)p4.85(24.21%)d14.19(70.80%) 0.000040582 - 4.064137209
552 RY*(18)N28 s(3.47%)p24.93(86.61%)d2.85(9.91%) 0.000016858 - 4.324704193
553 RY*(19)N28 s(2.04%)p34.42(70.27%)d13.56(27.69%) 0.000019695 - 3.800958700
554 RY*(20)N28 s(0.42%)p99.99(98.55%)d2.44(1.03%) 0.000003495 - 4.106253051
555 RY*(21)N28 s(97.28%)p0.02(2.23%)d0.00(0.49%) 0.000002018 - 33.940564121
556 RY*(22)N28 s(0.15%)p15.70(2.30%)d99.99(97.55%) 0.000003145 - 4.900400090
557 RY*(1)C29 s(0.90%)p99.99(95.19%)d4.33(3.90%) 0.005128657 - 0.917647245
558 RY*(2)C29 s(0.37%)p99.99(88.81%)d29.18(10.82%) 0.003065849 - 1.054975471
559 RY*(3)C29 s(0.03%)p99.99(91.60%)d99.99(8.37%) 0.001416778 - 0.959594319
560 RY*(4)C29 s(23.55%)p1.74(40.97%)d1.51(35.48%) 0.001252524 - 1.448685801
561 RY*(5)C29 s(0.69%)p99.99(79.49%)d28.84(19.83%) 0.000905259 - 1.217876047
562 RY*(6)C29 s(6.71%)p10.46(70.18%)d3.45(23.11%) 0.000673326 - 1.092165541
563 RY*(7)C29 s(19.99%)p2.73(54.53%)d1.27(25.48%) 0.000462569 - 1.318458718
564 RY*(8)C29 s(0.19%)p99.99(19.19%)d99.99(80.62%) 0.000438149 - 1.820688317
565 RY*(9)C29 s(37.18%)p0.27(10.00%)d1.42(52.82%) 0.000364315 - 2.034472246
566 RY*(10)C29 s(0.31%)p71.89(22.09%)d99.99(77.61%) 0.000158847 - 1.530844515
567 RY*(11)C29 s(2.17%)p14.17(30.81%)d30.83(67.02%) 0.000120220 - 1.851963945
568 RY*(12)C29 s(3.16%)p8.01(25.35%)d22.60(71.49%) 0.000089315 - 1.634395843
569 RY*(13)C29 s(5.07%)p7.27(36.85%)d11.47(58.09%) 0.000065652 - 3.601706609
570 RY*(14)C29 s(1.94%)p12.36(23.97%)d38.21(74.09%) 0.000069884 - 2.607012804
571 RY*(15)C29 s(3.79%)p14.57(55.24%)d10.81(40.97%) 0.000049118 - 3.599196677
572 RY*(16)C29 s(0.40%)p99.99(72.05%)d69.05(27.55%) 0.000023193 - 2.832947353
573 RY*(17)C29 s(5.46%)p1.57(8.56%)d15.76(85.98%) 0.000021758 - 3.523601684
574 RY*(18)C29 s(2.95%)p10.29(30.40%)d22.55(66.64%) 0.000025070 - 2.919258751
575 RY*(19)C29 s(2.89%)p6.79(19.64%)d26.76(77.47%) 0.000017959 - 2.853907672
576 RY*(20)C29 s(91.60%)p0.08(7.67%)d0.01(0.73%) 0.000002033 - 21.242819444
577 RY*(21)C29 s(1.05%)p12.44(13.00%)d82.24(85.95%) 0.000010488 - 3.663711710
578 RY*(22)C29 s(89.54%)p0.05(4.88%)d0.06(5.58%) 0.000004589 - 1.078176778
579 RY*(1)C30 s(2.80%)p32.37(90.73%)d2.31(6.47%) 0.006661666 - 1.306331886
580 RY*(2)C30 s(0.06%)p99.99(94.66%)d84.17(5.28%) 0.003548986 - 1.143778031
581 RY*(3)C30 s(1.07%)p83.94(89.72%)d8.62(9.21%) 0.001695308 - 0.777546346
582 RY*(4)C30 s(12.19%)p4.75(57.86%)d2.46(29.95%) 0.001627522 - 1.158356503
583 RY*(5)C30 s(0.02%)p99.99(74.46%)d99.99(25.52%) 0.001046516 - 1.086955412
584 RY*(6)C30 s(0.02%)p99.99(87.83%)d99.99(12.15%) 0.000825658 - 0.975608776
585 RY*(7)C30 s(15.25%)p1.50(22.87%)d4.06(61.88%) 0.000577468 - 2.940510437
586 RY*(8)C30 s(59.40%)p0.28(16.86%)d0.40(23.74%) 0.000389901 - 1.998628750
587 RY*(9)C30 s(0.50%)p28.40(14.15%)d99.99(85.36%) 0.000349360 - 2.388633856
588 RY*(10)C30 s(1.19%)p25.77(30.65%)d57.30(68.16%) 0.000261525 - 2.636533696
589 RY*(11)C30 s(5.74%)p4.22(24.23%)d12.19(70.02%) 0.000141113 - 1.608409556
590 RY*(12)C30 s(3.74%)p3.82(14.29%)d21.93(81.97%) 0.000095186 - 3.254619165
591 RY*(13)C30 s(1.73%)p12.59(21.81%)d44.14(76.46%) 0.000068313 - 2.753965197
592 RY*(14)C30 s(2.77%)p5.24(14.51%)d29.88(82.72%) 0.000070477 - 2.373501021
593 RY*(15)C30 s(5.82%)p10.86(63.20%)d5.32(30.98%) 0.000031948 - 4.086422585
594 RY*(16)C30 s(12.01%)p4.09(49.08%)d3.24(38.91%) 0.000028172 - 2.757370460
595 RY*(17)C30 s(0.47%)p99.99(94.57%)d10.45(4.95%) 0.000004561 - 2.971916399
596 RY*(18)C30 s(81.47%)p0.12(9.76%)d0.11(8.77%) 0.000012861 - 2.880623479
597 RY*(19)C30 s(0.87%)p12.79(11.15%)d99.99(87.97%) 0.000006558 - 3.650730223
598 RY*(20)C30 s(0.38%)p29.01(11.00%)d99.99(88.62%) 0.000011032 - 2.293883700
599 RY*(21)C30 s(91.61%)p0.03(2.66%)d0.06(5.73%) 0.000004667 - 18.286697387
600 RY*(22)C30 s(0.98%)p4.18(4.09%)d97.04(94.94%) 0.000013568 - 2.282127705
601 RY*(1)C31 s(0.07%)p99.99(92.29%)d99.99(7.65%) 0.005765586 - 1.436587888
602 RY*(2)C31 s(0.21%)p99.99(97.21%)d12.05(2.58%) 0.002057011 - 1.294428961
603 RY*(3)C31 s(0.33%)p99.99(79.11%)d61.64(20.55%) 0.001158190 - 0.701143645
604 RY*(4)C31 s(42.47%)p0.20(8.47%)d1.15(49.05%) 0.000757778 - 2.035104379
605 RY*(5)C31 s(0.19%)p99.99(43.92%)d99.99(55.89%) 0.000578174 - 1.893920335
606 RY*(6)C31 s(10.50%)p2.88(30.22%)d5.65(59.29%) 0.000468049 - 2.183393021
607 RY*(7)C31 s(1.81%)p6.87(12.46%)d47.27(85.72%) 0.000207138 - 2.303981534
608 RY*(8)C31 s(37.58%)p0.13(4.95%)d1.53(57.47%) 0.000216263 - 1.471867391
609 RY*(9)C31 s(5.85%)p6.19(36.23%)d9.90(57.92%) 0.000083360 - 1.521610846
610 RY*(10)C31 s(5.88%)p1.79(10.54%)d14.22(83.58%) 0.000063942 - 2.272224201
611 RY*(11)C31 s(4.23%)p12.90(54.63%)d9.72(41.14%) 0.000041551 - 2.165812860
612 RY*(12)C31 s(5.05%)p10.19(51.46%)d8.61(43.49%) 0.000039809 - 1.731689009
613 RY*(13)C31 s(4.47%)p19.34(86.53%)d2.01(9.00%) 0.000024317 - 1.251172850
614 RY*(14)C31 s(6.26%)p4.16(26.07%)d10.81(67.67%) 0.000030258 - 2.808889203
615 RY*(15)C31 s(2.52%)p35.19(88.82%)d3.43(8.66%) 0.000008084 - 3.094611707
616 RY*(16)C31 s(0.20%)p35.66(7.01%)d99.99(92.79%) 0.000008181 - 1.890860665
617 RY*(17)C31 s(0.89%)p99.99(92.87%)d7.00(6.24%) 0.000005291 - 2.988679969
618 RY*(18)C31 s(0.98%)p42.66(41.60%)d58.88(57.42%) 0.000011432 - 2.921578720
619 RY*(19)C31 s(69.61%)p0.31(21.57%)d0.13(8.83%) 0.000009764 - 1.312468723
620 RY*(20)C31 s(1.65%)p5.81(9.57%)d53.87(88.78%) 0.000003739 - 3.370901512
621 RY*(21)C31 s(97.84%)p0.01(1.42%)d0.01(0.74%) 0.000002712 - 20.774890523
622 RY*(22)C31 s(1.50%)p2.17(3.26%)d63.37(95.24%) 0.000003214 - 3.275017429
623 RY*(1)C32 s(0.39%)p99.99(90.57%)d22.95(9.03%) 0.006530785 - 1.264083506
624 RY*(2)C32 s(0.16%)p99.99(99.62%)d1.38(0.22%) 0.002186167 - 1.271198651
625 RY*(3)C32 s(0.04%)p99.99(83.93%)d99.99(16.03%) 0.001083712 - 0.433642972
626 RY*(4)C32 s(49.98%)p0.08(3.99%)d0.92(46.02%) 0.000697480 - 2.073777838
627 RY*(5)C32 s(7.55%)p4.32(32.58%)d7.93(59.87%) 0.000404620 - 2.104169129
628 RY*(6)C32 s(0.05%)p99.99(11.30%)d99.99(88.64%) 0.000412147 - 2.590574070
629 RY*(7)C32 s(16.16%)p0.29(4.65%)d4.90(79.20%) 0.000133419 - 2.037992990
630 RY*(8)C32 s(17.17%)p2.93(50.24%)d1.90(32.59%) 0.000081681 - 4.573383883
631 RY*(9)C32 s(9.11%)p4.42(40.29%)d5.56(50.61%) 0.000038996 - 1.340226137
632 RY*(10)C32 s(1.24%)p36.18(45.01%)d43.21(53.75%) 0.000038397 - 3.461098629
633 RY*(11)C32 s(4.80%)p12.86(61.69%)d6.99(33.51%) 0.000043608 - 1.102527690
634 RY*(12)C32 s(31.16%)p1.91(59.55%)d0.30(9.29%) 0.000043767 - 1.124642287
635 RY*(13)C32 s(4.87%)p5.21(25.41%)d14.31(69.72%) 0.000013533 - 3.493070232
636 RY*(14)C32 s(5.08%)p1.91(9.71%)d16.76(85.21%) 0.000006172 - 2.957708037
637 RY*(15)C32 s(2.08%)p13.08(27.14%)d34.10(70.78%) 0.000006915 - 1.747304770
638 RY*(16)C32 s(0.33%)p17.27(5.64%)d99.99(94.03%) 0.000003329 - 3.024274154
639 RY*(17)C32 s(3.50%)p10.34(36.21%)d17.21(60.29%) 0.000006858 - 1.387618116
640 RY*(18)C32 s(47.95%)p1.00(48.14%)d0.08(3.91%) 0.000006961 - 1.388989606
641 RY*(19)C32 s(88.31%)p0.03(2.86%)d0.10(8.83%) 0.000001807 - 17.461066123
642 RY*(20)C32 s(0.40%)p5.22(2.08%)d99.99(97.53%) 0.000007248 - 2.009317430
643 RY*(21)C32 s(0.74%)p99.99(86.11%)d17.72(13.14%) 0.000001792 - 2.787505321
644 RY*(22)C32 s(9.06%)p8.11(73.44%)d1.93(17.50%) 0.000006369 - 2.859451821
645 RY*(1)C33 s(1.07%)p83.43(89.50%)d8.79(9.43%) 0.006313763 - 1.264344898
646 RY*(2)C33 s(0.00%)p1.00(99.78%)d0.00(0.22%) 0.002190122 - 1.296884180
647 RY*(3)C33 s(0.06%)p99.99(84.78%)d99.99(15.16%) 0.001182977 - 0.385029175
648 RY*(4)C33 s(46.18%)p0.08(3.50%)d1.09(50.32%) 0.000664987 - 1.975326985
649 RY*(5)C33 s(0.05%)p99.99(46.83%)d99.99(53.12%) 0.000540748 - 1.696230391
650 RY*(6)C33 s(0.03%)p56.94(1.62%)d99.99(98.36%) 0.000363467 - 3.018948420
651 RY*(7)C33 s(36.25%)p0.34(12.49%)d1.41(51.26%) 0.000126471 - 1.634372594
652 RY*(8)C33 s(17.52%)p1.75(30.58%)d2.96(51.90%) 0.000100135 - 3.844580680
653 RY*(9)C33 s(1.37%)p48.81(66.81%)d23.25(31.82%) 0.000045820 - 2.663021083
654 RY*(10)C33 s(1.62%)p14.56(23.65%)d46.01(74.73%) 0.000032379 - 2.942768829
655 RY*(11)C33 s(2.19%)p10.83(23.69%)d33.90(74.12%) 0.000013021 - 2.141403524
656 RY*(12)C33 s(6.21%)p10.11(62.80%)d4.99(30.99%) 0.000009877 - 2.843848692
657 RY*(13)C33 s(6.37%)p5.85(37.25%)d8.85(56.38%) 0.000004417 - 1.702214377
658 RY*(14)C33 s(4.73%)p19.07(90.20%)d1.07(5.06%) 0.000013834 - 0.686515667
659 RY*(15)C33 s(1.72%)p8.65(14.87%)d48.52(83.42%) 0.000007087 - 1.783494721
660 RY*(16)C33 s(1.57%)p49.86(78.39%)d12.74(20.04%) 0.000001449 - 2.360156543
661 RY*(17)C33 s(0.47%)p99.99(86.74%)d27.12(12.79%) 0.000001477 - 2.495852780
662 RY*(18)C33 s(72.41%)p0.30(21.91%)d0.08(5.68%) 0.000006390 - 2.347713987
663 RY*(19)C33 s(1.96%)p5.52(10.83%)d44.42(87.20%) 0.000005064 - 1.844894015
664 RY*(20)C33 s(0.45%)p8.85(3.95%)d99.99(95.60%) 0.000001809 - 2.773660307
665 RY*(21)C33 s(96.30%)p0.01(0.85%)d0.03(2.85%) 0.000001407 - 17.531292811
666 RY*(22)C33 s(1.60%)p5.72(9.13%)d55.91(89.27%) 0.000003131 - 3.006891138
667 RY*(1)C34 s(0.40%)p99.99(89.97%)d23.82(9.62%) 0.006444882 - 1.255723400
668 RY*(2)C34 s(0.23%)p99.99(99.73%)d0.18(0.04%) 0.002187623 - 1.278330242
669 RY*(3)C34 s(0.17%)p99.99(79.85%)d99.99(19.99%) 0.000999893 - 0.464304272
670 RY*(4)C34 s(51.84%)p0.07(3.80%)d0.86(44.36%) 0.000674744 - 2.081415726
671 RY*(5)C34 s(2.45%)p14.43(35.40%)d25.33(62.14%) 0.000443689 - 1.959044925
672 RY*(6)C34 s(0.02%)p99.99(9.82%)d99.99(90.16%) 0.000400901 - 2.697801656
673 RY*(7)C34 s(21.58%)p0.20(4.33%)d3.43(74.08%) 0.000116296 - 1.638073311
674 RY*(8)C34 s(18.06%)p1.46(26.36%)d3.08(55.58%) 0.000091908 - 3.991797569
675 RY*(9)C34 s(2.45%)p34.56(84.81%)d5.19(12.74%) 0.000058343 - 2.140683378
676 RY*(10)C34 s(10.23%)p7.56(77.33%)d1.22(12.44%) 0.000029026 - 1.117503393
677 RY*(11)C34 s(10.03%)p0.83(8.31%)d8.14(81.66%) 0.000037198 - 2.978425396
678 RY*(12)C34 s(2.65%)p15.95(42.23%)d20.81(55.12%) 0.000012330 - 2.370310825
679 RY*(13)C34 s(11.45%)p5.17(59.24%)d2.56(29.31%) 0.000013091 - 4.187919993
680 RY*(14)C34 s(82.44%)p0.13(10.45%)d0.09(7.11%) 0.000000568 - 17.273991453
681 RY*(15)C34 s(71.17%)p0.19(13.63%)d0.21(15.19%) 0.000007103 - 1.436319908
682 RY*(16)C34 s(0.48%)p44.01(21.04%)d99.99(78.48%) 0.000005262 - 2.196513412
683 RY*(17)C34 s(3.26%)p22.11(72.18%)d7.52(24.55%) 0.000003864 - 3.004354179
684 RY*(18)C34 s(0.79%)p55.02(43.37%)d70.82(55.84%) 0.000000626 - 2.912850662
685 RY*(19)C34 s(0.35%)p56.64(19.76%)d99.99(79.89%) 0.000003432 - 1.658477623
686 RY*(20)C34 s(0.05%)p99.99(6.18%)d99.99(93.77%) 0.000001316 - 2.702995191
687 RY*(21)C34 s(8.18%)p4.50(36.85%)d6.72(54.96%) 0.000007053 - 1.624435816
688 RY*(22)C34 s(1.84%)p30.13(55.51%)d23.15(42.65%) 0.000006344 - 1.436654887
689 RY*(1)C35 s(0.10%)p99.99(91.79%)d85.32(8.11%) 0.006387091 - 1.320316394
690 RY*(2)C35 s(0.06%)p99.99(95.73%)d69.50(4.21%) 0.002103390 - 1.116880257
691 RY*(3)C35 s(0.21%)p99.99(77.11%)d99.99(22.69%) 0.001012258 - 0.681450810
692 RY*(4)C35 s(48.16%)p0.11(5.33%)d0.97(46.51%) 0.000735010 - 2.006019938
693 RY*(5)C35 s(0.13%)p99.99(27.35%)d99.99(72.52%) 0.000452322 - 2.081102019
694 RY*(6)C35 s(6.13%)p6.80(41.67%)d8.52(52.20%) 0.000400757 - 2.757958769
695 RY*(7)C35 s(20.08%)p0.54(10.93%)d3.44(68.99%) 0.000215705 - 1.543816375
696 RY*(8)C35 s(7.03%)p4.67(32.82%)d8.56(60.15%) 0.000125078 - 2.961972507
697 RY*(9)C35 s(2.73%)p5.33(14.55%)d30.33(82.72%) 0.000074095 - 1.358602905
698 RY*(10)C35 s(6.74%)p8.05(54.26%)d5.79(39.01%) 0.000039488 - 1.565608737
699 RY*(11)C35 s(12.67%)p2.06(26.11%)d4.83(61.22%) 0.000045539 - 2.737050709
700 RY*(12)C35 s(3.67%)p16.72(61.32%)d9.55(35.01%) 0.000045934 - 2.113744719
701 RY*(13)C35 s(77.36%)p0.15(11.87%)d0.14(10.76%) 0.000006649 - 1.053358628
702 RY*(14)C35 s(2.84%)p24.11(68.55%)d10.06(28.61%) 0.000016516 - 1.346608449
703 RY*(15)C35 s(6.58%)p10.28(67.62%)d3.92(25.80%) 0.000003826 - 3.588762547
704 RY*(16)C35 s(0.83%)p11.93(9.94%)d99.99(89.23%) 0.000002120 - 3.173687044
705 RY*(17)C35 s(7.56%)p6.75(51.06%)d5.47(41.38%) 0.000011246 - 2.948177829
706 RY*(18)C35 s(83.43%)p0.16(13.22%)d0.04(3.35%) 0.000002283 - 18.147150709
707 RY*(19)C35 s(1.19%)p14.22(16.88%)d69.01(81.93%) 0.000004413 - 3.129369774
708 RY*(20)C35 s(0.98%)p22.16(21.68%)d79.07(77.34%) 0.000009025 - 1.749407695
709 RY*(21)C35 s(7.87%)p10.23(80.55%)d1.47(11.58%) 0.000010378 - 3.207406976
710 RY*(22)C35 s(3.80%)p5.22(19.81%)d20.11(76.39%) 0.000007248 - 3.006238649
711 RY*(1)H36 s(99.71%)p0.00(0.29%) 0.000569289 - 1.575011314
712 RY*(2)H36 s(0.38%)p99.99(99.62%) 0.000211806 - 1.950568475
713 RY*(3)H36 s(83.40%)p0.20(16.60%) 0.000138330 - 1.941766620
714 RY*(4)H36 s(2.31%)p42.29(97.69%) 0.000046608 - 2.592449215
715 RY*(5)H36 s(14.24%)p6.02(85.76%) 0.000048004 - 2.544062872
716 RY*(1)H37 s(99.35%)p0.01(0.65%) 0.000464824 - 1.199962130
717 RY*(2)H37 s(0.41%)p99.99(99.59%) 0.000206826 - 1.921503972
718 RY*(3)H37 s(92.35%)p0.08(7.65%) 0.000168150 - 2.045007752
719 RY*(4)H37 s(5.70%)p16.55(94.30%) 0.000043676 - 2.648932688
720 RY*(5)H37 s(2.24%)p43.69(97.76%) 0.000048066 - 2.592541012
721 RY*(1)H38 s(98.64%)p0.01(1.36%) 0.000459824 - 1.166800721
722 RY*(2)H38 s(0.04%)p99.99(99.96%) 0.000205902 - 1.921713566
723 RY*(3)H38 s(94.42%)p0.06(5.58%) 0.000157861 - 2.101181705
724 RY*(4)H38 s(5.87%)p16.04(94.13%) 0.000042904 - 2.638193255
725 RY*(5)H38 s(1.07%)p92.87(98.93%) 0.000044084 - 2.596691420
726 RY*(1)H39 s(99.72%)p0.00(0.28%) 0.000518833 - 1.243430206
727 RY*(2)H39 s(0.03%)p99.99(99.97%) 0.000197719 - 1.922148672
728 RY*(3)H39 s(94.90%)p0.05(5.10%) 0.000150158 - 2.035416889
729 RY*(4)H39 s(0.03%)p99.99(99.97%) 0.000047775 - 2.591977546
730 RY*(5)H39 s(5.35%)p17.68(94.65%) 0.000044450 - 2.745942124
731 RY*(1)H40 s(98.78%)p0.01(1.22%) 0.001875710 - 0.992480850
732 RY*(2)H40 s(95.25%)p0.05(4.75%) 0.000368724 - 2.465607693
733 RY*(3)H40 s(0.21%)p99.99(99.79%) 0.000200608 - 2.049750244
734 RY*(4)H40 s(2.34%)p41.66(97.66%) 0.000054152 - 2.946502129
735 RY*(5)H40 s(3.44%)p28.08(96.56%) 0.000041520 - 2.666237571
736 RY*(1)H41 s(95.92%)p0.04(4.08%) 0.000639466 - 1.710063691
737 RY*(2)H41 s(2.30%)p42.47(97.70%) 0.000129015 - 2.215084963
738 RY*(3)H41 s(12.77%)p6.83(87.23%) 0.000103765 - 2.178804333
739 RY*(4)H41 s(65.11%)p0.54(34.89%) 0.000072508 - 1.779332276
740 RY*(5)H41 s(23.94%)p3.18(76.06%) 0.000049746 - 2.879508866
741 RY*(1)H42 s(97.24%)p0.03(2.76%) 0.000765107 - 1.681973817
742 RY*(2)H42 s(2.58%)p37.80(97.42%) 0.000122733 - 2.318167422
743 RY*(3)H42 s(22.98%)p3.35(77.02%) 0.000097786 - 2.030187926
744 RY*(4)H42 s(52.15%)p0.92(47.85%) 0.000062589 - 1.967202328
745 RY*(5)H42 s(25.08%)p2.99(74.92%) 0.000044316 - 2.836852569
746 RY*(1)C43 s(11.61%)p7.56(87.75%)d0.06(0.64%) 0.014591906 - 1.040378019
747 RY*(2)C43 s(3.14%)p28.37(89.20%)d2.44(7.66%) 0.006325282 - 1.219325649
748 RY*(3)C43 s(11.34%)p2.65(30.09%)d5.17(58.57%) 0.004000270 - 1.699778754
749 RY*(4)C43 s(1.82%)p10.20(18.58%)d43.69(79.60%) 0.003109936 - 2.103699104
750 RY*(5)C43 s(24.02%)p1.93(46.36%)d1.23(29.62%) 0.001864829 - 1.974636991
751 RY*(6)C43 s(55.60%)p0.41(22.92%)d0.39(21.48%) 0.001322285 - 1.439203469
752 RY*(7)C43 s(6.43%)p10.00(64.30%)d4.55(29.27%) 0.001121148 - 1.276611231
753 RY*(8)C43 s(27.14%)p1.37(37.17%)d1.31(35.69%) 0.000883329 - 1.469714990
754 RY*(9)C43 s(16.11%)p2.91(46.84%)d2.30(37.05%) 0.000735472 - 2.236072548
755 RY*(10)C43 s(15.55%)p2.56(39.74%)d2.88(44.71%) 0.000425557 - 2.036702156
756 RY*(11)C43 s(2.70%)p10.68(28.81%)d25.39(68.49%) 0.000365434 - 2.516511609
757 RY*(12)C43 s(0.84%)p76.41(63.92%)d42.13(35.24%) 0.000280044 - 1.939750847
758 RY*(13)C43 s(14.43%)p0.70(10.13%)d5.23(75.43%) 0.000148682 - 2.675369860
759 RY*(14)C43 s(2.22%)p13.32(29.52%)d30.80(68.26%) 0.000113770 - 2.319011491
760 RY*(15)C43 s(13.95%)p3.68(51.27%)d2.49(34.78%) 0.000078624 - 3.797364269
761 RY*(16)C43 s(4.66%)p11.74(54.76%)d8.70(40.57%) 0.000056079 - 3.251459435
762 RY*(17)C43 s(9.64%)p2.31(22.28%)d7.06(68.08%) 0.000055949 - 3.899113702
763 RY*(18)C43 s(10.08%)p2.64(26.63%)d6.28(63.30%) 0.000031859 - 4.262216157
764 RY*(19)C43 s(11.20%)p6.79(76.11%)d1.13(12.69%) 0.000015914 - 3.634643035
765 RY*(20)C43 s(51.16%)p0.37(18.88%)d0.59(29.96%) 0.000010680 - 12.306902307
766 RY*(21)C43 s(5.57%)p5.60(31.20%)d11.35(63.23%) 0.000014903 - 3.581292579
767 RY*(22)C43 s(0.81%)p4.90(3.96%)d99.99(95.23%) 0.000006268 - 3.647437569
768 RY*(1)C44 s(0.57%)p99.99(93.97%)d9.64(5.46%) 0.007539642 - 1.589333303
769 RY*(2)C44 s(1.06%)p88.43(93.71%)d4.93(5.23%) 0.004314567 - 1.065813637
770 RY*(3)C44 s(1.11%)p82.72(91.94%)d6.25(6.95%) 0.001460886 - 1.051753306
771 RY*(4)C44 s(84.79%)p0.06(5.27%)d0.12(9.94%) 0.001128272 - 1.196190037
772 RY*(5)C44 s(0.52%)p13.01(6.82%)d99.99(92.65%) 0.000850888 - 2.547637786
773 RY*(6)C44 s(2.92%)p7.37(21.54%)d25.85(75.54%) 0.000538964 - 3.048794310
774 RY*(7)C44 s(0.23%)p10.34(2.39%)d99.99(97.38%) 0.000483656 - 2.808984346
775 RY*(8)C44 s(1.66%)p5.16(8.59%)d53.97(89.75%) 0.000319635 - 2.723341643
776 RY*(9)C44 s(2.98%)p9.26(27.58%)d23.32(69.45%) 0.000250563 - 1.994191010
777 RY*(10)C44 s(3.97%)p6.51(25.86%)d17.65(70.16%) 0.000165708 - 2.307911179
778 RY*(11)C44 s(1.49%)p7.77(11.57%)d58.35(86.94%) 0.000115281 - 3.128077063
779 RY*(12)C44 s(0.64%)p99.59(63.54%)d56.13(35.82%) 0.000075419 - 1.925089167
780 RY*(13)C44 s(3.77%)p11.55(43.52%)d13.99(52.72%) 0.000055913 - 2.364427152
781 RY*(14)C44 s(3.92%)p15.38(60.26%)d9.14(35.82%) 0.000035907 - 2.669820576
782 RY*(15)C44 s(1.98%)p43.32(85.65%)d6.26(12.37%) 0.000021993 - 1.596856414
783 RY*(16)C44 s(0.34%)p34.00(11.40%)d99.99(88.27%) 0.000008799 - 3.177538596
784 RY*(17)C44 s(0.33%)p99.99(81.73%)d54.06(17.93%) 0.000008545 - 2.903490057
785 RY*(18)C44 s(0.18%)p25.76(4.52%)d99.99(95.30%) 0.000005506 - 3.362752634
786 RY*(19)C44 s(95.67%)p0.01(0.88%)d0.04(3.45%) 0.000006079 - 20.068031070
787 RY*(20)C44 s(0.14%)p99.99(92.72%)d49.41(7.14%) 0.000014194 - 1.506761009
788 RY*(21)C44 s(91.58%)p0.08(6.88%)d0.02(1.54%) 0.000008844 - 1.355839764
789 RY*(22)C44 s(0.24%)p99.99(59.82%)d99.99(39.94%) 0.000013775 - 2.639722883
790 RY*(1)C45 s(0.13%)p99.99(90.75%)d72.48(9.12%) 0.005924892 - 1.435202194
791 RY*(2)C45 s(0.22%)p99.99(97.41%)d10.79(2.37%) 0.002111670 - 1.222870245
792 RY*(3)C45 s(0.75%)p99.99(78.69%)d27.59(20.57%) 0.001003549 - 0.786463075
793 RY*(4)C45 s(38.60%)p0.27(10.26%)d1.32(51.14%) 0.000786152 - 2.143934822
794 RY*(5)C45 s(9.52%)p4.23(40.24%)d5.28(50.24%) 0.000548102 - 2.361499958
795 RY*(6)C45 s(0.05%)p99.99(27.05%)d99.99(72.90%) 0.000477176 - 2.054282328
796 RY*(7)C45 s(34.95%)p0.14(4.93%)d1.72(60.12%) 0.000236027 - 1.427144553
797 RY*(8)C45 s(8.43%)p1.17(9.83%)d9.69(81.73%) 0.000174641 - 2.575566067
798 RY*(9)C45 s(15.32%)p1.44(22.06%)d4.09(62.62%) 0.000095809 - 1.487950374
799 RY*(10)C45 s(3.07%)p18.02(55.34%)d13.54(41.59%) 0.000104257 - 2.139362419
800 RY*(11)C45 s(11.56%)p1.70(19.59%)d5.96(68.85%) 0.000057346 - 2.633781803
801 RY*(12)C45 s(3.19%)p28.86(92.19%)d1.45(4.62%) 0.000044287 - 1.669857634
802 RY*(13)C45 s(8.94%)p3.18(28.44%)d7.00(62.62%) 0.000040352 - 2.481315604
803 RY*(14)C45 s(2.17%)p26.03(56.61%)d18.95(41.21%) 0.000011911 - 2.643566730
804 RY*(15)C45 s(5.98%)p6.46(38.68%)d9.25(55.34%) 0.000008671 - 2.037371544
805 RY*(16)C45 s(7.22%)p3.75(27.05%)d9.11(65.73%) 0.000016860 - 1.944375892
806 RY*(17)C45 s(88.33%)p0.11(10.05%)d0.02(1.62%) 0.000002016 - 19.184184104
807 RY*(18)C45 s(0.29%)p14.14(4.11%)d99.99(95.60%) 0.000003152 - 3.448206238
808 RY*(19)C45 s(53.80%)p0.23(12.37%)d0.63(33.83%) 0.000010523 - 1.398927035
809 RY*(20)C45 s(4.02%)p20.28(81.59%)d3.58(14.39%) 0.000010677 - 3.136175144
810 RY*(21)C45 s(2.53%)p36.21(91.50%)d2.36(5.97%) 0.000010757 - 2.981330702
811 RY*(22)C45 s(1.04%)p1.36(1.42%)d93.39(97.54%) 0.000003102 - 3.189816705
812 RY*(1)C46 s(0.41%)p99.99(90.60%)d22.11(8.99%) 0.006457893 - 1.257274147
813 RY*(2)C46 s(0.11%)p99.99(99.75%)d1.25(0.14%) 0.002192944 - 1.257137790
814 RY*(3)C46 s(0.62%)p99.99(79.88%)d31.41(19.49%) 0.000900418 - 0.473373611
815 RY*(4)C46 s(53.45%)p0.10(5.09%)d0.78(41.46%) 0.000725098 - 2.000404154
816 RY*(5)C46 s(10.75%)p3.34(35.92%)d4.96(53.33%) 0.000429836 - 1.913616528
817 RY*(6)C46 s(0.20%)p33.33(6.65%)d99.99(93.15%) 0.000367170 - 2.758219236
818 RY*(7)C46 s(23.16%)p0.28(6.39%)d3.04(70.45%) 0.000138481 - 2.103059688
819 RY*(8)C46 s(24.68%)p1.48(36.64%)d1.57(38.68%) 0.000092484 - 3.917377304
820 RY*(9)C46 s(6.24%)p12.73(79.49%)d2.29(14.27%) 0.000045626 - 1.002864637
821 RY*(10)C46 s(2.11%)p27.61(58.27%)d18.77(39.62%) 0.000048962 - 1.380050043
822 RY*(11)C46 s(3.82%)p11.53(44.05%)d13.65(52.13%) 0.000036409 - 2.688311054
823 RY*(12)C46 s(14.66%)p2.88(42.24%)d2.94(43.10%) 0.000045124 - 2.395232180
824 RY*(13)C46 s(36.97%)p1.21(44.67%)d0.50(18.36%) 0.000024522 - 1.081971173
825 RY*(14)C46 s(9.09%)p2.08(18.91%)d7.92(72.01%) 0.000007573 - 2.698302963
826 RY*(15)C46 s(91.94%)p0.03(2.30%)d0.06(5.76%) 0.000001713 - 18.870085148
827 RY*(16)C46 s(1.62%)p6.70(10.88%)d53.89(87.49%) 0.000003154 - 1.661083162
828 RY*(17)C46 s(1.91%)p19.46(37.20%)d31.84(60.88%) 0.000006230 - 1.971221279
829 RY*(18)C46 s(0.28%)p54.86(15.55%)d99.99(84.17%) 0.000004388 - 2.952037980
830 RY*(19)C46 s(3.83%)p22.30(85.50%)d2.78(10.67%) 0.000005008 - 2.828751090
831 RY*(20)C46 s(12.13%)p6.44(78.18%)d0.80(9.69%) 0.000004403 - 2.922696356
832 RY*(21)C46 s(0.53%)p33.29(17.53%)d99.99(81.94%) 0.000006014 - 1.419779768
833 RY*(22)C46 s(1.62%)p2.77(4.48%)d58.11(93.90%) 0.000001113 - 2.769154184
834 RY*(1)C47 s(0.83%)p99.99(89.70%)d11.37(9.47%) 0.006345309 - 1.265492695
835 RY*(2)C47 s(0.00%)p1.00(99.59%)d0.00(0.40%) 0.002201295 - 1.317104109
836 RY*(3)C47 s(0.49%)p99.99(79.53%)d40.71(19.98%) 0.000868664 - 0.457703944
837 RY*(4)C47 s(20.85%)p1.41(29.43%)d2.39(49.72%) 0.000669983 - 1.668243351
838 RY*(5)C47 s(23.14%)p1.16(26.95%)d2.16(49.91%) 0.000638338 - 1.721674059
839 RY*(6)C47 s(0.67%)p0.76(0.51%)d99.99(98.81%) 0.000364376 - 2.982396622
840 RY*(7)C47 s(55.64%)p0.34(18.68%)d0.46(25.68%) 0.000155083 - 2.655819037
841 RY*(8)C47 s(31.20%)p0.11(3.59%)d2.09(65.22%) 0.000117059 - 1.820057600
842 RY*(9)C47 s(0.19%)p99.99(83.65%)d83.45(16.16%) 0.000057920 - 2.564198908
843 RY*(10)C47 s(19.89%)p2.52(50.18%)d1.50(29.93%) 0.000042065 - 1.549835941
844 RY*(11)C47 s(0.53%)p28.77(15.22%)d99.99(84.25%) 0.000030919 - 2.891891652
845 RY*(12)C47 s(13.45%)p1.61(21.70%)d4.82(64.86%) 0.000011123 - 2.671321719
846 RY*(13)C47 s(25.67%)p0.19(4.86%)d2.71(69.47%) 0.000002827 - 2.837418768
847 RY*(14)C47 s(92.32%)p0.07(6.76%)d0.01(0.93%) 0.000000733 - 19.778042641
848 RY*(15)C47 s(1.45%)p28.40(41.28%)d39.39(57.26%) 0.000003760 - 1.296239740
849 RY*(16)C47 s(2.78%)p7.30(20.33%)d27.62(76.88%) 0.000002622 - 2.618299046
850 RY*(17)C47 s(1.44%)p55.17(79.52%)d13.21(19.04%) 0.000001963 - 1.862098494
851 RY*(18)C47 s(7.23%)p4.08(29.51%)d8.75(63.26%) 0.000007864 - 3.066003193
852 RY*(19)C47 s(0.45%)p85.55(38.28%)d99.99(61.27%) 0.000004884 - 1.426964957
853 RY*(20)C47 s(0.92%)p64.97(59.78%)d42.71(39.30%) 0.000008779 - 1.448735673
854 RY*(21)C47 s(0.04%)p99.99(98.58%)d36.18(1.38%) 0.000000443 - 2.703733671
855 RY*(22)C47 s(0.94%)p2.71(2.55%)d99.99(96.51%) 0.000002709 - 1.487659797
856 RY*(1)C48 s(0.55%)p99.99(89.87%)d17.43(9.58%) 0.006392182 - 1.251789673
857 RY*(2)C48 s(0.04%)p99.99(99.86%)d2.51(0.10%) 0.002152112 - 1.304917433
858 RY*(3)C48 s(1.57%)p49.35(77.44%)d13.38(20.99%) 0.000841972 - 0.482392034
859 RY*(4)C48 s(47.82%)p0.21(10.00%)d0.88(42.18%) 0.000704256 - 1.908016912
860 RY*(5)C48 s(5.28%)p7.12(37.63%)d10.80(57.09%) 0.000491391 - 1.908026558
861 RY*(6)C48 s(0.11%)p22.45(2.49%)d99.99(97.40%) 0.000361245 - 2.808672118
862 RY*(7)C48 s(41.30%)p0.57(23.64%)d0.85(35.06%) 0.000117145 - 3.863018521
863 RY*(8)C48 s(24.51%)p0.32(7.85%)d2.76(67.65%) 0.000117182 - 1.573686127
864 RY*(9)C48 s(25.80%)p0.69(17.93%)d2.18(56.27%) 0.000044107 - 1.526389005
865 RY*(10)C48 s(12.09%)p5.29(63.94%)d1.98(23.97%) 0.000042999 - 1.031810960
866 RY*(11)C48 s(7.68%)p3.70(28.38%)d8.33(63.94%) 0.000039397 - 2.501940785
867 RY*(12)C48 s(4.00%)p20.42(81.77%)d3.55(14.22%) 0.000042007 - 1.940218430
868 RY*(13)C48 s(0.71%)p62.01(43.94%)d78.12(55.35%) 0.000010293 - 1.257314906
869 RY*(14)C48 s(1.49%)p48.40(72.19%)d17.65(26.32%) 0.000016141 - 1.455384036
870 RY*(15)C48 s(4.19%)p20.57(86.28%)d2.27(9.52%) 0.000002993 - 2.763999896
871 RY*(16)C48 s(3.04%)p29.60(89.98%)d2.30(6.98%) 0.000002772 - 2.852646853
872 RY*(17)C48 s(3.32%)p8.30(27.57%)d20.82(69.11%) 0.000009653 - 2.028868596
873 RY*(18)C48 s(11.03%)p1.14(12.60%)d6.92(76.37%) 0.000007863 - 3.009821793
874 RY*(19)C48 s(93.97%)p0.02(2.24%)d0.04(3.79%) 0.000001847 - 19.585069687
875 RY*(20)C48 s(10.29%)p1.43(14.77%)d7.28(74.94%) 0.000004722 - 2.514211766
876 RY*(21)C48 s(0.80%)p11.14(8.96%)d99.99(90.23%) 0.000001222 - 1.758538273
877 RY*(22)C48 s(0.52%)p1.65(0.86%)d99.99(98.61%) 0.000000658 - 2.932511672
878 RY*(1)C49 s(0.11%)p99.99(91.46%)d73.50(8.42%) 0.006175968 - 1.371110794
879 RY*(2)C49 s(0.22%)p99.99(95.89%)d18.08(3.90%) 0.002367452 - 1.114904606
880 RY*(3)C49 s(1.05%)p78.08(82.08%)d16.05(16.87%) 0.001020567 - 0.727841829
881 RY*(4)C49 s(54.74%)p0.10(5.65%)d0.72(39.62%) 0.000746077 - 1.907211210
882 RY*(5)C49 s(9.82%)p4.27(41.95%)d4.91(48.23%) 0.000578763 - 2.090569131
883 RY*(6)C49 s(0.18%)p99.99(20.09%)d99.99(79.73%) 0.000468942 - 2.121367142
884 RY*(7)C49 s(16.52%)p0.78(12.92%)d4.27(70.56%) 0.000344371 - 1.590308539
885 RY*(8)C49 s(5.86%)p8.11(47.52%)d7.96(46.62%) 0.000158741 - 2.496687907
886 RY*(9)C49 s(2.44%)p14.97(36.56%)d24.98(60.99%) 0.000097777 - 1.750948947
887 RY*(10)C49 s(13.00%)p3.31(43.05%)d3.38(43.96%) 0.000067542 - 2.104469862
888 RY*(11)C49 s(2.43%)p24.33(59.23%)d15.75(38.34%) 0.000047054 - 1.162306160
889 RY*(12)C49 s(10.56%)p6.01(63.52%)d2.45(25.92%) 0.000047129 - 3.547549244
890 RY*(13)C49 s(1.97%)p11.71(23.11%)d37.97(74.92%) 0.000028977 - 2.999976980
891 RY*(14)C49 s(22.79%)p1.07(24.34%)d2.32(52.87%) 0.000024347 - 1.796681234
892 RY*(15)C49 s(48.55%)p0.47(22.68%)d0.59(28.77%) 0.000007982 - 1.058936370
893 RY*(16)C49 s(7.68%)p10.39(79.74%)d1.64(12.59%) 0.000012848 - 2.972428986
894 RY*(17)C49 s(3.53%)p23.92(84.47%)d3.40(12.00%) 0.000007197 - 3.274483608
895 RY*(18)C49 s(4.81%)p0.25(1.21%)d19.55(93.98%) 0.000001768 - 3.398408070
896 RY*(19)C49 s(83.43%)p0.12(10.21%)d0.08(6.36%) 0.000001331 - 17.824599026
897 RY*(20)C49 s(5.24%)p6.66(34.92%)d11.41(59.84%) 0.000008965 - 3.290270474
898 RY*(21)C49 s(2.46%)p6.93(17.05%)d32.74(80.49%) 0.000010392 - 1.928707790
899 RY*(22)C49 s(2.75%)p0.92(2.52%)d34.50(94.74%) 0.000002077 - 3.239027571
900 RY*(1)H50 s(99.42%)p0.01(0.58%) 0.000586268 - 1.699222101
901 RY*(2)H50 s(5.86%)p16.06(94.14%) 0.000208804 - 1.963438059
902 RY*(3)H50 s(82.28%)p0.22(17.72%) 0.000147634 - 1.832045479
903 RY*(4)H50 s(11.85%)p7.44(88.15%) 0.000049535 - 2.570922700
904 RY*(5)H50 s(0.63%)p99.99(99.37%) 0.000040595 - 2.677873606
905 RY*(1)H51 s(98.93%)p0.01(1.07%) 0.000501300 - 1.179023996
906 RY*(2)H51 s(0.03%)p99.99(99.97%) 0.000198076 - 1.918685862
907 RY*(3)H51 s(92.35%)p0.08(7.65%) 0.000166482 - 2.114209929
908 RY*(4)H51 s(0.20%)p99.99(99.80%) 0.000052249 - 2.560764724
909 RY*(5)H51 s(8.53%)p10.72(91.47%) 0.000040098 - 2.669257082
910 RY*(1)H52 s(97.79%)p0.02(2.21%) 0.000443851 - 1.182703739
911 RY*(2)H52 s(0.39%)p99.99(99.61%) 0.000198290 - 1.918072964
912 RY*(3)H52 s(92.90%)p0.08(7.10%) 0.000165378 - 2.140862375
913 RY*(4)H52 s(0.02%)p99.99(99.98%) 0.000047700 - 2.551741496
914 RY*(5)H52 s(8.95%)p10.18(91.05%) 0.000035220 - 2.632069174
915 RY*(1)H53 s(99.39%)p0.01(0.61%) 0.000524956 - 1.210229797
916 RY*(2)H53 s(1.67%)p58.77(98.33%) 0.000201592 - 1.921917045
917 RY*(3)H53 s(93.05%)p0.07(6.95%) 0.000157766 - 2.066041211
918 RY*(4)H53 s(0.60%)p99.99(99.40%) 0.000043614 - 2.618198412
919 RY*(5)H53 s(5.33%)p17.74(94.67%) 0.000047624 - 2.696867330
920 RY*(1)H54 s(98.63%)p0.01(1.37%) 0.001414215 - 0.777301141
921 RY*(2)H54 s(87.68%)p0.14(12.32%) 0.000330415 - 2.385096918
922 RY*(3)H54 s(9.47%)p9.56(90.53%) 0.000187786 - 2.066481942
923 RY*(4)H54 s(3.36%)p28.78(96.64%) 0.000046037 - 2.967261364
924 RY*(5)H54 s(0.88%)p99.99(99.12%) 0.000045666 - 2.617836194
925 RY*(1)O55 s(1.00%)p96.29(96.69%)d2.30(2.31%) 0.002267083 - 0.892070742
926 RY*(2)O55 s(0.23%)p99.99(97.23%)d11.28(2.54%) 0.001792839 - 0.672327309
927 RY*(3)O55 s(7.70%)p11.84(91.10%)d0.16(1.21%) 0.001206845 - 0.512284085
928 RY*(4)O55 s(6.27%)p13.32(83.49%)d1.63(10.24%) 0.000202782 - 1.252897129
929 RY*(5)O55 s(8.08%)p7.23(58.40%)d4.15(33.52%) 0.000196593 - 1.953835026
930 RY*(6)O55 s(22.18%)p2.03(44.92%)d1.48(32.90%) 0.000175388 - 2.345455720
931 RY*(7)O55 s(52.91%)p0.44(23.17%)d0.45(23.92%) 0.000122009 - 2.282179345
932 RY*(8)O55 s(3.19%)p23.19(73.92%)d7.18(22.90%) 0.000101657 - 1.779163256
933 RY*(9)O55 s(1.45%)p14.12(20.53%)d53.66(78.02%) 0.000084268 - 2.623907520
934 RY*(10)O55 s(2.90%)p2.21(6.39%)d31.31(90.71%) 0.000065811 - 2.022090993
935 RY*(11)O55 s(77.98%)p0.13(10.38%)d0.15(11.64%) 0.000022563 - 1.500816490
936 RY*(12)O55 s(1.08%)p8.62(9.29%)d83.08(89.63%) 0.000016236 - 2.036799191
937 RY*(13)O55 s(5.87%)p14.87(87.27%)d1.17(6.87%) 0.000002590 - 4.994069667
938 RY*(14)O55 s(0.38%)p2.87(1.10%)d99.99(98.52%) 0.000001920 - 6.912053089
939 RY*(15)O55 s(99.92%)p0.00(0.05%)d0.00(0.03%) 0.000000111 - 49.354133362
940 RY*(16)O55 s(0.75%)p2.35(1.75%)d99.99(97.50%) 0.000001589 - 6.725171741
941 RY*(17)O55 s(1.06%)p5.34(5.64%)d88.37(93.30%) 0.000009800 - 1.963365928
942 RY*(18)O55 s(0.72%)p1.79(1.28%)d99.99(98.00%) 0.000001640 - 6.751241357
943 RY*(19)O55 s(5.02%)p17.68(88.69%)d1.26(6.30%) 0.000009687 - 5.159177823
944 RY*(20)O55 s(1.09%)p1.99(2.17%)d88.65(96.73%) 0.000002703 - 6.290063429
945 RY*(21)O55 s(0.14%)p99.99(96.96%)d21.17(2.91%) 0.000002556 - 4.958182828
946 RY*(22)O55 s(0.15%)p3.49(0.54%)d99.99(99.31%) 0.000000670 - 6.804541687
947 RY*(1)H56 s(96.35%)p0.04(3.65%) 0.001237502 - 0.956276309
948 RY*(2)H56 s(90.58%)p0.10(9.42%) 0.000205509 - 2.329910937
949 RY*(3)H56 s(2.96%)p32.74(97.04%) 0.000136743 - 2.495334693
950 RY*(4)H56 s(7.45%)p12.43(92.55%) 0.000087751 - 2.582996178
951 RY*(5)H56 s(2.71%)p35.84(97.29%) 0.000025380 - 3.157896194
952 RY*(1)O57 s(0.58%)p99.99(97.46%)d3.40(1.96%) 0.002332579 - 1.061807800
953 RY*(2)O57 s(0.23%)p99.99(97.50%)d9.84(2.27%) 0.001695916 - 0.770332525
954 RY*(3)O57 s(5.04%)p18.27(92.14%)d0.56(2.82%) 0.000425892 - 0.798728836
955 RY*(4)O57 s(12.91%)p2.10(27.13%)d4.64(59.96%) 0.000166594 - 2.029907989
956 RY*(5)O57 s(68.96%)p0.26(17.60%)d0.19(13.44%) 0.000150843 - 2.344856971
957 RY*(6)O57 s(3.59%)p6.35(22.77%)d20.52(73.64%) 0.000100910 - 1.871905079
958 RY*(7)O57 s(6.90%)p4.10(28.27%)d9.39(64.82%) 0.000085165 - 1.731660915
959 RY*(8)O57 s(16.72%)p0.66(11.09%)d4.32(72.19%) 0.000086106 - 2.059240998
960 RY*(9)O57 s(2.02%)p42.56(86.07%)d5.89(11.90%) 0.000048919 - 2.738196504
961 RY*(10)O57 s(35.79%)p1.56(55.68%)d0.24(8.53%) 0.000036732 - 2.035339627
962 RY*(11)O57 s(33.20%)p0.88(29.08%)d1.14(37.71%) 0.000011836 - 2.022413718
963 RY*(12)O57 s(7.93%)p9.85(78.09%)d1.76(13.98%) 0.000017589 - 4.573356238
964 RY*(13)O57 s(3.60%)p9.84(35.38%)d16.97(61.02%) 0.000015451 - 2.225934211
965 RY*(14)O57 s(0.15%)p6.00(0.93%)d99.99(98.92%) 0.000000776 - 6.837506766
966 RY*(15)O57 s(1.46%)p9.11(13.31%)d58.35(85.23%) 0.000010553 - 1.820619372
967 RY*(16)O57 s(0.77%)p2.39(1.85%)d99.99(97.38%) 0.000001381 - 6.731271600
968 RY*(17)O57 s(98.87%)p0.01(0.58%)d0.01(0.55%) 0.000000102 - 49.055880974
969 RY*(18)O57 s(0.27%)p4.65(1.25%)d99.99(98.49%) 0.000002212 - 6.785306226
970 RY*(19)O57 s(0.33%)p99.99(99.32%)d1.09(0.36%) 0.000001261 - 4.924563887
971 RY*(20)O57 s(0.22%)p5.67(1.27%)d99.99(98.50%) 0.000000838 - 6.814317089
972 RY*(21)O57 s(0.19%)p99.99(99.25%)d2.98(0.56%) 0.000004750 - 5.071688328
973 RY*(22)O57 s(0.31%)p16.55(5.08%)d99.99(94.62%) 0.000003212 - 6.514421275
974 RY*(1)H58 s(99.09%)p0.01(0.91%) 0.000720434 - 1.191373141
975 RY*(2)H58 s(0.36%)p99.99(99.64%) 0.000626070 - 2.054100467
976 RY*(3)H58 s(94.17%)p0.06(5.83%) 0.000297454 - 2.227810474
977 RY*(4)H58 s(1.83%)p53.62(98.17%) 0.000159488 - 2.643177739
978 RY*(5)H58 s(4.59%)p20.78(95.41%) 0.000043298 - 2.990538309

Natural Bond Orbitals

Orbital Description NHOs Occupancy Spin Energy () Actions
1 BD(1)C1-C2 1, 2 1.976118148 - -0.605323608
2 BD(1)C1-C6 3, 4 1.976150933 - -0.605021364
3 BD(1)C1-C10 5, 6 1.976533645 - -0.609859412
4 BD(1)C1-N14 7, 8 1.981383807 - -0.730186261
5 BD(1)C2-H3 9, 10 1.987600743 - -0.492906656
6 BD(1)C2-H4 11, 12 1.983674719 - -0.493098393
7 BD(1)C2-H5 13, 14 1.987644557 - -0.492723163
8 BD(1)C6-H7 15, 16 1.987535014 - -0.492127781
9 BD(1)C6-H8 17, 18 1.987498172 - -0.491844278
10 BD(1)C6-H9 19, 20 1.983556084 - -0.492570524
11 BD(1)C10-H11 21, 22 1.987546835 - -0.500160277
12 BD(1)C10-H12 23, 24 1.984636049 - -0.499386229
13 BD(1)C10-H13 25, 26 1.987673224 - -0.500044365
14 BD(1)N14-C15 27, 28 1.988326182 - -0.849698119
15 BD(1)N14-H58 29, 30 1.979953809 - -0.653017329
16 BD(1)C15-C16 31, 32 1.965548225 - -0.624508651
17 BD(1)C15-O57 33, 34 1.988158532 - -0.865637155
18 BD(2)C15-O57 35, 36 1.987464729 - -0.558223375
19 BD(1)C16-C17 37, 38 1.971472655 - -0.643107370
20 BD(1)C16-N28 39, 40 1.977252263 - -0.735888256
21 BD(1)C16-H56 41, 42 1.954384120 - -0.508190299
22 BD(1)C17-C18 43, 44 1.971946698 - -0.702650124
23 BD(2)C17-C18 45, 46 1.667765389 - -0.262628280
24 BD(1)C17-C22 47, 48 1.971371898 - -0.701633349
25 BD(1)C18-C19 49, 50 1.977244076 - -0.703518710
26 BD(1)C18-H27 51, 52 1.978081633 - -0.519396519
27 BD(1)C19-C20 53, 54 1.978998490 - -0.703679118
28 BD(2)C19-C20 55, 56 1.658125177 - -0.257785287
29 BD(1)C19-H26 57, 58 1.978753198 - -0.518583681
30 BD(1)C20-C21 59, 60 1.979360826 - -0.702737227
31 BD(1)C20-H25 61, 62 1.979234646 - -0.519152671
32 BD(1)C21-C22 63, 64 1.977194403 - -0.701928528
33 BD(2)C21-C22 65, 66 1.657521211 - -0.257465428
34 BD(1)C21-H24 67, 68 1.979008665 - -0.517437569
35 BD(1)C22-H23 69, 70 1.978090228 - -0.516527026
36 BD(1)N28-C29 71, 72 1.981941476 - -0.741415097
37 BD(1)N28-C43 73, 74 1.986129791 - -0.836550087
38 BD(1)C29-C30 75, 76 1.976397897 - -0.635678228
39 BD(1)C29-H41 77, 78 1.966250812 - -0.518071482
40 BD(1)C29-H42 79, 80 1.972055379 - -0.512789060
41 BD(1)C30-C31 81, 82 1.971922534 - -0.699771253
42 BD(2)C30-C31 83, 84 1.661501451 - -0.255800017
43 BD(1)C30-C35 85, 86 1.972610314 - -0.696912059
44 BD(1)C31-C32 87, 88 1.977263279 - -0.696152505
45 BD(1)C31-H40 89, 90 1.977738280 - -0.512704073
46 BD(1)C32-C33 91, 92 1.979329585 - -0.700154195
47 BD(2)C32-C33 93, 94 1.670332272 - -0.254535869
48 BD(1)C32-H39 95, 96 1.979152834 - -0.514215380
49 BD(1)C33-C34 97, 98 1.978856333 - -0.698294938
50 BD(1)C33-H38 99, 100 1.979336914 - -0.515781688
51 BD(1)C34-C35 101, 102 1.977499428 - -0.700953944
52 BD(2)C34-C35 103, 104 1.674969166 - -0.255676517
53 BD(1)C34-H37 105, 106 1.979085101 - -0.516042913
54 BD(1)C35-H36 107, 108 1.977966989 - -0.515738506
55 BD(1)C43-C44 109, 110 1.970136194 - -0.656171467
56 BD(1)C43-O55 111, 112 1.989067893 - -0.948700282
57 BD(2)C43-O55 113, 114 1.981418742 - -0.478452641
58 BD(1)C44-C45 115, 116 1.970554264 - -0.708195634
59 BD(2)C44-C45 117, 118 1.659740290 - -0.263230692
60 BD(1)C44-C49 119, 120 1.970009961 - -0.703226217
61 BD(1)C45-C46 121, 122 1.977404455 - -0.705445253
62 BD(1)C45-H54 123, 124 1.978356244 - -0.523820714
63 BD(1)C46-C47 125, 126 1.979419858 - -0.705393774
64 BD(2)C46-C47 127, 128 1.652765396 - -0.259016282
65 BD(1)C46-H53 129, 130 1.978667089 - -0.519234476
66 BD(1)C47-C48 131, 132 1.979304517 - -0.704410343
67 BD(1)C47-H52 133, 134 1.979346925 - -0.520290083
68 BD(1)C48-C49 135, 136 1.978091791 - -0.706431325
69 BD(2)C48-C49 137, 138 1.656223348 - -0.259414731
70 BD(1)C48-H51 139, 140 1.978740072 - -0.519415720
71 BD(1)C49-H50 141, 142 1.978016272 - -0.519955970
72 CR(1)C1 143 1.999237278 - -10.093833316
73 CR(1)C2 144 1.999256385 - -10.009446121
74 CR(1)C6 145 1.999256210 - -10.008826426
75 CR(1)C10 146 1.999267821 - -10.016788555
76 CR(1)N14 147 1.999219388 - -14.162228354
77 CR(1)C15 148 1.999273810 - -10.155830297
78 CR(1)C16 149 1.998989046 - -10.097957180
79 CR(1)C17 150 1.998971661 - -10.047064344
80 CR(1)C18 151 1.999029336 - -10.033761591
81 CR(1)C19 152 1.999146345 - -10.035341892
82 CR(1)C20 153 1.999151339 - -10.035267388
83 CR(1)C21 154 1.999150720 - -10.035255826
84 CR(1)C22 155 1.999014084 - -10.030183269
85 CR(1)N28 156 1.999237239 - -14.191385299
86 CR(1)C29 157 1.999127755 - -10.081207945
87 CR(1)C30 158 1.998984231 - -10.043877749
88 CR(1)C31 159 1.999019634 - -10.024685556
89 CR(1)C32 160 1.999152424 - -10.031466158
90 CR(1)C33 161 1.999149395 - -10.030448555
91 CR(1)C34 162 1.999153699 - -10.032344909
92 CR(1)C35 163 1.999039325 - -10.028974593
93 CR(1)C43 164 1.999138754 - -10.156475673
94 CR(1)C44 165 1.998905137 - -10.051349055
95 CR(1)C45 166 1.999043226 - -10.037655144
96 CR(1)C46 167 1.999147215 - -10.037114705
97 CR(1)C47 168 1.999153244 - -10.037762137
98 CR(1)C48 169 1.999150141 - -10.037027992
99 CR(1)C49 170 1.999052155 - -10.037204059
100 CR(1)O55 171 1.999757089 - -18.846550085
101 CR(1)O57 172 1.999743332 - -18.834877078
102 LP(1)N14 173 1.666864841 - -0.253425388
103 LP(1)N28 174 1.669269406 - -0.264019875
104 LP(1)O55 175 1.977603143 - -0.697918675
105 LP(2)O55 176 1.867586015 - -0.268540548
106 LP(1)O57 177 1.975660429 - -0.685545386
107 LP(2)O57 178 1.865948360 - -0.257966597
108 RY*(1)C1 179 0.006805676 - 0.930960859
109 RY*(2)C1 180 0.002675036 - 1.004521188
110 RY*(3)C1 181 0.001917237 - 0.876172371
111 RY*(4)C1 182 0.001649185 - 1.095945858
112 RY*(5)C1 183 0.000871719 - 2.857770995
113 RY*(6)C1 184 0.000792528 - 2.604763479
114 RY*(7)C1 185 0.000709619 - 2.759168388
115 RY*(8)C1 186 0.000560805 - 1.782038270
116 RY*(9)C1 187 0.000321288 - 2.619512603
117 RY*(10)C1 188 0.000210008 - 1.361601463
118 RY*(11)C1 189 0.000160426 - 1.485864105
119 RY*(12)C1 190 0.000108994 - 2.274962061
120 RY*(13)C1 191 0.000038003 - 2.859274812
121 RY*(14)C1 192 0.000041011 - 1.695325719
122 RY*(15)C1 193 0.000003947 - 22.150428036
123 RY*(16)C1 194 0.000003303 - 2.818201030
124 RY*(17)C1 195 0.000012211 - 2.823258797
125 RY*(18)C1 196 0.000005954 - 2.914384129
126 RY*(19)C1 197 0.000008645 - 1.904869125
127 RY*(20)C1 198 0.000008157 - 2.272859294
128 RY*(21)C1 199 0.000012640 - 2.127154250
129 RY*(22)C1 200 0.000005176 - 2.253886457
130 RY*(1)C2 201 0.002868865 - 0.737678338
131 RY*(2)C2 202 0.001674411 - 0.786900315
132 RY*(3)C2 203 0.000762077 - 0.773552185
133 RY*(4)C2 204 0.000371858 - 1.171050091
134 RY*(5)C2 205 0.000255189 - 1.036027777
135 RY*(6)C2 206 0.000184424 - 1.445475436
136 RY*(7)C2 207 0.000109675 - 1.769652922
137 RY*(8)C2 208 0.000079729 - 1.057748876
138 RY*(9)C2 209 0.000072262 - 1.120160905
139 RY*(10)C2 210 0.000034361 - 1.208682803
140 RY*(11)C2 211 0.000036921 - 0.876668019
141 RY*(12)C2 212 0.000018587 - 0.941381919
142 RY*(13)C2 213 0.000010950 - 2.518995757
143 RY*(14)C2 214 0.000001479 - 3.391406710
144 RY*(15)C2 215 0.000000240 - 23.121216409
145 RY*(16)C2 216 0.000004396 - 3.518262012
146 RY*(17)C2 217 0.000004083 - 2.861469990
147 RY*(18)C2 218 0.000000999 - 3.584144513
148 RY*(19)C2 219 0.000005212 - 0.607565864
149 RY*(20)C2 220 0.000003276 - 3.514242609
150 RY*(21)C2 221 0.000004476 - 2.561456603
151 RY*(22)C2 222 0.000004615 - 3.211611719
152 RY*(1)H3 223 0.000601793 - 1.254249038
153 RY*(2)H3 224 0.000234141 - 1.849830860
154 RY*(3)H3 225 0.000118424 - 2.050124008
155 RY*(4)H3 226 0.000094403 - 2.319880802
156 RY*(5)H3 227 0.000023785 - 2.541885627
157 RY*(1)H4 228 0.000484648 - 0.916520759
158 RY*(2)H4 229 0.000224893 - 2.004420105
159 RY*(3)H4 230 0.000125372 - 2.327692240
160 RY*(4)H4 231 0.000096744 - 2.028088621
161 RY*(5)H4 232 0.000017268 - 2.608825643
162 RY*(1)H5 233 0.000919041 - 1.261873100
163 RY*(2)H5 234 0.000192515 - 1.902287049
164 RY*(3)H5 235 0.000112262 - 2.212878177
165 RY*(4)H5 236 0.000113962 - 2.112395875
166 RY*(5)H5 237 0.000036868 - 2.550387948
167 RY*(1)C6 238 0.002895817 - 0.737523862
168 RY*(2)C6 239 0.001682522 - 0.790654702
169 RY*(3)C6 240 0.000853589 - 0.777843312
170 RY*(4)C6 241 0.000361071 - 1.167274957
171 RY*(5)C6 242 0.000259459 - 1.004267859
172 RY*(6)C6 243 0.000189774 - 1.450790236
173 RY*(7)C6 244 0.000105953 - 1.933153620
174 RY*(8)C6 245 0.000073136 - 1.038275214
175 RY*(9)C6 246 0.000077417 - 1.044929990
176 RY*(10)C6 247 0.000032563 - 1.336517164
177 RY*(11)C6 248 0.000038110 - 1.114055625
178 RY*(12)C6 249 0.000018566 - 1.702891338
179 RY*(13)C6 250 0.000011413 - 2.384382354
180 RY*(14)C6 251 0.000004380 - 3.117005211
181 RY*(15)C6 252 0.000000218 - 23.145842549
182 RY*(16)C6 253 0.000002646 - 3.376009196
183 RY*(17)C6 254 0.000007988 - 2.559908927
184 RY*(18)C6 255 0.000005023 - 3.250201149
185 RY*(19)C6 256 0.000006194 - 0.676556282
186 RY*(20)C6 257 0.000001151 - 3.584510295
187 RY*(21)C6 258 0.000005569 - 2.528676083
188 RY*(22)C6 259 0.000004615 - 3.187220967
189 RY*(1)H7 260 0.000581569 - 1.244623985
190 RY*(2)H7 261 0.000230744 - 1.879164907
191 RY*(3)H7 262 0.000118529 - 2.059769430
192 RY*(4)H7 263 0.000092758 - 2.314909994
193 RY*(5)H7 264 0.000023304 - 2.533430282
194 RY*(1)H8 265 0.000921122 - 1.325915644
195 RY*(2)H8 266 0.000214873 - 1.821445678
196 RY*(3)H8 267 0.000113041 - 2.235146103
197 RY*(4)H8 268 0.000116892 - 2.086469846
198 RY*(5)H8 269 0.000038944 - 2.598030450
199 RY*(1)H9 270 0.000477644 - 0.922297436
200 RY*(2)H9 271 0.000224079 - 1.995063446
201 RY*(3)H9 272 0.000126181 - 2.319709658
202 RY*(4)H9 273 0.000095706 - 2.027671265
203 RY*(5)H9 274 0.000016674 - 2.633976699
204 RY*(1)C10 275 0.002720886 - 0.742372760
205 RY*(2)C10 276 0.002222292 - 0.733519401
206 RY*(3)C10 277 0.000579194 - 0.898263673
207 RY*(4)C10 278 0.000323010 - 1.199507860
208 RY*(5)C10 279 0.000238949 - 0.775076074
209 RY*(6)C10 280 0.000166503 - 1.572905530
210 RY*(7)C10 281 0.000089322 - 0.806361346
211 RY*(8)C10 282 0.000072419 - 2.070987578
212 RY*(9)C10 283 0.000040732 - 1.328345672
213 RY*(10)C10 284 0.000048284 - 0.835277847
214 RY*(11)C10 285 0.000018264 - 1.291748161
215 RY*(12)C10 286 0.000015559 - 0.795042884
216 RY*(13)C10 287 0.000008600 - 2.077049433
217 RY*(14)C10 288 0.000012249 - 0.744066773
218 RY*(15)C10 289 0.000000526 - 22.946436052
219 RY*(16)C10 290 0.000005701 - 3.415832938
220 RY*(17)C10 291 0.000001283 - 3.091191460
221 RY*(18)C10 292 0.000000551 - 3.583436395
222 RY*(19)C10 293 0.000003872 - 2.792229943
223 RY*(20)C10 294 0.000002846 - 3.522394177
224 RY*(21)C10 295 0.000001716 - 3.271574722
225 RY*(22)C10 296 0.000002471 - 3.208396303
226 RY*(1)H11 297 0.000612729 - 1.122680365
227 RY*(2)H11 298 0.000229680 - 1.926281149
228 RY*(3)H11 299 0.000101808 - 2.020306059
229 RY*(4)H11 300 0.000082345 - 2.428699730
230 RY*(5)H11 301 0.000025128 - 2.462410173
231 RY*(1)H12 302 0.000383330 - 1.016559447
232 RY*(2)H12 303 0.000226336 - 1.923753264
233 RY*(3)H12 304 0.000113982 - 2.332739265
234 RY*(4)H12 305 0.000110155 - 2.010989971
235 RY*(5)H12 306 0.000015680 - 2.603158256
236 RY*(1)H13 307 0.000596350 - 1.216392097
237 RY*(2)H13 308 0.000241578 - 1.843709437
238 RY*(3)H13 309 0.000089534 - 2.257771016
239 RY*(4)H13 310 0.000096964 - 2.158645174
240 RY*(5)H13 311 0.000024695 - 2.497186840
241 RY*(1)N14 312 0.007190024 - 0.622002052
242 RY*(2)N14 313 0.004036957 - 1.264511205
243 RY*(3)N14 314 0.001414912 - 1.591497479
244 RY*(4)N14 315 0.001143096 - 1.337199732
245 RY*(5)N14 316 0.000861610 - 1.414959653
246 RY*(6)N14 317 0.000797276 - 1.265824122
247 RY*(7)N14 318 0.000672480 - 1.952431042
248 RY*(8)N14 319 0.000460616 - 1.304081670
249 RY*(9)N14 320 0.000267551 - 1.943182891
250 RY*(10)N14 321 0.000249316 - 2.052715847
251 RY*(11)N14 322 0.000160466 - 1.466852957
252 RY*(12)N14 323 0.000088966 - 3.440613862
253 RY*(13)N14 324 0.000061444 - 4.230087421
254 RY*(14)N14 325 0.000059545 - 1.821137667
255 RY*(15)N14 326 0.000054337 - 4.263332509
256 RY*(16)N14 327 0.000037552 - 4.114187867
257 RY*(17)N14 328 0.000004078 - 3.988606059
258 RY*(18)N14 329 0.000001486 - 4.768449703
259 RY*(19)N14 330 0.000007633 - 4.304273094
260 RY*(20)N14 331 0.000003664 - 4.691929666
261 RY*(21)N14 332 0.000000452 - 34.819463507
262 RY*(22)N14 333 0.000007039 - 4.385909232
263 RY*(1)C15 334 0.016312003 - 1.110691614
264 RY*(2)C15 335 0.005889484 - 1.336856610
265 RY*(3)C15 336 0.002913125 - 2.195436568
266 RY*(4)C15 337 0.002245676 - 2.021979923
267 RY*(5)C15 338 0.001787222 - 2.190587106
268 RY*(6)C15 339 0.001220557 - 1.599939832
269 RY*(7)C15 340 0.000453811 - 3.007323226
270 RY*(8)C15 341 0.000253050 - 2.372750703
271 RY*(9)C15 342 0.000228950 - 1.915772498
272 RY*(10)C15 343 0.000166628 - 2.742896184
273 RY*(11)C15 344 0.000112226 - 3.225960892
274 RY*(12)C15 345 0.000057082 - 1.931420474
275 RY*(13)C15 346 0.000062369 - 3.242224115
276 RY*(14)C15 347 0.000027426 - 4.562600570
277 RY*(15)C15 348 0.000034714 - 4.674590283
278 RY*(16)C15 349 0.000033561 - 4.411477749
279 RY*(17)C15 350 0.000034292 - 3.922802156
280 RY*(18)C15 351 0.000015169 - 6.851997755
281 RY*(19)C15 352 0.000013117 - 2.635648604
282 RY*(20)C15 353 0.000008022 - 2.192802540
283 RY*(21)C15 354 0.000003376 - 2.877740772
284 RY*(22)C15 355 0.000010578 - 4.265815048
285 RY*(1)C16 356 0.010481624 - 1.000291285
286 RY*(2)C16 357 0.005997859 - 0.925655103
287 RY*(3)C16 358 0.003142714 - 1.132293386
288 RY*(4)C16 359 0.001693194 - 1.741145223
289 RY*(5)C16 360 0.001271095 - 1.718034699
290 RY*(6)C16 361 0.000949352 - 1.563006490
291 RY*(7)C16 362 0.000769975 - 2.193023656
292 RY*(8)C16 363 0.000648048 - 2.682194420
293 RY*(9)C16 364 0.000536622 - 1.787691791
294 RY*(10)C16 365 0.000421642 - 1.859710780
295 RY*(11)C16 366 0.000344583 - 2.443385011
296 RY*(12)C16 367 0.000196216 - 2.772817158
297 RY*(13)C16 368 0.000191937 - 2.196255469
298 RY*(14)C16 369 0.000157880 - 2.730102714
299 RY*(15)C16 370 0.000102107 - 2.959592567
300 RY*(16)C16 371 0.000080852 - 2.336240809
301 RY*(17)C16 372 0.000041781 - 2.817885338
302 RY*(18)C16 373 0.000047970 - 2.635994354
303 RY*(19)C16 374 0.000028974 - 2.523392373
304 RY*(20)C16 375 0.000024509 - 3.283385338
305 RY*(21)C16 376 0.000023493 - 2.361947002
306 RY*(22)C16 377 0.000007674 - 19.893721286
307 RY*(1)C17 378 0.008001720 - 1.219535627
308 RY*(2)C17 379 0.003489217 - 1.086431818
309 RY*(3)C17 380 0.002439754 - 0.847911192
310 RY*(4)C17 381 0.001611820 - 1.137153392
311 RY*(5)C17 382 0.000997935 - 0.912875592
312 RY*(6)C17 383 0.000887580 - 1.159532819
313 RY*(7)C17 384 0.000693659 - 1.629214690
314 RY*(8)C17 385 0.000523328 - 3.301708278
315 RY*(9)C17 386 0.000436470 - 2.535856314
316 RY*(10)C17 387 0.000294407 - 2.780708903
317 RY*(11)C17 388 0.000178340 - 2.522584300
318 RY*(12)C17 389 0.000124555 - 2.831662883
319 RY*(13)C17 390 0.000104161 - 1.660159056
320 RY*(14)C17 391 0.000090822 - 2.487375615
321 RY*(15)C17 392 0.000063498 - 3.023011992
322 RY*(16)C17 393 0.000046988 - 3.726713959
323 RY*(17)C17 394 0.000027692 - 3.148631133
324 RY*(18)C17 395 0.000029276 - 2.894164634
325 RY*(19)C17 396 0.000001265 - 1.161070654
326 RY*(20)C17 397 0.000004695 - 3.135178331
327 RY*(21)C17 398 0.000008069 - 20.257220336
328 RY*(22)C17 399 0.000010377 - 3.545189595
329 RY*(1)C18 400 0.006327558 - 1.343089090
330 RY*(2)C18 401 0.002100249 - 1.126751944
331 RY*(3)C18 402 0.001328008 - 0.661232383
332 RY*(4)C18 403 0.000724129 - 1.890587995
333 RY*(5)C18 404 0.000513841 - 2.032363060
334 RY*(6)C18 405 0.000405137 - 2.664745314
335 RY*(7)C18 406 0.000320068 - 1.579152316
336 RY*(8)C18 407 0.000146117 - 2.493006887
337 RY*(9)C18 408 0.000066053 - 2.383924855
338 RY*(10)C18 409 0.000050940 - 2.442621618
339 RY*(11)C18 410 0.000058019 - 2.280685640
340 RY*(12)C18 411 0.000031803 - 2.032159219
341 RY*(13)C18 412 0.000030687 - 1.965064654
342 RY*(14)C18 413 0.000017386 - 4.071127373
343 RY*(15)C18 414 0.000003590 - 0.902081218
344 RY*(16)C18 415 0.000002978 - 3.438826085
345 RY*(17)C18 416 0.000003914 - 2.896617803
346 RY*(18)C18 417 0.000004398 - 2.920711763
347 RY*(19)C18 418 0.000009795 - 1.802357676
348 RY*(20)C18 419 0.000009985 - 2.010186142
349 RY*(21)C18 420 0.000012797 - 2.156508922
350 RY*(22)C18 421 0.000001732 - 18.953946967
351 RY*(1)C19 422 0.006548236 - 1.254239358
352 RY*(2)C19 423 0.002177068 - 1.281174704
353 RY*(3)C19 424 0.001027200 - 0.437208335
354 RY*(4)C19 425 0.000661500 - 2.106290460
355 RY*(5)C19 426 0.000410158 - 2.125348608
356 RY*(6)C19 427 0.000370551 - 2.823367877
357 RY*(7)C19 428 0.000119638 - 1.696771905
358 RY*(8)C19 429 0.000092014 - 4.295118660
359 RY*(9)C19 430 0.000058986 - 1.962793665
360 RY*(10)C19 431 0.000032859 - 2.983396621
361 RY*(11)C19 432 0.000034391 - 1.397048773
362 RY*(12)C19 433 0.000008830 - 1.271925532
363 RY*(13)C19 434 0.000003121 - 2.771929033
364 RY*(14)C19 435 0.000004559 - 1.976697153
365 RY*(15)C19 436 0.000005466 - 3.275163836
366 RY*(16)C19 437 0.000012907 - 2.232655381
367 RY*(17)C19 438 0.000009403 - 1.420783081
368 RY*(18)C19 439 0.000008014 - 2.961020520
369 RY*(19)C19 440 0.000002512 - 17.988290691
370 RY*(20)C19 441 0.000004587 - 2.421675664
371 RY*(21)C19 442 0.000007879 - 1.676548370
372 RY*(22)C19 443 0.000007548 - 2.133329887
373 RY*(1)C20 444 0.006268618 - 1.264835935
374 RY*(2)C20 445 0.002186002 - 1.305139093
375 RY*(3)C20 446 0.001045509 - 0.425227066
376 RY*(4)C20 447 0.000676117 - 1.979176387
377 RY*(5)C20 448 0.000569536 - 1.626668405
378 RY*(6)C20 449 0.000357560 - 3.004869270
379 RY*(7)C20 450 0.000125047 - 1.454257230
380 RY*(8)C20 451 0.000094749 - 4.305247264
381 RY*(9)C20 452 0.000052120 - 2.469736235
382 RY*(10)C20 453 0.000023534 - 2.837011749
383 RY*(11)C20 454 0.000033465 - 3.033102172
384 RY*(12)C20 455 0.000015853 - 1.828640514
385 RY*(13)C20 456 0.000001395 - 1.762415874
386 RY*(14)C20 457 0.000002564 - 17.706506894
387 RY*(15)C20 458 0.000004297 - 1.981572669
388 RY*(16)C20 459 0.000000310 - 3.281283435
389 RY*(17)C20 460 0.000002373 - 1.832643789
390 RY*(18)C20 461 0.000001575 - 2.640085325
391 RY*(19)C20 462 0.000009916 - 0.698590762
392 RY*(20)C20 463 0.000001566 - 3.077053951
393 RY*(21)C20 464 0.000001548 - 1.300221187
394 RY*(22)C20 465 0.000002767 - 2.470670587
395 RY*(1)C21 466 0.006505958 - 1.257380857
396 RY*(2)C21 467 0.002151017 - 1.304266766
397 RY*(3)C21 468 0.001045085 - 0.447488667
398 RY*(4)C21 469 0.000679720 - 2.107573826
399 RY*(5)C21 470 0.000385252 - 2.167423093
400 RY*(6)C21 471 0.000383016 - 2.615630381
401 RY*(7)C21 472 0.000130374 - 2.009887846
402 RY*(8)C21 473 0.000084127 - 4.791442819
403 RY*(9)C21 474 0.000046296 - 0.951713684
404 RY*(10)C21 475 0.000038078 - 1.667644144
405 RY*(11)C21 476 0.000035063 - 2.275231132
406 RY*(12)C21 477 0.000042630 - 2.793196745
407 RY*(13)C21 478 0.000005809 - 1.932108706
408 RY*(14)C21 479 0.000002561 - 2.816608977
409 RY*(15)C21 480 0.000008174 - 2.596762273
410 RY*(16)C21 481 0.000005923 - 3.309061723
411 RY*(17)C21 482 0.000011860 - 2.615581030
412 RY*(18)C21 483 0.000005750 - 0.914064788
413 RY*(19)C21 484 0.000001401 - 18.310515439
414 RY*(20)C21 485 0.000008587 - 1.509815169
415 RY*(21)C21 486 0.000006633 - 1.391501945
416 RY*(22)C21 487 0.000001966 - 2.777672108
417 RY*(1)C22 488 0.005813000 - 1.422557915
418 RY*(2)C22 489 0.002176007 - 1.205811887
419 RY*(3)C22 490 0.001256278 - 0.717144789
420 RY*(4)C22 491 0.000690869 - 1.905589015
421 RY*(5)C22 492 0.000551568 - 2.127706666
422 RY*(6)C22 493 0.000480686 - 2.368806772
423 RY*(7)C22 494 0.000301139 - 1.424174055
424 RY*(8)C22 495 0.000172345 - 2.273927791
425 RY*(9)C22 496 0.000089008 - 1.904363465
426 RY*(10)C22 497 0.000066126 - 1.913960934
427 RY*(11)C22 498 0.000044727 - 2.173336139
428 RY*(12)C22 499 0.000038401 - 2.434962353
429 RY*(13)C22 500 0.000024698 - 2.672504416
430 RY*(14)C22 501 0.000019477 - 1.127835562
431 RY*(15)C22 502 0.000018764 - 2.219396512
432 RY*(16)C22 503 0.000004154 - 3.499026563
433 RY*(17)C22 504 0.000002143 - 20.035275983
434 RY*(18)C22 505 0.000012083 - 2.602666538
435 RY*(19)C22 506 0.000003950 - 2.994425439
436 RY*(20)C22 507 0.000009676 - 1.389313669
437 RY*(21)C22 508 0.000010011 - 3.116435426
438 RY*(22)C22 509 0.000005442 - 3.081661866
439 RY*(1)H23 510 0.001350581 - 1.077709504
440 RY*(2)H23 511 0.000354163 - 2.474183893
441 RY*(3)H23 512 0.000193553 - 2.039164167
442 RY*(4)H23 513 0.000062174 - 2.876554898
443 RY*(5)H23 514 0.000045700 - 2.760218951
444 RY*(1)H24 515 0.000556472 - 1.180917246
445 RY*(2)H24 516 0.000204471 - 1.922525558
446 RY*(3)H24 517 0.000160905 - 2.037566902
447 RY*(4)H24 518 0.000043721 - 2.716051815
448 RY*(5)H24 519 0.000052286 - 2.647559087
449 RY*(1)H25 520 0.000432240 - 1.186655611
450 RY*(2)H25 521 0.000215044 - 1.924077269
451 RY*(3)H25 522 0.000161667 - 2.089397394
452 RY*(4)H25 523 0.000045835 - 2.553361315
453 RY*(5)H25 524 0.000042239 - 2.674630109
454 RY*(1)H26 525 0.000473855 - 1.231664548
455 RY*(2)H26 526 0.000209539 - 1.925363616
456 RY*(3)H26 527 0.000166638 - 2.041930422
457 RY*(4)H26 528 0.000043601 - 2.657508080
458 RY*(5)H26 529 0.000048762 - 2.581864920
459 RY*(1)H27 530 0.000567260 - 1.623232005
460 RY*(2)H27 531 0.000211894 - 1.971496497
461 RY*(3)H27 532 0.000115971 - 2.079556122
462 RY*(4)H27 533 0.000061161 - 2.502090247
463 RY*(5)H27 534 0.000039844 - 2.704438457
464 RY*(1)N28 535 0.008648095 - 0.897714566
465 RY*(2)N28 536 0.003329937 - 1.583964013
466 RY*(3)N28 537 0.002516068 - 1.267878156
467 RY*(4)N28 538 0.001525734 - 1.598415947
468 RY*(5)N28 539 0.000866779 - 1.627927652
469 RY*(6)N28 540 0.000782410 - 1.332615258
470 RY*(7)N28 541 0.000723259 - 1.430987583
471 RY*(8)N28 542 0.000404237 - 1.842615459
472 RY*(9)N28 543 0.000357600 - 2.283971019
473 RY*(10)N28 544 0.000220581 - 2.287615997
474 RY*(11)N28 545 0.000202594 - 2.381036466
475 RY*(12)N28 546 0.000121897 - 2.655055371
476 RY*(13)N28 547 0.000092045 - 3.873583489
477 RY*(14)N28 548 0.000101288 - 2.313516463
478 RY*(15)N28 549 0.000065273 - 4.554683922
479 RY*(16)N28 550 0.000049806 - 3.899490822
480 RY*(17)N28 551 0.000040582 - 4.064137209
481 RY*(18)N28 552 0.000016858 - 4.324704193
482 RY*(19)N28 553 0.000019695 - 3.800958700
483 RY*(20)N28 554 0.000003495 - 4.106253051
484 RY*(21)N28 555 0.000002018 - 33.940564121
485 RY*(22)N28 556 0.000003145 - 4.900400090
486 RY*(1)C29 557 0.005128657 - 0.917647245
487 RY*(2)C29 558 0.003065849 - 1.054975471
488 RY*(3)C29 559 0.001416778 - 0.959594319
489 RY*(4)C29 560 0.001252524 - 1.448685801
490 RY*(5)C29 561 0.000905259 - 1.217876047
491 RY*(6)C29 562 0.000673326 - 1.092165541
492 RY*(7)C29 563 0.000462569 - 1.318458718
493 RY*(8)C29 564 0.000438149 - 1.820688317
494 RY*(9)C29 565 0.000364315 - 2.034472246
495 RY*(10)C29 566 0.000158847 - 1.530844515
496 RY*(11)C29 567 0.000120220 - 1.851963945
497 RY*(12)C29 568 0.000089315 - 1.634395843
498 RY*(13)C29 569 0.000065652 - 3.601706609
499 RY*(14)C29 570 0.000069884 - 2.607012804
500 RY*(15)C29 571 0.000049118 - 3.599196677
501 RY*(16)C29 572 0.000023193 - 2.832947353
502 RY*(17)C29 573 0.000021758 - 3.523601684
503 RY*(18)C29 574 0.000025070 - 2.919258751
504 RY*(19)C29 575 0.000017959 - 2.853907672
505 RY*(20)C29 576 0.000002033 - 21.242819444
506 RY*(21)C29 577 0.000010488 - 3.663711710
507 RY*(22)C29 578 0.000004589 - 1.078176778
508 RY*(1)C30 579 0.006661666 - 1.306331886
509 RY*(2)C30 580 0.003548986 - 1.143778031
510 RY*(3)C30 581 0.001695308 - 0.777546346
511 RY*(4)C30 582 0.001627522 - 1.158356503
512 RY*(5)C30 583 0.001046516 - 1.086955412
513 RY*(6)C30 584 0.000825658 - 0.975608776
514 RY*(7)C30 585 0.000577468 - 2.940510437
515 RY*(8)C30 586 0.000389901 - 1.998628750
516 RY*(9)C30 587 0.000349360 - 2.388633856
517 RY*(10)C30 588 0.000261525 - 2.636533696
518 RY*(11)C30 589 0.000141113 - 1.608409556
519 RY*(12)C30 590 0.000095186 - 3.254619165
520 RY*(13)C30 591 0.000068313 - 2.753965197
521 RY*(14)C30 592 0.000070477 - 2.373501021
522 RY*(15)C30 593 0.000031948 - 4.086422585
523 RY*(16)C30 594 0.000028172 - 2.757370460
524 RY*(17)C30 595 0.000004561 - 2.971916399
525 RY*(18)C30 596 0.000012861 - 2.880623479
526 RY*(19)C30 597 0.000006558 - 3.650730223
527 RY*(20)C30 598 0.000011032 - 2.293883700
528 RY*(21)C30 599 0.000004667 - 18.286697387
529 RY*(22)C30 600 0.000013568 - 2.282127705
530 RY*(1)C31 601 0.005765586 - 1.436587888
531 RY*(2)C31 602 0.002057011 - 1.294428961
532 RY*(3)C31 603 0.001158190 - 0.701143645
533 RY*(4)C31 604 0.000757778 - 2.035104379
534 RY*(5)C31 605 0.000578174 - 1.893920335
535 RY*(6)C31 606 0.000468049 - 2.183393021
536 RY*(7)C31 607 0.000207138 - 2.303981534
537 RY*(8)C31 608 0.000216263 - 1.471867391
538 RY*(9)C31 609 0.000083360 - 1.521610846
539 RY*(10)C31 610 0.000063942 - 2.272224201
540 RY*(11)C31 611 0.000041551 - 2.165812860
541 RY*(12)C31 612 0.000039809 - 1.731689009
542 RY*(13)C31 613 0.000024317 - 1.251172850
543 RY*(14)C31 614 0.000030258 - 2.808889203
544 RY*(15)C31 615 0.000008084 - 3.094611707
545 RY*(16)C31 616 0.000008181 - 1.890860665
546 RY*(17)C31 617 0.000005291 - 2.988679969
547 RY*(18)C31 618 0.000011432 - 2.921578720
548 RY*(19)C31 619 0.000009764 - 1.312468723
549 RY*(20)C31 620 0.000003739 - 3.370901512
550 RY*(21)C31 621 0.000002712 - 20.774890523
551 RY*(22)C31 622 0.000003214 - 3.275017429
552 RY*(1)C32 623 0.006530785 - 1.264083506
553 RY*(2)C32 624 0.002186167 - 1.271198651
554 RY*(3)C32 625 0.001083712 - 0.433642972
555 RY*(4)C32 626 0.000697480 - 2.073777838
556 RY*(5)C32 627 0.000404620 - 2.104169129
557 RY*(6)C32 628 0.000412147 - 2.590574070
558 RY*(7)C32 629 0.000133419 - 2.037992990
559 RY*(8)C32 630 0.000081681 - 4.573383883
560 RY*(9)C32 631 0.000038996 - 1.340226137
561 RY*(10)C32 632 0.000038397 - 3.461098629
562 RY*(11)C32 633 0.000043608 - 1.102527690
563 RY*(12)C32 634 0.000043767 - 1.124642287
564 RY*(13)C32 635 0.000013533 - 3.493070232
565 RY*(14)C32 636 0.000006172 - 2.957708037
566 RY*(15)C32 637 0.000006915 - 1.747304770
567 RY*(16)C32 638 0.000003329 - 3.024274154
568 RY*(17)C32 639 0.000006858 - 1.387618116
569 RY*(18)C32 640 0.000006961 - 1.388989606
570 RY*(19)C32 641 0.000001807 - 17.461066123
571 RY*(20)C32 642 0.000007248 - 2.009317430
572 RY*(21)C32 643 0.000001792 - 2.787505321
573 RY*(22)C32 644 0.000006369 - 2.859451821
574 RY*(1)C33 645 0.006313763 - 1.264344898
575 RY*(2)C33 646 0.002190122 - 1.296884180
576 RY*(3)C33 647 0.001182977 - 0.385029175
577 RY*(4)C33 648 0.000664987 - 1.975326985
578 RY*(5)C33 649 0.000540748 - 1.696230391
579 RY*(6)C33 650 0.000363467 - 3.018948420
580 RY*(7)C33 651 0.000126471 - 1.634372594
581 RY*(8)C33 652 0.000100135 - 3.844580680
582 RY*(9)C33 653 0.000045820 - 2.663021083
583 RY*(10)C33 654 0.000032379 - 2.942768829
584 RY*(11)C33 655 0.000013021 - 2.141403524
585 RY*(12)C33 656 0.000009877 - 2.843848692
586 RY*(13)C33 657 0.000004417 - 1.702214377
587 RY*(14)C33 658 0.000013834 - 0.686515667
588 RY*(15)C33 659 0.000007087 - 1.783494721
589 RY*(16)C33 660 0.000001449 - 2.360156543
590 RY*(17)C33 661 0.000001477 - 2.495852780
591 RY*(18)C33 662 0.000006390 - 2.347713987
592 RY*(19)C33 663 0.000005064 - 1.844894015
593 RY*(20)C33 664 0.000001809 - 2.773660307
594 RY*(21)C33 665 0.000001407 - 17.531292811
595 RY*(22)C33 666 0.000003131 - 3.006891138
596 RY*(1)C34 667 0.006444882 - 1.255723400
597 RY*(2)C34 668 0.002187623 - 1.278330242
598 RY*(3)C34 669 0.000999893 - 0.464304272
599 RY*(4)C34 670 0.000674744 - 2.081415726
600 RY*(5)C34 671 0.000443689 - 1.959044925
601 RY*(6)C34 672 0.000400901 - 2.697801656
602 RY*(7)C34 673 0.000116296 - 1.638073311
603 RY*(8)C34 674 0.000091908 - 3.991797569
604 RY*(9)C34 675 0.000058343 - 2.140683378
605 RY*(10)C34 676 0.000029026 - 1.117503393
606 RY*(11)C34 677 0.000037198 - 2.978425396
607 RY*(12)C34 678 0.000012330 - 2.370310825
608 RY*(13)C34 679 0.000013091 - 4.187919993
609 RY*(14)C34 680 0.000000568 - 17.273991453
610 RY*(15)C34 681 0.000007103 - 1.436319908
611 RY*(16)C34 682 0.000005262 - 2.196513412
612 RY*(17)C34 683 0.000003864 - 3.004354179
613 RY*(18)C34 684 0.000000626 - 2.912850662
614 RY*(19)C34 685 0.000003432 - 1.658477623
615 RY*(20)C34 686 0.000001316 - 2.702995191
616 RY*(21)C34 687 0.000007053 - 1.624435816
617 RY*(22)C34 688 0.000006344 - 1.436654887
618 RY*(1)C35 689 0.006387091 - 1.320316394
619 RY*(2)C35 690 0.002103390 - 1.116880257
620 RY*(3)C35 691 0.001012258 - 0.681450810
621 RY*(4)C35 692 0.000735010 - 2.006019938
622 RY*(5)C35 693 0.000452322 - 2.081102019
623 RY*(6)C35 694 0.000400757 - 2.757958769
624 RY*(7)C35 695 0.000215705 - 1.543816375
625 RY*(8)C35 696 0.000125078 - 2.961972507
626 RY*(9)C35 697 0.000074095 - 1.358602905
627 RY*(10)C35 698 0.000039488 - 1.565608737
628 RY*(11)C35 699 0.000045539 - 2.737050709
629 RY*(12)C35 700 0.000045934 - 2.113744719
630 RY*(13)C35 701 0.000006649 - 1.053358628
631 RY*(14)C35 702 0.000016516 - 1.346608449
632 RY*(15)C35 703 0.000003826 - 3.588762547
633 RY*(16)C35 704 0.000002120 - 3.173687044
634 RY*(17)C35 705 0.000011246 - 2.948177829
635 RY*(18)C35 706 0.000002283 - 18.147150709
636 RY*(19)C35 707 0.000004413 - 3.129369774
637 RY*(20)C35 708 0.000009025 - 1.749407695
638 RY*(21)C35 709 0.000010378 - 3.207406976
639 RY*(22)C35 710 0.000007248 - 3.006238649
640 RY*(1)H36 711 0.000569289 - 1.575011314
641 RY*(2)H36 712 0.000211806 - 1.950568475
642 RY*(3)H36 713 0.000138330 - 1.941766620
643 RY*(4)H36 714 0.000046608 - 2.592449215
644 RY*(5)H36 715 0.000048004 - 2.544062872
645 RY*(1)H37 716 0.000464824 - 1.199962130
646 RY*(2)H37 717 0.000206826 - 1.921503972
647 RY*(3)H37 718 0.000168150 - 2.045007752
648 RY*(4)H37 719 0.000043676 - 2.648932688
649 RY*(5)H37 720 0.000048066 - 2.592541012
650 RY*(1)H38 721 0.000459824 - 1.166800721
651 RY*(2)H38 722 0.000205902 - 1.921713566
652 RY*(3)H38 723 0.000157861 - 2.101181705
653 RY*(4)H38 724 0.000042904 - 2.638193255
654 RY*(5)H38 725 0.000044084 - 2.596691420
655 RY*(1)H39 726 0.000518833 - 1.243430206
656 RY*(2)H39 727 0.000197719 - 1.922148672
657 RY*(3)H39 728 0.000150158 - 2.035416889
658 RY*(4)H39 729 0.000047775 - 2.591977546
659 RY*(5)H39 730 0.000044450 - 2.745942124
660 RY*(1)H40 731 0.001875710 - 0.992480850
661 RY*(2)H40 732 0.000368724 - 2.465607693
662 RY*(3)H40 733 0.000200608 - 2.049750244
663 RY*(4)H40 734 0.000054152 - 2.946502129
664 RY*(5)H40 735 0.000041520 - 2.666237571
665 RY*(1)H41 736 0.000639466 - 1.710063691
666 RY*(2)H41 737 0.000129015 - 2.215084963
667 RY*(3)H41 738 0.000103765 - 2.178804333
668 RY*(4)H41 739 0.000072508 - 1.779332276
669 RY*(5)H41 740 0.000049746 - 2.879508866
670 RY*(1)H42 741 0.000765107 - 1.681973817
671 RY*(2)H42 742 0.000122733 - 2.318167422
672 RY*(3)H42 743 0.000097786 - 2.030187926
673 RY*(4)H42 744 0.000062589 - 1.967202328
674 RY*(5)H42 745 0.000044316 - 2.836852569
675 RY*(1)C43 746 0.014591906 - 1.040378019
676 RY*(2)C43 747 0.006325282 - 1.219325649
677 RY*(3)C43 748 0.004000270 - 1.699778754
678 RY*(4)C43 749 0.003109936 - 2.103699104
679 RY*(5)C43 750 0.001864829 - 1.974636991
680 RY*(6)C43 751 0.001322285 - 1.439203469
681 RY*(7)C43 752 0.001121148 - 1.276611231
682 RY*(8)C43 753 0.000883329 - 1.469714990
683 RY*(9)C43 754 0.000735472 - 2.236072548
684 RY*(10)C43 755 0.000425557 - 2.036702156
685 RY*(11)C43 756 0.000365434 - 2.516511609
686 RY*(12)C43 757 0.000280044 - 1.939750847
687 RY*(13)C43 758 0.000148682 - 2.675369860
688 RY*(14)C43 759 0.000113770 - 2.319011491
689 RY*(15)C43 760 0.000078624 - 3.797364269
690 RY*(16)C43 761 0.000056079 - 3.251459435
691 RY*(17)C43 762 0.000055949 - 3.899113702
692 RY*(18)C43 763 0.000031859 - 4.262216157
693 RY*(19)C43 764 0.000015914 - 3.634643035
694 RY*(20)C43 765 0.000010680 - 12.306902307
695 RY*(21)C43 766 0.000014903 - 3.581292579
696 RY*(22)C43 767 0.000006268 - 3.647437569
697 RY*(1)C44 768 0.007539642 - 1.589333303
698 RY*(2)C44 769 0.004314567 - 1.065813637
699 RY*(3)C44 770 0.001460886 - 1.051753306
700 RY*(4)C44 771 0.001128272 - 1.196190037
701 RY*(5)C44 772 0.000850888 - 2.547637786
702 RY*(6)C44 773 0.000538964 - 3.048794310
703 RY*(7)C44 774 0.000483656 - 2.808984346
704 RY*(8)C44 775 0.000319635 - 2.723341643
705 RY*(9)C44 776 0.000250563 - 1.994191010
706 RY*(10)C44 777 0.000165708 - 2.307911179
707 RY*(11)C44 778 0.000115281 - 3.128077063
708 RY*(12)C44 779 0.000075419 - 1.925089167
709 RY*(13)C44 780 0.000055913 - 2.364427152
710 RY*(14)C44 781 0.000035907 - 2.669820576
711 RY*(15)C44 782 0.000021993 - 1.596856414
712 RY*(16)C44 783 0.000008799 - 3.177538596
713 RY*(17)C44 784 0.000008545 - 2.903490057
714 RY*(18)C44 785 0.000005506 - 3.362752634
715 RY*(19)C44 786 0.000006079 - 20.068031070
716 RY*(20)C44 787 0.000014194 - 1.506761009
717 RY*(21)C44 788 0.000008844 - 1.355839764
718 RY*(22)C44 789 0.000013775 - 2.639722883
719 RY*(1)C45 790 0.005924892 - 1.435202194
720 RY*(2)C45 791 0.002111670 - 1.222870245
721 RY*(3)C45 792 0.001003549 - 0.786463075
722 RY*(4)C45 793 0.000786152 - 2.143934822
723 RY*(5)C45 794 0.000548102 - 2.361499958
724 RY*(6)C45 795 0.000477176 - 2.054282328
725 RY*(7)C45 796 0.000236027 - 1.427144553
726 RY*(8)C45 797 0.000174641 - 2.575566067
727 RY*(9)C45 798 0.000095809 - 1.487950374
728 RY*(10)C45 799 0.000104257 - 2.139362419
729 RY*(11)C45 800 0.000057346 - 2.633781803
730 RY*(12)C45 801 0.000044287 - 1.669857634
731 RY*(13)C45 802 0.000040352 - 2.481315604
732 RY*(14)C45 803 0.000011911 - 2.643566730
733 RY*(15)C45 804 0.000008671 - 2.037371544
734 RY*(16)C45 805 0.000016860 - 1.944375892
735 RY*(17)C45 806 0.000002016 - 19.184184104
736 RY*(18)C45 807 0.000003152 - 3.448206238
737 RY*(19)C45 808 0.000010523 - 1.398927035
738 RY*(20)C45 809 0.000010677 - 3.136175144
739 RY*(21)C45 810 0.000010757 - 2.981330702
740 RY*(22)C45 811 0.000003102 - 3.189816705
741 RY*(1)C46 812 0.006457893 - 1.257274147
742 RY*(2)C46 813 0.002192944 - 1.257137790
743 RY*(3)C46 814 0.000900418 - 0.473373611
744 RY*(4)C46 815 0.000725098 - 2.000404154
745 RY*(5)C46 816 0.000429836 - 1.913616528
746 RY*(6)C46 817 0.000367170 - 2.758219236
747 RY*(7)C46 818 0.000138481 - 2.103059688
748 RY*(8)C46 819 0.000092484 - 3.917377304
749 RY*(9)C46 820 0.000045626 - 1.002864637
750 RY*(10)C46 821 0.000048962 - 1.380050043
751 RY*(11)C46 822 0.000036409 - 2.688311054
752 RY*(12)C46 823 0.000045124 - 2.395232180
753 RY*(13)C46 824 0.000024522 - 1.081971173
754 RY*(14)C46 825 0.000007573 - 2.698302963
755 RY*(15)C46 826 0.000001713 - 18.870085148
756 RY*(16)C46 827 0.000003154 - 1.661083162
757 RY*(17)C46 828 0.000006230 - 1.971221279
758 RY*(18)C46 829 0.000004388 - 2.952037980
759 RY*(19)C46 830 0.000005008 - 2.828751090
760 RY*(20)C46 831 0.000004403 - 2.922696356
761 RY*(21)C46 832 0.000006014 - 1.419779768
762 RY*(22)C46 833 0.000001113 - 2.769154184
763 RY*(1)C47 834 0.006345309 - 1.265492695
764 RY*(2)C47 835 0.002201295 - 1.317104109
765 RY*(3)C47 836 0.000868664 - 0.457703944
766 RY*(4)C47 837 0.000669983 - 1.668243351
767 RY*(5)C47 838 0.000638338 - 1.721674059
768 RY*(6)C47 839 0.000364376 - 2.982396622
769 RY*(7)C47 840 0.000155083 - 2.655819037
770 RY*(8)C47 841 0.000117059 - 1.820057600
771 RY*(9)C47 842 0.000057920 - 2.564198908
772 RY*(10)C47 843 0.000042065 - 1.549835941
773 RY*(11)C47 844 0.000030919 - 2.891891652
774 RY*(12)C47 845 0.000011123 - 2.671321719
775 RY*(13)C47 846 0.000002827 - 2.837418768
776 RY*(14)C47 847 0.000000733 - 19.778042641
777 RY*(15)C47 848 0.000003760 - 1.296239740
778 RY*(16)C47 849 0.000002622 - 2.618299046
779 RY*(17)C47 850 0.000001963 - 1.862098494
780 RY*(18)C47 851 0.000007864 - 3.066003193
781 RY*(19)C47 852 0.000004884 - 1.426964957
782 RY*(20)C47 853 0.000008779 - 1.448735673
783 RY*(21)C47 854 0.000000443 - 2.703733671
784 RY*(22)C47 855 0.000002709 - 1.487659797
785 RY*(1)C48 856 0.006392182 - 1.251789673
786 RY*(2)C48 857 0.002152112 - 1.304917433
787 RY*(3)C48 858 0.000841972 - 0.482392034
788 RY*(4)C48 859 0.000704256 - 1.908016912
789 RY*(5)C48 860 0.000491391 - 1.908026558
790 RY*(6)C48 861 0.000361245 - 2.808672118
791 RY*(7)C48 862 0.000117145 - 3.863018521
792 RY*(8)C48 863 0.000117182 - 1.573686127
793 RY*(9)C48 864 0.000044107 - 1.526389005
794 RY*(10)C48 865 0.000042999 - 1.031810960
795 RY*(11)C48 866 0.000039397 - 2.501940785
796 RY*(12)C48 867 0.000042007 - 1.940218430
797 RY*(13)C48 868 0.000010293 - 1.257314906
798 RY*(14)C48 869 0.000016141 - 1.455384036
799 RY*(15)C48 870 0.000002993 - 2.763999896
800 RY*(16)C48 871 0.000002772 - 2.852646853
801 RY*(17)C48 872 0.000009653 - 2.028868596
802 RY*(18)C48 873 0.000007863 - 3.009821793
803 RY*(19)C48 874 0.000001847 - 19.585069687
804 RY*(20)C48 875 0.000004722 - 2.514211766
805 RY*(21)C48 876 0.000001222 - 1.758538273
806 RY*(22)C48 877 0.000000658 - 2.932511672
807 RY*(1)C49 878 0.006175968 - 1.371110794
808 RY*(2)C49 879 0.002367452 - 1.114904606
809 RY*(3)C49 880 0.001020567 - 0.727841829
810 RY*(4)C49 881 0.000746077 - 1.907211210
811 RY*(5)C49 882 0.000578763 - 2.090569131
812 RY*(6)C49 883 0.000468942 - 2.121367142
813 RY*(7)C49 884 0.000344371 - 1.590308539
814 RY*(8)C49 885 0.000158741 - 2.496687907
815 RY*(9)C49 886 0.000097777 - 1.750948948
816 RY*(10)C49 887 0.000067542 - 2.104469862
817 RY*(11)C49 888 0.000047054 - 1.162306160
818 RY*(12)C49 889 0.000047129 - 3.547549244
819 RY*(13)C49 890 0.000028977 - 2.999976980
820 RY*(14)C49 891 0.000024347 - 1.796681234
821 RY*(15)C49 892 0.000007981 - 1.058936370
822 RY*(16)C49 893 0.000012848 - 2.972428986
823 RY*(17)C49 894 0.000007197 - 3.274483608
824 RY*(18)C49 895 0.000001768 - 3.398408070
825 RY*(19)C49 896 0.000001331 - 17.824599026
826 RY*(20)C49 897 0.000008965 - 3.290270474
827 RY*(21)C49 898 0.000010392 - 1.928707790
828 RY*(22)C49 899 0.000002077 - 3.239027571
829 RY*(1)H50 900 0.000586268 - 1.699222101
830 RY*(2)H50 901 0.000208804 - 1.963438059
831 RY*(3)H50 902 0.000147634 - 1.832045479
832 RY*(4)H50 903 0.000049535 - 2.570922700
833 RY*(5)H50 904 0.000040595 - 2.677873606
834 RY*(1)H51 905 0.000501300 - 1.179023996
835 RY*(2)H51 906 0.000198076 - 1.918685862
836 RY*(3)H51 907 0.000166482 - 2.114209929
837 RY*(4)H51 908 0.000052249 - 2.560764724
838 RY*(5)H51 909 0.000040098 - 2.669257082
839 RY*(1)H52 910 0.000443851 - 1.182703739
840 RY*(2)H52 911 0.000198290 - 1.918072964
841 RY*(3)H52 912 0.000165378 - 2.140862375
842 RY*(4)H52 913 0.000047700 - 2.551741496
843 RY*(5)H52 914 0.000035220 - 2.632069174
844 RY*(1)H53 915 0.000524956 - 1.210229797
845 RY*(2)H53 916 0.000201592 - 1.921917045
846 RY*(3)H53 917 0.000157766 - 2.066041211
847 RY*(4)H53 918 0.000043614 - 2.618198412
848 RY*(5)H53 919 0.000047624 - 2.696867330
849 RY*(1)H54 920 0.001414215 - 0.777301141
850 RY*(2)H54 921 0.000330415 - 2.385096918
851 RY*(3)H54 922 0.000187786 - 2.066481942
852 RY*(4)H54 923 0.000046037 - 2.967261364
853 RY*(5)H54 924 0.000045666 - 2.617836194
854 RY*(1)O55 925 0.002267083 - 0.892070742
855 RY*(2)O55 926 0.001792839 - 0.672327309
856 RY*(3)O55 927 0.001206845 - 0.512284085
857 RY*(4)O55 928 0.000202782 - 1.252897129
858 RY*(5)O55 929 0.000196593 - 1.953835026
859 RY*(6)O55 930 0.000175388 - 2.345455720
860 RY*(7)O55 931 0.000122009 - 2.282179345
861 RY*(8)O55 932 0.000101657 - 1.779163256
862 RY*(9)O55 933 0.000084268 - 2.623907520
863 RY*(10)O55 934 0.000065811 - 2.022090993
864 RY*(11)O55 935 0.000022563 - 1.500816490
865 RY*(12)O55 936 0.000016236 - 2.036799191
866 RY*(13)O55 937 0.000002590 - 4.994069667
867 RY*(14)O55 938 0.000001920 - 6.912053089
868 RY*(15)O55 939 0.000000111 - 49.354133362
869 RY*(16)O55 940 0.000001589 - 6.725171741
870 RY*(17)O55 941 0.000009800 - 1.963365928
871 RY*(18)O55 942 0.000001640 - 6.751241357
872 RY*(19)O55 943 0.000009687 - 5.159177823
873 RY*(20)O55 944 0.000002703 - 6.290063429
874 RY*(21)O55 945 0.000002556 - 4.958182828
875 RY*(22)O55 946 0.000000670 - 6.804541687
876 RY*(1)H56 947 0.001237502 - 0.956276309
877 RY*(2)H56 948 0.000205509 - 2.329910937
878 RY*(3)H56 949 0.000136743 - 2.495334693
879 RY*(4)H56 950 0.000087751 - 2.582996178
880 RY*(5)H56 951 0.000025380 - 3.157896194
881 RY*(1)O57 952 0.002332579 - 1.061807800
882 RY*(2)O57 953 0.001695916 - 0.770332525
883 RY*(3)O57 954 0.000425892 - 0.798728836
884 RY*(4)O57 955 0.000166594 - 2.029907989
885 RY*(5)O57 956 0.000150843 - 2.344856971
886 RY*(6)O57 957 0.000100910 - 1.871905079
887 RY*(7)O57 958 0.000085165 - 1.731660915
888 RY*(8)O57 959 0.000086106 - 2.059240998
889 RY*(9)O57 960 0.000048919 - 2.738196504
890 RY*(10)O57 961 0.000036732 - 2.035339627
891 RY*(11)O57 962 0.000011836 - 2.022413718
892 RY*(12)O57 963 0.000017589 - 4.573356238
893 RY*(13)O57 964 0.000015451 - 2.225934211
894 RY*(14)O57 965 0.000000776 - 6.837506766
895 RY*(15)O57 966 0.000010553 - 1.820619372
896 RY*(16)O57 967 0.000001381 - 6.731271600
897 RY*(17)O57 968 0.000000102 - 49.055880974
898 RY*(18)O57 969 0.000002212 - 6.785306226
899 RY*(19)O57 970 0.000001261 - 4.924563887
900 RY*(20)O57 971 0.000000838 - 6.814317089
901 RY*(21)O57 972 0.000004750 - 5.071688328
902 RY*(22)O57 973 0.000003212 - 6.514421275
903 RY*(1)H58 974 0.000720434 - 1.191373141
904 RY*(2)H58 975 0.000626070 - 2.054100467
905 RY*(3)H58 976 0.000297454 - 2.227810474
906 RY*(4)H58 977 0.000159488 - 2.643177739
907 RY*(5)H58 978 0.000043298 - 2.990538309
908 BD*(1)C1-C2 0.027169758 - 0.370451040
909 BD*(1)C1-C6 0.028010838 - 0.370981479
910 BD*(1)C1-C10 0.019269660 - 0.369998090
911 BD*(1)C1-N14 0.051220796 - 0.321943770
912 BD*(1)C2-H3 0.005847227 - 0.411020887
913 BD*(1)C2-H4 0.005799574 - 0.408685100
914 BD*(1)C2-H5 0.007373873 - 0.424780591
915 BD*(1)C6-H7 0.005792345 - 0.412627304
916 BD*(1)C6-H8 0.007265949 - 0.425129358
917 BD*(1)C6-H9 0.005857765 - 0.408913246
918 BD*(1)C10-H11 0.006584812 - 0.405393117
919 BD*(1)C10-H12 0.004502640 - 0.407229879
920 BD*(1)C10-H13 0.006575345 - 0.405898131
921 BD*(1)N14-C15 0.065296489 - 0.498020986
922 BD*(1)N14-H58 0.017619700 - 0.412621249
923 BD*(1)C15-C16 0.083401332 - 0.337247868
924 BD*(1)C15-O57 0.107924648 - 0.416729594
925 BD*(2)C15-O57 0.250897200 - 0.161597046
926 BD*(1)C16-C17 0.035313516 - 0.402132949
927 BD*(1)C16-N28 0.039274837 - 0.320254948
928 BD*(1)C16-H56 0.019003847 - 0.388684998
929 BD*(1)C17-C18 0.023268718 - 0.560177482
930 BD*(2)C17-C18 0.362643864 - 0.022085476
931 BD*(1)C17-C22 0.025953614 - 0.560605156
932 BD*(1)C18-C19 0.015472678 - 0.564666525
933 BD*(1)C18-H27 0.014856323 - 0.433589472
934 BD*(1)C19-C20 0.016225430 - 0.567160498
935 BD*(2)C19-C20 0.324279352 - 0.023989098
936 BD*(1)C19-H26 0.013660430 - 0.435222943
937 BD*(1)C20-C21 0.016317176 - 0.565313265
938 BD*(1)C20-H25 0.013842053 - 0.436914448
939 BD*(1)C21-C22 0.015809154 - 0.569003983
940 BD*(2)C21-C22 0.315327690 - 0.024720692
941 BD*(1)C21-H24 0.013756891 - 0.436023965
942 BD*(1)C22-H23 0.016136310 - 0.452542171
943 BD*(1)N28-C29 0.023357274 - 0.329713843
944 BD*(1)N28-C43 0.076853576 - 0.457152269
945 BD*(1)C29-C30 0.031115597 - 0.399508012
946 BD*(1)C29-H41 0.014721155 - 0.395726646
947 BD*(1)C29-H42 0.020480974 - 0.388557874
948 BD*(1)C30-C31 0.024799758 - 0.572806223
949 BD*(2)C30-C31 0.344158960 - 0.030915359
950 BD*(1)C30-C35 0.022368383 - 0.565098116
951 BD*(1)C31-C32 0.015908515 - 0.569890096
952 BD*(1)C31-H40 0.019018093 - 0.457287843
953 BD*(1)C32-C33 0.016285997 - 0.572198070
954 BD*(2)C32-C33 0.325768628 - 0.027822192
955 BD*(1)C32-H39 0.013956513 - 0.438545162
956 BD*(1)C33-C34 0.016416008 - 0.567398515
957 BD*(1)C33-H38 0.013924055 - 0.439240896
958 BD*(1)C34-C35 0.015100752 - 0.571917735
959 BD*(2)C34-C35 0.321716591 - 0.027018318
960 BD*(1)C34-H37 0.013654356 - 0.438117512
961 BD*(1)C35-H36 0.014922143 - 0.432735075
962 BD*(1)C43-C44 0.062653765 - 0.408486067
963 BD*(1)C43-O55 0.068749967 - 0.474004310
964 BD*(2)C43-O55 0.272085686 - 0.085632395
965 BD*(1)C44-C45 0.024263670 - 0.557891624
966 BD*(2)C44-C45 0.363817305 - 0.021685046
967 BD*(1)C44-C49 0.023097826 - 0.556023290
968 BD*(1)C45-C46 0.015923093 - 0.565009226
969 BD*(1)C45-H54 0.015317991 - 0.441667184
970 BD*(1)C46-C47 0.016098048 - 0.565037628
971 BD*(2)C46-C47 0.321714906 - 0.022830862
972 BD*(1)C46-H53 0.013684355 - 0.434386593
973 BD*(1)C47-C48 0.016278652 - 0.563630164
974 BD*(1)C47-H52 0.013689871 - 0.435844584
975 BD*(1)C48-C49 0.015168822 - 0.567523427
976 BD*(2)C48-C49 0.311099200 - 0.023690774
977 BD*(1)C48-H51 0.013690534 - 0.434485185
978 BD*(1)C49-H50 0.013923637 - 0.435788986

Quote

...THOSE SCIENCES ARE VAIN AND FULL OF ERRORS WHICH ARE NOT BORN FROM EXPERIMENT, THE MOTHER OF CERTAINTY... -- LEONARDO DA VINCI, 1452-1519