WebMO Job Summary

273180: C5H11(+1) isoamyl secondary carbocation, 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)
Method B3LYP
Stoichiometry C5H11(1+)
Symmetry C1
Basis 6-311+G(2d,p)
RB3LYP Energy -196.909317834 Hartree
Dipole Moment 1.7478 Debye
Server class (274124)
CPU time 208.3 sec

Rotational Constants

Constant Frequency (GHz) Frequency (cm-1)
a 6.2116018 0.20719673341
b 4.1190341 0.13739618827
c 3.0981724 0.10334390734

Partial Charges

Atom Symbol Charge
1 C -0.366930  
2 C 0.061020  
3 C -0.395180  
4 H 0.178026  
5 H 0.169304  
6 H 0.138469  
7 C 0.194275  
8 C -0.512737  
9 H 0.204942  
10 H 0.223964  
11 H 0.170945  
12 H 0.194461  
13 H 0.157254  
14 H 0.190882  
15 H 0.183801  
16 H 0.207503  

Molecular Orbitals

Orbital Symmetry Occupancy Spin Energy () Actions
1 - 2 - -10.47159
2 - 2 - -10.40955
3 - 2 - -10.39559
4 - 2 - -10.37744
5 - 2 - -10.34322
6 - 2 - -1.06655
7 - 2 - -0.95821
8 - 2 - -0.89429
9 - 2 - -0.85632
10 - 2 - -0.7574
11 - 2 - -0.71843
12 - 2 - -0.65486
13 - 2 - -0.64213
14 - 2 - -0.61604
15 - 2 - -0.61139
16 - 2 - -0.5946
17 - 2 - -0.58295
18 - 2 - -0.5664
19 - 2 - -0.5493
20 - 2 - -0.53268
21 - 0 - -0.29324
22 - 0 - -0.15601
23 - 0 - -0.12988
24 - 0 - -0.12345
25 - 0 - -0.11558
26 - 0 - -0.09159
27 - 0 - -0.09012
28 - 0 - -0.08796
29 - 0 - -0.08027
30 - 0 - -0.07364
31 - 0 - -0.06726
32 - 0 - -0.05355
33 - 0 - -0.04819
34 - 0 - -0.04506
35 - 0 - -0.03582
36 - 0 - -0.02929
37 - 0 - -0.02146
38 - 0 - -0.01908
39 - 0 - -0.00685
40 - 0 - 0.00663
41 - 0 - 0.0143
42 - 0 - 0.01841
43 - 0 - 0.02869
44 - 0 - 0.04422
45 - 0 - 0.04792
46 - 0 - 0.05335
47 - 0 - 0.05939
48 - 0 - 0.07085
49 - 0 - 0.08258
50 - 0 - 0.09402
51 - 0 - 0.10359
52 - 0 - 0.12109
53 - 0 - 0.12311
54 - 0 - 0.14005
55 - 0 - 0.15779
56 - 0 - 0.18542
57 - 0 - 0.20335
58 - 0 - 0.21223
59 - 0 - 0.23002
60 - 0 - 0.26078
61 - 0 - 0.26476
62 - 0 - 0.28728
63 - 0 - 0.30273
64 - 0 - 0.31377
65 - 0 - 0.32868
66 - 0 - 0.33364
67 - 0 - 0.35003
68 - 0 - 0.37194
69 - 0 - 0.37787
70 - 0 - 0.39043
71 - 0 - 0.39795
72 - 0 - 0.41522
73 - 0 - 0.41891
74 - 0 - 0.42923
75 - 0 - 0.44496
76 - 0 - 0.44923
77 - 0 - 0.46466
78 - 0 - 0.48161
79 - 0 - 0.48553
80 - 0 - 0.51026
81 - 0 - 0.52647
82 - 0 - 0.55095
83 - 0 - 0.55828
84 - 0 - 0.56934
85 - 0 - 0.58032
86 - 0 - 0.61677
87 - 0 - 0.62724
88 - 0 - 0.65272
89 - 0 - 0.69685
90 - 0 - 0.73971
91 - 0 - 0.74557
92 - 0 - 0.77751
93 - 0 - 0.81791
94 - 0 - 0.83461
95 - 0 - 0.86738
96 - 0 - 0.89828
97 - 0 - 0.92356
98 - 0 - 0.95678
99 - 0 - 0.958
100 - 0 - 0.9856
101 - 0 - 1.01668
102 - 0 - 1.05715
103 - 0 - 1.07186
104 - 0 - 1.08648
105 - 0 - 1.10458
106 - 0 - 1.12147
107 - 0 - 1.12623
108 - 0 - 1.17256
109 - 0 - 1.20262
110 - 0 - 1.22159
111 - 0 - 1.25282
112 - 0 - 1.28683
113 - 0 - 1.29988
114 - 0 - 1.32434
115 - 0 - 1.35559
116 - 0 - 1.50438
117 - 0 - 1.54126
118 - 0 - 1.57223
119 - 0 - 1.61444
120 - 0 - 1.62397
121 - 0 - 1.65697
122 - 0 - 1.70116
123 - 0 - 1.73436
124 - 0 - 1.75632
125 - 0 - 1.80434
126 - 0 - 1.87363
127 - 0 - 1.89865
128 - 0 - 1.97002
129 - 0 - 1.99206
130 - 0 - 2.01529
131 - 0 - 2.02948
132 - 0 - 2.06855
133 - 0 - 2.07221
134 - 0 - 2.08182
135 - 0 - 2.09779
136 - 0 - 2.10269
137 - 0 - 2.14457
138 - 0 - 2.16157
139 - 0 - 2.19073
140 - 0 - 2.20407
141 - 0 - 2.23792
142 - 0 - 2.24119
143 - 0 - 2.33123
144 - 0 - 2.33561
145 - 0 - 2.34574
146 - 0 - 2.40371
147 - 0 - 2.46002
148 - 0 - 2.49163
149 - 0 - 2.50558
150 - 0 - 2.5095
151 - 0 - 2.53692
152 - 0 - 2.56277
153 - 0 - 2.58491
154 - 0 - 2.61255
155 - 0 - 2.71264
156 - 0 - 2.71702
157 - 0 - 2.74052
158 - 0 - 2.80738
159 - 0 - 2.85413
160 - 0 - 2.87946
161 - 0 - 2.9671
162 - 0 - 2.98675
163 - 0 - 2.99853
164 - 0 - 3.03122
165 - 0 - 3.08094
166 - 0 - 3.10255
167 - 0 - 3.13945
168 - 0 - 3.14983
169 - 0 - 3.20099
170 - 0 - 3.26808
171 - 0 - 3.28321
172 - 0 - 3.29096
173 - 0 - 3.31269
174 - 0 - 3.33573
175 - 0 - 3.3621
176 - 0 - 3.3748
177 - 0 - 3.40137
178 - 0 - 3.41126
179 - 0 - 3.4299
180 - 0 - 3.49167
181 - 0 - 3.50587
182 - 0 - 3.52444
183 - 0 - 3.56985
184 - 0 - 3.5943
185 - 0 - 3.68977
186 - 0 - 3.7559
187 - 0 - 3.9434
188 - 0 - 3.99039
189 - 0 - 4.00878
190 - 0 - 4.05043
191 - 0 - 4.06762
192 - 0 - 4.08729
193 - 0 - 4.10761
194 - 0 - 4.26428
195 - 0 - 4.31781
196 - 0 - 4.64874
197 - 0 - 23.60342
198 - 0 - 23.69727
199 - 0 - 23.79484
200 - 0 - 23.82524
201 - 0 - 23.88945
Electron density
Electrostatic potential
Electrophilic (HOMO) frontier density
Nucleophilic (LUMO) frontier density
Radical frontier density

Natural Population Analysis

Atom Symbol Charge
1 C -0.51977  
2 C -0.26039  
3 C -0.58860  
4 H 0.24250  
5 H 0.23911  
6 H 0.21919  
7 C 0.26380  
8 C -0.67588  
9 H 0.27343  
10 H 0.30454  
11 H 0.24779  
12 H 0.23123  
13 H 0.26118  
14 H 0.24549  
15 H 0.23444  
16 H 0.28192  

Natural Atomic Orbitals

Orbital Description Occupancy Spin Energy () Actions
1 C1 Cor(1S) 1.999223614 - -10.263491530
2 C1 Val(2S) 1.140298171 - -0.507085705
3 C1 Ryd(4S) 0.000696499 - 0.943272008
4 C1 Ryd(3S) 0.000287219 - 0.311327871
5 C1 Ryd(5S) 0.000000671 - 23.201426266
6 C1 Val(2p) 1.220525289 - -0.316024683
7 C1 Ryd(4p) 0.001541936 - 0.395413503
8 C1 Ryd(3p) 0.000144833 - 0.120383658
9 C1 Ryd(5p) 0.000029355 - 3.102627912
10 C1 Val(2p) 1.030837798 - -0.303721952
11 C1 Ryd(4p) 0.002006266 - 0.378270085
12 C1 Ryd(3p) 0.000376717 - 0.103001879
13 C1 Ryd(5p) 0.000038016 - 3.063200460
14 C1 Val(2p) 1.116361749 - -0.307261439
15 C1 Ryd(4p) 0.001125505 - 0.334549114
16 C1 Ryd(3p) 0.000252452 - 0.063981790
17 C1 Ryd(5p) 0.000044632 - 3.018392610
18 C1 Ryd(3d) 0.000958186 - 1.289409607
19 C1 Ryd(4d) 0.000106647 - 2.926028358
20 C1 Ryd(3d) 0.001041521 - 1.242729706
21 C1 Ryd(4d) 0.000058008 - 2.874894423
22 C1 Ryd(3d) 0.001508326 - 1.337846923
23 C1 Ryd(4d) 0.000091874 - 3.015067974
24 C1 Ryd(3d) 0.000955257 - 1.339648125
25 C1 Ryd(4d) 0.000073445 - 3.028303159
26 C1 Ryd(3d) 0.001084968 - 1.340573837
27 C1 Ryd(4d) 0.000099345 - 3.011581882
28 C2 Cor(1S) 1.999079034 - -10.265523475
29 C2 Val(2S) 0.990751861 - -0.439051937
30 C2 Ryd(3S) 0.001430387 - 0.797029132
31 C2 Ryd(4S) 0.000575504 - 0.836763471
32 C2 Ryd(5S) 0.000003821 - 22.856328460
33 C2 Val(2p) 1.097453221 - -0.320743518
34 C2 Ryd(3p) 0.002755084 - 0.442344045
35 C2 Ryd(4p) 0.000521167 - 0.508169235
36 C2 Ryd(5p) 0.000140557 - 2.901723444
37 C2 Val(2p) 1.019164709 - -0.314648895
38 C2 Ryd(4p) 0.002908228 - 0.520902587
39 C2 Ryd(3p) 0.000403328 - 0.486886532
40 C2 Ryd(5p) 0.000103998 - 2.755728321
41 C2 Val(2p) 1.131413428 - -0.314697693
42 C2 Ryd(4p) 0.005792970 - 0.565916668
43 C2 Ryd(3p) 0.000331661 - 0.515601597
44 C2 Ryd(5p) 0.000091904 - 2.832716583
45 C2 Ryd(3d) 0.000925166 - 1.308422970
46 C2 Ryd(4d) 0.000410757 - 3.070120359
47 C2 Ryd(3d) 0.000660230 - 1.305663857
48 C2 Ryd(4d) 0.000331923 - 3.070284297
49 C2 Ryd(3d) 0.001852499 - 1.377128477
50 C2 Ryd(4d) 0.000121296 - 3.212737907
51 C2 Ryd(3d) 0.001512487 - 1.506201308
52 C2 Ryd(4d) 0.000224686 - 3.282587386
53 C2 Ryd(3d) 0.001286509 - 1.337974023
54 C2 Ryd(4d) 0.000139715 - 3.095276569
55 C3 Cor(1S) 1.999306274 - -10.199370441
56 C3 Val(2S) 1.084277243 - -0.424880620
57 C3 Ryd(4S) 0.000750624 - 0.697572301
58 C3 Ryd(3S) 0.000133406 - 0.485597051
59 C3 Ryd(5S) 0.000001391 - 23.111504732
60 C3 Val(2p) 1.201360081 - -0.274655463
61 C3 Ryd(4p) 0.002831561 - 0.426974683
62 C3 Ryd(3p) 0.000201662 - 0.129881394
63 C3 Ryd(5p) 0.000017097 - 3.083549664
64 C3 Val(2p) 1.102001731 - -0.266792510
65 C3 Ryd(4p) 0.002369034 - 0.405110463
66 C3 Ryd(3p) 0.000369540 - 0.104367281
67 C3 Ryd(5p) 0.000064020 - 3.093801138
68 C3 Val(2p) 1.186797801 - -0.269737454
69 C3 Ryd(4p) 0.001949459 - 0.412504671
70 C3 Ryd(3p) 0.000223226 - 0.093067720
71 C3 Ryd(5p) 0.000051945 - 3.074384294
72 C3 Ryd(3d) 0.000829335 - 1.397415366
73 C3 Ryd(4d) 0.000147258 - 2.889461650
74 C3 Ryd(3d) 0.001181695 - 1.355486440
75 C3 Ryd(4d) 0.000040987 - 2.830799426
76 C3 Ryd(3d) 0.001345674 - 1.499783605
77 C3 Ryd(4d) 0.000101752 - 3.027198717
78 C3 Ryd(3d) 0.001072184 - 1.469301262
79 C3 Ryd(4d) 0.000090884 - 3.034415211
80 C3 Ryd(3d) 0.000960739 - 1.401147461
81 C3 Ryd(4d) 0.000123760 - 2.918270901
82 H4 Val(1S) 0.756680689 - -0.119658688
83 H4 Ryd(2S) 0.000291520 - 0.848539060
84 H4 Ryd(3S) 0.000071912 - 1.653406700
85 H4 Ryd(2p) 0.000115199 - 1.826145311
86 H4 Ryd(2p) 0.000213035 - 2.439856506
87 H4 Ryd(2p) 0.000128691 - 2.113607723
88 H5 Val(1S) 0.759991595 - -0.117711550
89 H5 Ryd(2S) 0.000379314 - 0.770577873
90 H5 Ryd(3S) 0.000073804 - 1.732595955
91 H5 Ryd(2p) 0.000234763 - 2.648055150
92 H5 Ryd(2p) 0.000099250 - 1.931807803
93 H5 Ryd(2p) 0.000106658 - 1.827836696
94 H6 Val(1S) 0.779563503 - -0.130853772
95 H6 Ryd(2S) 0.000649817 - 0.588679173
96 H6 Ryd(3S) 0.000068988 - 1.950173839
97 H6 Ryd(2p) 0.000125677 - 1.952848057
98 H6 Ryd(2p) 0.000147957 - 1.931403007
99 H6 Ryd(2p) 0.000257740 - 2.500838573
100 C7 Cor(1S) 1.999165599 - -10.327207804
101 C7 Val(2S) 1.020633425 - -0.476490304
102 C7 Ryd(3S) 0.001204560 - 0.716710124
103 C7 Ryd(4S) 0.000453449 - 0.972132120
104 C7 Ryd(5S) 0.000004393 - 22.290015119
105 C7 Val(2p) 1.014506548 - -0.290429385
106 C7 Ryd(3p) 0.002984959 - 0.348387922
107 C7 Ryd(4p) 0.000693163 - 0.421293224
108 C7 Ryd(5p) 0.000080404 - 3.118228705
109 C7 Val(2p) 0.782711485 - -0.325560393
110 C7 Ryd(4p) 0.002487244 - 0.417508389
111 C7 Ryd(3p) 0.000345868 - 0.401418206
112 C7 Ryd(5p) 0.000049090 - 2.689618303
113 C7 Val(2p) 0.902289030 - -0.319160878
114 C7 Ryd(4p) 0.002478907 - 0.431755155
115 C7 Ryd(3p) 0.000455239 - 0.379277583
116 C7 Ryd(5p) 0.000027876 - 2.773578856
117 C7 Ryd(3d) 0.001002139 - 1.558578944
118 C7 Ryd(4d) 0.000147973 - 2.892164006
119 C7 Ryd(3d) 0.001019375 - 1.623573251
120 C7 Ryd(4d) 0.000294229 - 3.014628698
121 C7 Ryd(3d) 0.000947733 - 1.561718419
122 C7 Ryd(4d) 0.000096199 - 2.894564395
123 C7 Ryd(3d) 0.001145902 - 1.625766873
124 C7 Ryd(4d) 0.000263836 - 2.937056615
125 C7 Ryd(3d) 0.000565436 - 1.433444775
126 C7 Ryd(4d) 0.000143823 - 2.740456519
127 C8 Cor(1S) 1.999221518 - -10.230914639
128 C8 Val(2S) 1.100773587 - -0.470139353
129 C8 Ryd(4S) 0.001747449 - 0.715293256
130 C8 Ryd(3S) 0.000095700 - 0.420870715
131 C8 Ryd(5S) 0.000001097 - 23.019298334
132 C8 Val(2p) 1.166432404 - -0.313966574
133 C8 Ryd(4p) 0.003746951 - 0.395379019
134 C8 Ryd(3p) 0.000196458 - 0.107921838
135 C8 Ryd(5p) 0.000033438 - 2.974663074
136 C8 Val(2p) 1.203532290 - -0.316745999
137 C8 Ryd(4p) 0.001953427 - 0.373818898
138 C8 Ryd(3p) 0.000131999 - 0.115677585
139 C8 Ryd(5p) 0.000047404 - 2.987582286
140 C8 Val(2p) 1.189036684 - -0.315897991
141 C8 Ryd(4p) 0.001884164 - 0.389707112
142 C8 Ryd(3p) 0.000178571 - 0.101911474
143 C8 Ryd(5p) 0.000079584 - 3.038288744
144 C8 Ryd(3d) 0.001595747 - 1.497544615
145 C8 Ryd(4d) 0.000027493 - 3.000214262
146 C8 Ryd(3d) 0.001739837 - 1.526019370
147 C8 Ryd(4d) 0.000041339 - 2.986378009
148 C8 Ryd(3d) 0.001758107 - 1.490727254
149 C8 Ryd(4d) 0.000095668 - 2.994844129
150 C8 Ryd(3d) 0.000308599 - 1.219408121
151 C8 Ryd(4d) 0.000169978 - 2.755544141
152 C8 Ryd(3d) 0.000890425 - 1.233431457
153 C8 Ryd(4d) 0.000159374 - 2.751534606
154 H9 Val(1S) 0.725474328 - -0.147561204
155 H9 Ryd(2S) 0.000580179 - 0.681461191
156 H9 Ryd(3S) 0.000069321 - 1.761998888
157 H9 Ryd(2p) 0.000200367 - 2.204708520
158 H9 Ryd(2p) 0.000144675 - 2.189327944
159 H9 Ryd(2p) 0.000102414 - 1.897064500
160 H10 Val(1S) 0.694313076 - -0.162425923
161 H10 Ryd(2S) 0.000604783 - 0.721029078
162 H10 Ryd(3S) 0.000054085 - 1.709674684
163 H10 Ryd(2p) 0.000182486 - 1.987390955
164 H10 Ryd(2p) 0.000166657 - 2.066812892
165 H10 Ryd(2p) 0.000136788 - 2.058902371
166 H11 Val(1S) 0.750915304 - -0.144939428
167 H11 Ryd(2S) 0.000704045 - 0.591605754
168 H11 Ryd(3S) 0.000068039 - 1.889162281
169 H11 Ryd(2p) 0.000147740 - 2.017011094
170 H11 Ryd(2p) 0.000171376 - 2.002005102
171 H11 Ryd(2p) 0.000202883 - 2.346793631
172 H12 Val(1S) 0.767703832 - -0.164772334
173 H12 Ryd(2S) 0.000344068 - 0.992728690
174 H12 Ryd(3S) 0.000120224 - 1.531241855
175 H12 Ryd(2p) 0.000106679 - 2.277670514
176 H12 Ryd(2p) 0.000227821 - 2.102140132
177 H12 Ryd(2p) 0.000266653 - 2.276826618
178 H13 Val(1S) 0.737420679 - -0.138375602
179 H13 Ryd(2S) 0.000735533 - 0.658242902
180 H13 Ryd(3S) 0.000094171 - 1.943827256
181 H13 Ryd(2p) 0.000119371 - 2.276424780
182 H13 Ryd(2p) 0.000146885 - 2.027816662
183 H13 Ryd(2p) 0.000299842 - 2.579556035
184 H14 Val(1S) 0.753620411 - -0.150081324
185 H14 Ryd(2S) 0.000264957 - 0.927948218
186 H14 Ryd(3S) 0.000078711 - 1.505529304
187 H14 Ryd(2p) 0.000135098 - 1.996753233
188 H14 Ryd(2p) 0.000308466 - 2.409101553
189 H14 Ryd(2p) 0.000101600 - 1.913769971
190 H15 Val(1S) 0.764471256 - -0.146381461
191 H15 Ryd(2S) 0.000483307 - 0.799297385
192 H15 Ryd(3S) 0.000071120 - 1.686315931
193 H15 Ryd(2p) 0.000112698 - 1.842517920
194 H15 Ryd(2p) 0.000111550 - 1.894188097
195 H15 Ryd(2p) 0.000308451 - 2.574485404
196 H16 Val(1S) 0.717025247 - -0.139085158
197 H16 Ryd(2S) 0.000420837 - 1.007171035
198 H16 Ryd(3S) 0.000068217 - 1.412897050
199 H16 Ryd(2p) 0.000273327 - 2.575469481
200 H16 Ryd(2p) 0.000170865 - 1.877763217
201 H16 Ryd(2p) 0.000117494 - 1.829585616

Natural Hybrid Orbitals

Orbital Description Occupancy Spin Energy () Actions
1 BD(1)C1(C2) 1s(24.82%)p3.02(75.03%)d0.01(0.15%) 0.837596556 - -0.348645259
2 BD(1)C2(C1) 2s(16.97%)p4.88(82.83%)d0.01(0.20%) 0.925482242 - -0.341621321
3 BD(1)C1(H14) 1s(28.84%)p2.46(71.05%)d0.00(0.11%) 1.227877183 - -0.369273206
4 BD(1)H14(C1) 14s(99.96%)p0.00(0.04%) 0.753888746 - -0.148550650
5 BD(1)C1(H15) 1s(26.77%)p2.73(73.13%)d0.00(0.11%) 1.235133887 - -0.362254508
6 BD(1)H15(C1) 15s(99.97%)p0.00(0.03%) 0.764735382 - -0.144462141
7 BD(1)C1(H16) 1s(19.43%)p4.14(80.46%)d0.01(0.11%) 1.215243028 - -0.344758144
8 BD(1)H16(C1) 16s(99.96%)p0.00(0.04%) 0.717278756 - -0.137205542
9 BD(1)C2(C3) 2s(30.96%)p2.23(68.99%)d0.00(0.05%) 1.073471305 - -0.348174958
10 BD(1)C3(C2) 3s(28.41%)p2.52(71.47%)d0.00(0.12%) 0.919452252 - -0.274823134
11 BD(1)C2(C7) 2s(29.44%)p2.39(70.40%)d0.01(0.15%) 1.008867254 - -0.327598969
12 BD(1)C7(C2) 7s(36.72%)p1.72(63.17%)d0.00(0.11%) 0.999074202 - -0.323925791
13 BD(1)C2(H13) 2s(22.59%)p3.42(77.29%)d0.01(0.11%) 1.240969427 - -0.354468889
14 BD(1)H13(C2) 13s(99.96%)p0.00(0.04%) 0.737693836 - -0.136363408
15 BD(1)C3(H4) 3s(23.59%)p3.24(76.30%)d0.00(0.11%) 1.223015491 - -0.314819753
16 BD(1)H4(C3) 4s(99.98%)p0.00(0.02%) 0.756867877 - -0.118508475
17 BD(1)C3(H5) 3s(23.76%)p3.20(76.13%)d0.00(0.11%) 1.228066115 - -0.313511096
18 BD(1)H5(C3) 5s(99.98%)p0.00(0.02%) 0.760177454 - -0.116522037
19 BD(1)C3(H6) 3s(24.23%)p3.12(75.65%)d0.00(0.11%) 1.212182088 - -0.316804321
20 BD(1)H6(C3) 6s(99.97%)p0.00(0.03%) 0.779786361 - -0.129319410
21 BD(1)C7(C8) 7s(35.14%)p1.84(64.78%)d0.00(0.09%) 1.017986433 - -0.353006929
22 BD(1)C8(C7) 8s(30.09%)p2.32(69.76%)d0.01(0.15%) 0.982731284 - -0.323095707
23 BD(1)C7(H12) 7s(27.44%)p2.64(72.46%)d0.00(0.10%) 1.225718662 - -0.379693478
24 BD(1)H12(C7) 12s(99.95%)p0.00(0.05%) 0.768102874 - -0.162352296
25 BD(1)C8(H9) 8s(23.47%)p3.26(76.42%)d0.00(0.11%) 1.236765569 - -0.357332580
26 BD(1)H9(C8) 9s(99.98%)p0.00(0.02%) 0.725660271 - -0.146106371
27 BD(1)C8(H10) 8s(20.86%)p3.79(78.99%)d0.01(0.15%) 1.210115008 - -0.359678743
28 BD(1)H10(C8) 10s(99.97%)p0.00(0.03%) 0.694513028 - -0.161265068
29 BD(1)C8(H11) 8s(25.67%)p2.89(74.23%)d0.00(0.10%) 1.240190845 - -0.358614066
30 BD(1)H11(C8) 11s(99.98%)p0.00(0.02%) 0.751108651 - -0.143154846
31 CR(1)C1 s(100.00%)p0.00(0.00%) 1.999175470 - -10.262165583
32 CR(1)C2 s(100.00%)p0.00(0.00%) 1.999077963 - -10.265466295
33 CR(1)C3 s(100.00%)p0.00(0.00%) 1.999303003 - -10.199278133
34 CR(1)C7 s(100.00%)p0.00(0.00%) 1.999166115 - -10.327472898
35 CR(1)C8 s(100.00%)p0.00(0.00%) 1.999219444 - -10.231035225
36 LP*(1)C7 s(0.63%)p99.99(99.28%)d0.14(0.09%) 0.483688510 - -0.335909064
37 RY*(1)C1 s(26.85%)p2.47(66.42%)d0.25(6.73%) 0.001893734 - 0.690201831
38 RY*(2)C1 s(2.42%)p36.46(88.29%)d3.84(9.29%) 0.001457742 - 0.554153766
39 RY*(3)C1 s(41.34%)p0.54(22.45%)d0.88(36.22%) 0.000506264 - 1.155743793
40 RY*(4)C1 s(5.37%)p15.64(83.99%)d1.98(10.64%) 0.000352827 - 0.480929435
41 RY*(5)C1 s(8.65%)p2.83(24.50%)d7.73(66.85%) 0.000209035 - 0.998451772
42 RY*(6)C1 s(3.11%)p14.65(45.52%)d16.53(51.38%) 0.000117259 - 0.498945260
43 RY*(7)C1 s(18.10%)p2.33(42.24%)d2.19(39.66%) 0.000087171 - 0.797238977
44 RY*(8)C1 s(4.36%)p18.59(81.01%)d3.36(14.63%) 0.000044131 - 0.718431769
45 RY*(9)C1 s(21.85%)p1.24(27.01%)d2.34(51.14%) 0.000022490 - 1.318567052
46 RY*(10)C1 s(6.67%)p3.75(25.03%)d10.24(68.30%) 0.000027310 - 0.716979912
47 RY*(11)C1 s(99.81%)p0.00(0.13%)d0.00(0.06%) 0.000000144 - 23.077860084
48 RY*(12)C1 s(4.02%)p22.38(90.00%)d1.49(5.98%) 0.000001328 - 2.691568647
49 RY*(13)C1 s(36.13%)p1.59(57.45%)d0.18(6.42%) 0.000003194 - 0.252340063
50 RY*(14)C1 s(0.43%)p12.58(5.42%)d99.99(94.15%) 0.000000667 - 3.097566129
51 RY*(15)C1 s(1.39%)p16.93(23.49%)d54.13(75.12%) 0.000003214 - 1.292703641
52 RY*(16)C1 s(4.77%)p3.44(16.41%)d16.53(78.82%) 0.000002811 - 2.356738080
53 RY*(17)C1 s(5.53%)p14.76(81.68%)d2.31(12.79%) 0.000002124 - 2.451353710
54 RY*(18)C1 s(0.64%)p7.83(4.99%)d99.99(94.38%) 0.000001466 - 3.089693319
55 RY*(19)C1 s(0.71%)p99.99(89.12%)d14.30(10.17%) 0.000001511 - 2.858261623
56 RY*(20)C1 s(1.57%)p1.93(3.03%)d60.57(95.39%) 0.000002347 - 3.152871695
57 RY*(21)C1 s(2.97%)p5.96(17.70%)d26.73(79.33%) 0.000004576 - 1.192174374
58 RY*(22)C1 s(3.45%)p1.29(4.46%)d26.68(92.09%) 0.000000832 - 2.988667611
59 RY*(1)C2 s(0.65%)p99.99(92.26%)d10.95(7.09%) 0.006437255 - 0.777834929
60 RY*(2)C2 s(4.48%)p20.65(92.40%)d0.70(3.13%) 0.001954345 - 0.898398889
61 RY*(3)C2 s(28.73%)p1.18(33.86%)d1.30(37.42%) 0.001175351 - 1.003208998
62 RY*(4)C2 s(10.81%)p4.70(50.82%)d3.55(38.37%) 0.000923640 - 1.223980013
63 RY*(5)C2 s(8.02%)p8.09(64.93%)d3.37(27.05%) 0.000621858 - 1.004794475
64 RY*(6)C2 s(49.56%)p0.59(29.44%)d0.42(21.00%) 0.000438314 - 1.362666448
65 RY*(7)C2 s(8.37%)p1.79(14.97%)d9.16(76.66%) 0.000392104 - 2.096817559
66 RY*(8)C2 s(7.38%)p1.35(9.98%)d11.20(82.64%) 0.000195536 - 2.513597180
67 RY*(9)C2 s(9.56%)p3.60(34.40%)d5.86(56.04%) 0.000118288 - 1.929872214
68 RY*(10)C2 s(28.71%)p1.51(43.37%)d0.97(27.92%) 0.000104160 - 1.409925436
69 RY*(11)C2 s(5.40%)p4.52(24.39%)d13.01(70.21%) 0.000053773 - 2.264170055
70 RY*(12)C2 s(1.29%)p28.13(36.28%)d48.42(62.44%) 0.000054985 - 1.835498804
71 RY*(13)C2 s(9.15%)p1.92(17.53%)d8.02(73.32%) 0.000018044 - 1.772877488
72 RY*(14)C2 s(2.20%)p17.33(38.08%)d27.18(59.72%) 0.000020623 - 1.179051073
73 RY*(15)C2 s(1.51%)p48.17(72.67%)d17.12(25.82%) 0.000000000 - 2.634363091
74 RY*(16)C2 s(0.96%)p18.35(17.59%)d84.94(81.45%) 0.000000405 - 2.616802217
75 RY*(17)C2 s(98.67%)p0.01(0.75%)d0.01(0.59%) 0.000000003 - 22.301310364
76 RY*(18)C2 s(3.38%)p19.82(67.06%)d8.73(29.55%) 0.000000118 - 0.977256303
77 RY*(19)C2 s(8.23%)p9.58(78.91%)d1.56(12.86%) 0.000000446 - 2.316554802
78 RY*(20)C2 s(4.01%)p17.23(69.15%)d6.69(26.84%) 0.000000064 - 2.405724626
79 RY*(21)C2 s(2.80%)p3.19(8.94%)d31.47(88.26%) 0.000000251 - 1.198835078
80 RY*(22)C2 s(6.17%)p0.44(2.71%)d14.76(91.11%) 0.000008374 - 2.845632102
81 RY*(1)C3 s(9.48%)p8.88(84.20%)d0.67(6.32%) 0.002877483 - 0.651680750
82 RY*(2)C3 s(0.15%)p99.99(95.18%)d30.71(4.67%) 0.002438344 - 0.519631778
83 RY*(3)C3 s(12.15%)p6.27(76.12%)d0.97(11.73%) 0.000481910 - 1.537844459
84 RY*(4)C3 s(21.34%)p1.84(39.37%)d1.84(39.30%) 0.000281927 - 0.899457778
85 RY*(5)C3 s(15.84%)p2.58(40.93%)d2.73(43.23%) 0.000182718 - 0.738584262
86 RY*(6)C3 s(5.41%)p8.56(46.32%)d8.92(48.27%) 0.000127561 - 0.654298177
87 RY*(7)C3 s(12.30%)p4.09(50.27%)d3.04(37.42%) 0.000091177 - 0.481906991
88 RY*(8)C3 s(18.03%)p0.63(11.43%)d3.91(70.54%) 0.000044211 - 1.212504880
89 RY*(9)C3 s(15.47%)p2.94(45.49%)d2.52(39.04%) 0.000019843 - 1.867875455
90 RY*(10)C3 s(99.55%)p0.00(0.11%)d0.00(0.34%) 0.000000116 - 22.988416469
91 RY*(11)C3 s(3.23%)p21.55(69.69%)d8.37(27.08%) 0.000001011 - 2.232936122
92 RY*(12)C3 s(0.25%)p99.99(94.27%)d22.10(5.48%) 0.000001108 - 2.622047773
93 RY*(13)C3 s(46.49%)p0.61(28.55%)d0.54(24.96%) 0.000003051 - 0.927562863
94 RY*(14)C3 s(1.57%)p5.16(8.11%)d57.42(90.32%) 0.000000578 - 2.904418635
95 RY*(15)C3 s(0.30%)p16.86(5.11%)d99.99(94.59%) 0.000004800 - 1.223230839
96 RY*(16)C3 s(0.87%)p16.65(14.51%)d97.09(84.62%) 0.000001175 - 2.625082658
97 RY*(17)C3 s(26.97%)p2.24(60.28%)d0.47(12.74%) 0.000004908 - 0.680212361
98 RY*(18)C3 s(0.20%)p11.99(2.38%)d99.99(97.42%) 0.000000644 - 3.226068312
99 RY*(19)C3 s(0.07%)p99.99(8.09%)d99.99(91.84%) 0.000007623 - 1.455664157
100 RY*(20)C3 s(4.08%)p4.75(19.40%)d18.75(76.52%) 0.000008551 - 2.405796520
101 RY*(21)C3 s(0.13%)p99.99(95.85%)d31.08(4.02%) 0.000002097 - 2.075934778
102 RY*(22)C3 s(6.13%)p0.78(4.77%)d14.54(89.10%) 0.000000580 - 2.994239367
103 RY*(1)H4 s(87.81%)p0.14(12.19%) 0.000329141 - 1.072497755
104 RY*(2)H4 s(2.80%)p34.73(97.20%) 0.000118588 - 1.811660215
105 RY*(3)H4 s(32.87%)p2.04(67.13%) 0.000122591 - 1.856586681
106 RY*(4)H4 s(57.86%)p0.73(42.14%) 0.000050532 - 2.045946590
107 RY*(5)H4 s(18.69%)p4.35(81.31%) 0.000012316 - 2.093713845
108 RY*(1)H5 s(93.45%)p0.07(6.55%) 0.000403548 - 0.908393061
109 RY*(2)H5 s(29.74%)p2.36(70.26%) 0.000113897 - 1.873088222
110 RY*(3)H5 s(12.60%)p6.94(87.40%) 0.000113345 - 1.797843908
111 RY*(4)H5 s(48.63%)p1.06(51.37%) 0.000051554 - 2.138987992
112 RY*(5)H5 s(15.61%)p5.41(84.39%) 0.000025586 - 2.191370780
113 RY*(1)H6 s(97.94%)p0.02(2.06%) 0.000662638 - 0.646860622
114 RY*(2)H6 s(9.10%)p9.99(90.90%) 0.000145756 - 1.941020657
115 RY*(3)H6 s(0.36%)p99.99(99.64%) 0.000112063 - 1.795825228
116 RY*(4)H6 s(76.76%)p0.30(23.24%) 0.000065422 - 2.287025986
117 RY*(5)H6 s(15.87%)p5.30(84.13%) 0.000041442 - 2.251675793
118 RY*(1)C7 s(2.34%)p37.09(86.98%)d4.55(10.67%) 0.004418607 - 0.821752247
119 RY*(2)C7 s(2.98%)p31.77(94.76%)d0.76(2.25%) 0.002645435 - 0.521921752
120 RY*(3)C7 s(36.15%)p0.64(23.22%)d1.12(40.63%) 0.001114789 - 1.165045901
121 RY*(4)C7 s(43.17%)p0.60(26.12%)d0.71(30.72%) 0.000743738 - 0.925465332
122 RY*(5)C7 s(17.18%)p2.89(49.67%)d1.93(33.15%) 0.000545755 - 1.284542735
123 RY*(6)C7 s(10.31%)p1.20(12.34%)d7.50(77.35%) 0.000390595 - 1.313517983
124 RY*(7)C7 s(3.64%)p7.17(26.10%)d19.30(70.26%) 0.000278841 - 1.485181727
125 RY*(8)C7 s(22.93%)p2.25(51.58%)d1.11(25.49%) 0.000160785 - 0.751685269
126 RY*(9)C7 s(1.05%)p56.10(58.96%)d38.05(39.99%) 0.000119505 - 1.282876536
127 RY*(10)C7 s(4.52%)p7.88(35.62%)d13.24(59.86%) 0.000078834 - 2.042750824
128 RY*(11)C7 s(9.33%)p3.30(30.77%)d6.42(59.90%) 0.000027507 - 2.052036606
129 RY*(12)C7 s(1.44%)p64.61(93.32%)d3.62(5.24%) 0.000002715 - 2.672208108
130 RY*(13)C7 s(0.46%)p99.99(91.68%)d17.22(7.87%) 0.000005971 - 2.779368257
131 RY*(14)C7 s(3.12%)p2.23(6.96%)d28.85(89.92%) 0.000003288 - 2.294044120
132 RY*(15)C7 s(98.96%)p0.00(0.43%)d0.01(0.61%) 0.000001264 - 22.087009703
133 RY*(16)C7 s(0.67%)p99.99(91.63%)d11.46(7.70%) 0.000005529 - 2.574502778
134 RY*(17)C7 s(0.50%)p31.01(15.39%)d99.99(84.11%) 0.000001772 - 1.733985749
135 RY*(18)C7 s(3.07%)p3.40(10.44%)d28.15(86.49%) 0.000000597 - 2.381715376
136 RY*(19)C7 s(1.97%)p5.48(10.78%)d44.40(87.26%) 0.000006289 - 2.132508429
137 RY*(20)C7 s(21.63%)p3.06(66.19%)d0.56(12.18%) 0.000004656 - 0.607951834
138 RY*(21)C7 s(12.51%)p1.14(14.24%)d5.86(73.25%) 0.000001034 - 1.761694443
139 RY*(22)C7 s(2.14%)p1.47(3.15%)d44.29(94.71%) 0.000006457 - 2.551269889
140 RY*(1)C8 s(4.04%)p22.10(89.19%)d1.68(6.77%) 0.004079227 - 0.604092860
141 RY*(2)C8 s(24.14%)p2.80(67.66%)d0.34(8.21%) 0.001331246 - 0.989888466
142 RY*(3)C8 s(6.25%)p13.60(84.95%)d1.41(8.81%) 0.000796458 - 0.917659350
143 RY*(4)C8 s(21.55%)p2.01(43.25%)d1.63(35.20%) 0.000188016 - 0.779731910
144 RY*(5)C8 s(17.25%)p2.51(43.35%)d2.28(39.40%) 0.000164001 - 0.533775755
145 RY*(6)C8 s(10.61%)p2.01(21.32%)d6.41(68.07%) 0.000118446 - 0.614049554
146 RY*(7)C8 s(6.83%)p10.74(73.37%)d2.90(19.80%) 0.000088560 - 0.380479275
147 RY*(8)C8 s(18.70%)p1.39(25.97%)d2.96(55.33%) 0.000039993 - 1.010037063
148 RY*(9)C8 s(13.07%)p4.09(53.45%)d2.56(33.48%) 0.000024765 - 0.899696193
149 RY*(10)C8 s(4.08%)p22.81(93.14%)d0.68(2.77%) 0.000001876 - 2.650017466
150 RY*(11)C8 s(30.49%)p1.29(39.44%)d0.99(30.07%) 0.000006104 - 1.050895129
151 RY*(12)C8 s(9.18%)p9.62(88.30%)d0.27(2.52%) 0.000001473 - 2.432326860
152 RY*(13)C8 s(2.78%)p13.71(38.11%)d21.27(59.11%) 0.000004130 - 0.979517568
153 RY*(14)C8 s(0.82%)p1.84(1.50%)d99.99(97.69%) 0.000000506 - 3.149257184
154 RY*(15)C8 s(99.49%)p0.00(0.41%)d0.00(0.10%) 0.000000038 - 22.906357848
155 RY*(16)C8 s(0.86%)p9.85(8.46%)d99.99(90.68%) 0.000000866 - 2.973799362
156 RY*(17)C8 s(5.78%)p1.85(10.69%)d14.46(83.54%) 0.000004094 - 1.421142303
157 RY*(18)C8 s(0.48%)p7.16(3.42%)d99.99(96.10%) 0.000001051 - 3.082642978
158 RY*(19)C8 s(3.58%)p25.95(92.88%)d0.99(3.54%) 0.000001321 - 2.447317679
159 RY*(20)C8 s(16.26%)p0.54(8.73%)d4.61(75.01%) 0.000001401 - 2.412311365
160 RY*(21)C8 s(1.74%)p5.70(9.91%)d50.84(88.35%) 0.000002646 - 1.069186363
161 RY*(22)C8 s(1.95%)p1.58(3.09%)d48.57(94.95%) 0.000000928 - 2.773967532
162 RY*(1)H9 s(92.95%)p0.08(7.05%) 0.000622070 - 0.818911436
163 RY*(2)H9 s(1.81%)p54.38(98.19%) 0.000115202 - 1.817158177
164 RY*(3)H9 s(40.09%)p1.49(59.91%) 0.000097049 - 1.971872284
165 RY*(4)H9 s(53.49%)p0.87(46.51%) 0.000051603 - 1.915852386
166 RY*(5)H9 s(11.69%)p7.55(88.31%) 0.000025089 - 2.209311928
167 RY*(1)H10 s(90.36%)p0.11(9.64%) 0.000666022 - 0.880830568
168 RY*(2)H10 s(0.44%)p99.99(99.56%) 0.000110570 - 1.724321451
169 RY*(3)H10 s(15.86%)p5.31(84.14%) 0.000105909 - 1.984114552
170 RY*(4)H10 s(76.76%)p0.30(23.24%) 0.000048563 - 1.955588290
171 RY*(5)H10 s(16.61%)p5.02(83.39%) 0.000013783 - 1.997794263
172 RY*(1)H11 s(98.31%)p0.02(1.69%) 0.000716437 - 0.655308561
173 RY*(2)H11 s(3.14%)p30.85(96.86%) 0.000145516 - 1.950236438
174 RY*(3)H11 s(1.56%)p63.14(98.44%) 0.000119078 - 1.765421505
175 RY*(4)H11 s(66.85%)p0.50(33.15%) 0.000072197 - 2.373429678
176 RY*(5)H11 s(30.17%)p2.32(69.83%) 0.000047509 - 2.100397099
177 RY*(1)H12 s(95.90%)p0.04(4.10%) 0.000358016 - 1.076331587
178 RY*(2)H12 s(70.45%)p0.42(29.55%) 0.000144713 - 1.845266014
179 RY*(3)H12 s(7.86%)p11.72(92.14%) 0.000059099 - 2.181008117
180 RY*(4)H12 s(22.03%)p3.54(77.97%) 0.000051575 - 1.856708193
181 RY*(5)H12 s(3.82%)p25.21(96.18%) 0.000053001 - 2.218873860
182 RY*(1)H13 s(95.54%)p0.05(4.46%) 0.000769553 - 0.777992264
183 RY*(2)H13 s(19.32%)p4.18(80.68%) 0.000149096 - 1.920015490
184 RY*(3)H13 s(39.12%)p1.56(60.88%) 0.000077351 - 2.058161385
185 RY*(4)H13 s(41.34%)p1.42(58.66%) 0.000086870 - 2.156606310
186 RY*(5)H13 s(4.72%)p20.19(95.28%) 0.000039775 - 2.571079991
187 RY*(1)H14 s(92.36%)p0.08(7.64%) 0.000283579 - 1.045836801
188 RY*(2)H14 s(3.10%)p31.29(96.90%) 0.000132771 - 1.843767167
189 RY*(3)H14 s(37.14%)p1.69(62.86%) 0.000114042 - 1.720412369
190 RY*(4)H14 s(46.18%)p1.17(53.82%) 0.000065669 - 2.140742695
191 RY*(5)H14 s(21.25%)p3.71(78.75%) 0.000024436 - 2.000812574
192 RY*(1)H15 s(96.09%)p0.04(3.91%) 0.000501736 - 0.859184914
193 RY*(2)H15 s(10.79%)p8.27(89.21%) 0.000115934 - 1.812742867
194 RY*(3)H15 s(0.15%)p99.99(99.85%) 0.000100066 - 1.820792635
195 RY*(4)H15 s(74.11%)p0.35(25.89%) 0.000074151 - 2.167641876
196 RY*(5)H15 s(18.89%)p4.29(81.11%) 0.000031112 - 2.134523124
197 RY*(1)H16 s(87.76%)p0.14(12.24%) 0.000465495 - 1.112031458
198 RY*(2)H16 s(11.17%)p7.95(88.83%) 0.000143112 - 1.700234381
199 RY*(3)H16 s(12.16%)p7.22(87.84%) 0.000097309 - 1.737665253
200 RY*(4)H16 s(73.25%)p0.37(26.75%) 0.000068213 - 1.976626078
201 RY*(5)H16 s(15.69%)p5.37(84.31%) 0.000023102 - 2.174449614

Natural Bond Orbitals

Orbital Description NHOs Occupancy Spin Energy () Actions
1 BD(1)C1-C2 403, 404 1.743253771 - -0.718311579
2 BD(1)C1-H14 405, 406 1.975857185 - -0.726407660
3 BD(1)C1-H15 407, 408 1.994169957 - -0.719784284
4 BD(1)C1-H16 409, 410 1.922863475 - -0.688920366
5 BD(1)C2-C3 411, 412 1.978281892 - -0.822404177
6 BD(1)C2-C7 413, 414 1.983925427 - -0.926159318
7 BD(1)C2-H13 415, 416 1.956542015 - -0.702001634
8 BD(1)C3-H4 417, 418 1.975254066 - -0.668921859
9 BD(1)C3-H5 419, 420 1.984096466 - -0.669050873
10 BD(1)C3-H6 421, 422 1.986355378 - -0.678409588
11 BD(1)C7-C8 423, 424 1.989598436 - -0.907499690
12 BD(1)C7-H12 425, 426 1.977203914 - -0.756982547
13 BD(1)C8-H9 427, 428 1.956266577 - -0.701867434
14 BD(1)C8-H10 429, 430 1.900591325 - -0.691942283
15 BD(1)C8-H11 431, 432 1.983655482 - -0.711595893
16 CR(1)C1 433 1.999175470 - -10.262165583
17 CR(1)C2 434 1.999077963 - -10.265466295
18 CR(1)C3 435 1.999303003 - -10.199278133
19 CR(1)C7 436 1.999166115 - -10.327472898
20 CR(1)C8 437 1.999219444 - -10.231035225
21 LP*(1)C7 438 0.483688510 - -0.335909064
22 RY*(1)C1 439 0.001893734 - 0.690201831
23 RY*(2)C1 440 0.001457742 - 0.554153766
24 RY*(3)C1 441 0.000506264 - 1.155743793
25 RY*(4)C1 442 0.000352827 - 0.480929435
26 RY*(5)C1 443 0.000209035 - 0.998451772
27 RY*(6)C1 444 0.000117259 - 0.498945260
28 RY*(7)C1 445 0.000087171 - 0.797238977
29 RY*(8)C1 446 0.000044131 - 0.718431769
30 RY*(9)C1 447 0.000022490 - 1.318567052
31 RY*(10)C1 448 0.000027310 - 0.716979912
32 RY*(11)C1 449 0.000000144 - 23.077860084
33 RY*(12)C1 450 0.000001328 - 2.691568647
34 RY*(13)C1 451 0.000003194 - 0.252340063
35 RY*(14)C1 452 0.000000667 - 3.097566129
36 RY*(15)C1 453 0.000003214 - 1.292703641
37 RY*(16)C1 454 0.000002811 - 2.356738080
38 RY*(17)C1 455 0.000002124 - 2.451353710
39 RY*(18)C1 456 0.000001466 - 3.089693319
40 RY*(19)C1 457 0.000001511 - 2.858261623
41 RY*(20)C1 458 0.000002347 - 3.152871695
42 RY*(21)C1 459 0.000004576 - 1.192174374
43 RY*(22)C1 460 0.000000832 - 2.988667611
44 RY*(1)C2 461 0.006437255 - 0.777834929
45 RY*(2)C2 462 0.001954345 - 0.898398889
46 RY*(3)C2 463 0.001175351 - 1.003208998
47 RY*(4)C2 464 0.000923640 - 1.223980013
48 RY*(5)C2 465 0.000621858 - 1.004794475
49 RY*(6)C2 466 0.000438314 - 1.362666448
50 RY*(7)C2 467 0.000392104 - 2.096817559
51 RY*(8)C2 468 0.000195536 - 2.513597180
52 RY*(9)C2 469 0.000118288 - 1.929872214
53 RY*(10)C2 470 0.000104160 - 1.409925436
54 RY*(11)C2 471 0.000053773 - 2.264170055
55 RY*(12)C2 472 0.000054985 - 1.835498804
56 RY*(13)C2 473 0.000018044 - 1.772877488
57 RY*(14)C2 474 0.000020623 - 1.179051073
58 RY*(15)C2 475 0.000000000 - 2.634363091
59 RY*(16)C2 476 0.000000405 - 2.616802217
60 RY*(17)C2 477 0.000000003 - 22.301310364
61 RY*(18)C2 478 0.000000118 - 0.977256303
62 RY*(19)C2 479 0.000000446 - 2.316554802
63 RY*(20)C2 480 0.000000064 - 2.405724626
64 RY*(21)C2 481 0.000000251 - 1.198835078
65 RY*(22)C2 482 0.000008374 - 2.845632102
66 RY*(1)C3 483 0.002877483 - 0.651680750
67 RY*(2)C3 484 0.002438344 - 0.519631778
68 RY*(3)C3 485 0.000481910 - 1.537844459
69 RY*(4)C3 486 0.000281927 - 0.899457778
70 RY*(5)C3 487 0.000182718 - 0.738584262
71 RY*(6)C3 488 0.000127561 - 0.654298177
72 RY*(7)C3 489 0.000091177 - 0.481906991
73 RY*(8)C3 490 0.000044211 - 1.212504880
74 RY*(9)C3 491 0.000019843 - 1.867875455
75 RY*(10)C3 492 0.000000116 - 22.988416469
76 RY*(11)C3 493 0.000001011 - 2.232936122
77 RY*(12)C3 494 0.000001108 - 2.622047773
78 RY*(13)C3 495 0.000003051 - 0.927562863
79 RY*(14)C3 496 0.000000578 - 2.904418635
80 RY*(15)C3 497 0.000004800 - 1.223230839
81 RY*(16)C3 498 0.000001175 - 2.625082658
82 RY*(17)C3 499 0.000004908 - 0.680212361
83 RY*(18)C3 500 0.000000644 - 3.226068312
84 RY*(19)C3 501 0.000007623 - 1.455664157
85 RY*(20)C3 502 0.000008551 - 2.405796520
86 RY*(21)C3 503 0.000002097 - 2.075934778
87 RY*(22)C3 504 0.000000580 - 2.994239367
88 RY*(1)H4 505 0.000329141 - 1.072497755
89 RY*(2)H4 506 0.000118588 - 1.811660215
90 RY*(3)H4 507 0.000122591 - 1.856586681
91 RY*(4)H4 508 0.000050532 - 2.045946590
92 RY*(5)H4 509 0.000012316 - 2.093713845
93 RY*(1)H5 510 0.000403548 - 0.908393061
94 RY*(2)H5 511 0.000113897 - 1.873088222
95 RY*(3)H5 512 0.000113345 - 1.797843908
96 RY*(4)H5 513 0.000051554 - 2.138987992
97 RY*(5)H5 514 0.000025586 - 2.191370780
98 RY*(1)H6 515 0.000662638 - 0.646860622
99 RY*(2)H6 516 0.000145756 - 1.941020657
100 RY*(3)H6 517 0.000112063 - 1.795825228
101 RY*(4)H6 518 0.000065422 - 2.287025986
102 RY*(5)H6 519 0.000041442 - 2.251675793
103 RY*(1)C7 520 0.004418607 - 0.821752247
104 RY*(2)C7 521 0.002645435 - 0.521921752
105 RY*(3)C7 522 0.001114789 - 1.165045901
106 RY*(4)C7 523 0.000743738 - 0.925465332
107 RY*(5)C7 524 0.000545755 - 1.284542735
108 RY*(6)C7 525 0.000390595 - 1.313517983
109 RY*(7)C7 526 0.000278841 - 1.485181727
110 RY*(8)C7 527 0.000160785 - 0.751685269
111 RY*(9)C7 528 0.000119505 - 1.282876536
112 RY*(10)C7 529 0.000078834 - 2.042750824
113 RY*(11)C7 530 0.000027507 - 2.052036606
114 RY*(12)C7 531 0.000002715 - 2.672208108
115 RY*(13)C7 532 0.000005971 - 2.779368257
116 RY*(14)C7 533 0.000003288 - 2.294044120
117 RY*(15)C7 534 0.000001264 - 22.087009703
118 RY*(16)C7 535 0.000005529 - 2.574502778
119 RY*(17)C7 536 0.000001772 - 1.733985749
120 RY*(18)C7 537 0.000000597 - 2.381715376
121 RY*(19)C7 538 0.000006289 - 2.132508429
122 RY*(20)C7 539 0.000004656 - 0.607951834
123 RY*(21)C7 540 0.000001034 - 1.761694443
124 RY*(22)C7 541 0.000006457 - 2.551269889
125 RY*(1)C8 542 0.004079227 - 0.604092860
126 RY*(2)C8 543 0.001331246 - 0.989888466
127 RY*(3)C8 544 0.000796458 - 0.917659350
128 RY*(4)C8 545 0.000188016 - 0.779731910
129 RY*(5)C8 546 0.000164001 - 0.533775755
130 RY*(6)C8 547 0.000118446 - 0.614049554
131 RY*(7)C8 548 0.000088560 - 0.380479275
132 RY*(8)C8 549 0.000039993 - 1.010037063
133 RY*(9)C8 550 0.000024765 - 0.899696193
134 RY*(10)C8 551 0.000001876 - 2.650017466
135 RY*(11)C8 552 0.000006104 - 1.050895129
136 RY*(12)C8 553 0.000001473 - 2.432326860
137 RY*(13)C8 554 0.000004130 - 0.979517568
138 RY*(14)C8 555 0.000000506 - 3.149257184
139 RY*(15)C8 556 0.000000038 - 22.906357848
140 RY*(16)C8 557 0.000000866 - 2.973799362
141 RY*(17)C8 558 0.000004094 - 1.421142303
142 RY*(18)C8 559 0.000001051 - 3.082642978
143 RY*(19)C8 560 0.000001321 - 2.447317679
144 RY*(20)C8 561 0.000001401 - 2.412311365
145 RY*(21)C8 562 0.000002646 - 1.069186363
146 RY*(22)C8 563 0.000000928 - 2.773967532
147 RY*(1)H9 564 0.000622070 - 0.818911436
148 RY*(2)H9 565 0.000115202 - 1.817158177
149 RY*(3)H9 566 0.000097049 - 1.971872284
150 RY*(4)H9 567 0.000051603 - 1.915852386
151 RY*(5)H9 568 0.000025089 - 2.209311928
152 RY*(1)H10 569 0.000666022 - 0.880830568
153 RY*(2)H10 570 0.000110570 - 1.724321451
154 RY*(3)H10 571 0.000105909 - 1.984114552
155 RY*(4)H10 572 0.000048563 - 1.955588290
156 RY*(5)H10 573 0.000013783 - 1.997794263
157 RY*(1)H11 574 0.000716437 - 0.655308561
158 RY*(2)H11 575 0.000145516 - 1.950236438
159 RY*(3)H11 576 0.000119078 - 1.765421505
160 RY*(4)H11 577 0.000072197 - 2.373429678
161 RY*(5)H11 578 0.000047509 - 2.100397099
162 RY*(1)H12 579 0.000358016 - 1.076331587
163 RY*(2)H12 580 0.000144713 - 1.845266014
164 RY*(3)H12 581 0.000059099 - 2.181008117
165 RY*(4)H12 582 0.000051575 - 1.856708193
166 RY*(5)H12 583 0.000053001 - 2.218873860
167 RY*(1)H13 584 0.000769553 - 0.777992264
168 RY*(2)H13 585 0.000149096 - 1.920015490
169 RY*(3)H13 586 0.000077351 - 2.058161385
170 RY*(4)H13 587 0.000086870 - 2.156606310
171 RY*(5)H13 588 0.000039775 - 2.571079991
172 RY*(1)H14 589 0.000283579 - 1.045836801
173 RY*(2)H14 590 0.000132771 - 1.843767167
174 RY*(3)H14 591 0.000114042 - 1.720412369
175 RY*(4)H14 592 0.000065669 - 2.140742695
176 RY*(5)H14 593 0.000024436 - 2.000812574
177 RY*(1)H15 594 0.000501736 - 0.859184914
178 RY*(2)H15 595 0.000115934 - 1.812742867
179 RY*(3)H15 596 0.000100066 - 1.820792635
180 RY*(4)H15 597 0.000074151 - 2.167641876
181 RY*(5)H15 598 0.000031112 - 2.134523124
182 RY*(1)H16 599 0.000465495 - 1.112031458
183 RY*(2)H16 600 0.000143112 - 1.700234381
184 RY*(3)H16 601 0.000097309 - 1.737665253
185 RY*(4)H16 602 0.000068213 - 1.976626078
186 RY*(5)H16 603 0.000023102 - 2.174449614
187 BD*(1)C1-C2 0.019825026 - 0.028045000
188 BD*(1)C1-H14 0.005908744 - 0.208583804
189 BD*(1)C1-H15 0.005699312 - 0.213067634
190 BD*(1)C1-H16 0.009658309 - 0.206956680
191 BD*(1)C2-C3 0.014641664 - 0.199406085
192 BD*(1)C2-C7 0.024016027 - 0.274634559
193 BD*(1)C2-H13 0.022121249 - 0.211169337
194 BD*(1)C3-H4 0.004629302 - 0.235593631
195 BD*(1)C3-H5 0.004147104 - 0.239017740
196 BD*(1)C3-H6 0.005613070 - 0.232285857
197 BD*(1)C7-C8 0.011119279 - 0.231397054
198 BD*(1)C7-H12 0.016617622 - 0.214936773
199 BD*(1)C8-H9 0.006159264 - 0.198428483
200 BD*(1)C8-H10 0.004036711 - 0.170998472
201 BD*(1)C8-H11 0.007644013 - 0.209826981

Quote

MOST BUREAUCRACIES FUNCTION LIKE A SEPTIC TANK. THE LARGE CHUNKS RISE TO THE TOP.