0 mol 16 unq 0 iso 0 dist 9.05346 4.78943 7.03948 6.36377 6.2983 5.05803 9.30877 9.87867 6.42835 5.01101 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.05346 4.78943 7.03948 6.36377 6.2983 5.05803 9.8871 4.68733 6.57331 4.65873 numMergedOcc 0
2 mol 16 unq 2 iso 0 dist 9.05346 5.48395 5.47769 6.36377 6.2983 6.31718 9.8871 4.68733 8.43054 4.65873 numMergedOcc 0
3 mol 16 unq 3 iso 0 dist 9.05346 5.48395 5.47769 12.9591 5.94084 7.63133 9.8871 4.68733 8.43054 9.81307 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.57958 4.71849 5.81965 11.0291 6.99832 7.4729 10.1309 7.94489 8.3773 4.46885 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 5.58063 5.24961 7.64585 12.5192 10.2377 9.33865 8.42219 5.65471 6.39384 6.63111 numMergedOcc 0
6 mol 115 unq 1 iso 0 dist 5.58063 5.24961 7.64585 10.8398 10.8939 6.11741 8.42219 5.65471 6.39384 6.07067 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 9.58171 10.4485 6.62561 18.7881 11.3679 9.84395 15.0886 6.95589 6.10127 6.57678 numMergedOcc 0
8 mol 117 unq 1 iso 0 dist 9.58171 10.4485 6.62561 6.90827 4.91401 7.90328 15.0886 6.95589 6.10127 10.5783 numMergedOcc 0
9 mol 117 unq 2 iso 0 dist 9.58171 5.27151 7.63616 6.90827 4.91401 7.83136 6.78655 5.56883 8.19331 3.55765 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 7.62575 10.4606 7.51198 13.0657 5.86939 7.46303 7.25009 4.48516 8.97626 9.16779 numMergedOcc 0
11 mol 155 unq 1 iso 0 dist 7.62575 10.4606 7.51198 10.6076 6.34186 6.43582 7.25009 4.48516 8.97626 4.91785 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 9.19849 8.66436 8.62646 5.59806 6.58937 9.87651 10.7297 4.15547 7.20495 7.87971 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 9.19849 8.66436 8.62646 5.59806 6.58937 9.87651 11.298 7.0046 9.2289 12.0033 numMergedOcc 0
14 mol 167 unq 2 iso 0 dist 9.19849 8.66436 8.62646 5.59806 6.58937 9.87651 11.5835 6.24722 7.02548 11.6011 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.70025 6.20895 7.37327 13.8362 11.1462 7.81386 11.2633 4.88823 6.64173 6.8757 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 9.70025 6.20895 7.37327 13.8362 11.1462 7.81386 13.7526 14.8923 9.01624 5.71898 numMergedOcc 0
17 mol 181 unq 2 iso 0 dist 9.70025 6.20895 7.37327 13.8362 11.1462 7.81386 14.0199 14.2334 9.55105 5.83796 numMergedOcc 0
18 mol 181 unq 3 iso 0 dist 9.70025 6.20895 7.37327 10.0354 13.3389 7.63312 11.2633 4.88823 6.64173 10.6474 numMergedOcc 0
19 mol 181 unq 4 iso 0 dist 9.70025 6.20895 7.37327 10.0354 13.3389 7.63312 13.7526 14.8923 9.01624 5.93724 numMergedOcc 0
20 mol 181 unq 5 iso 0 dist 9.70025 6.20895 7.37327 10.0354 13.3389 7.63312 14.0199 14.2334 9.55105 5.12833 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 8.42382 7.2593 9.62609 15 14.6185 8.65997 13.4661 11.5454 6.91318 5.0317 numMergedOcc 0
22 mol 236 unq 0 iso 0 dist 6.98151 4.15973 5.34718 12.3675 11.8759 9.81562 11.2893 13.0765 9.3206 4.27181 numMergedOcc 0
23 mol 236 unq 1 iso 0 dist 6.98151 4.15973 5.34718 11.0771 11.3552 7.68742 11.2893 13.0765 9.3206 4.89609 numMergedOcc 0
24 mol 236 unq 2 iso 0 dist 6.98151 4.15973 5.34718 5.66569 6.04825 6.27581 11.2893 13.0765 9.3206 10.5774 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 9.94175 14.9782 6.55759 13.9196 10.4664 7.31233 22.5495 15.4844 9.12776 10.3162 numMergedOcc 0
26 mol 238 unq 1 iso 0 dist 8.81534 9.85437 6.55759 11.3074 10.4664 7.31233 17.4614 15.4844 9.12776 10.3162 numMergedOcc 0
27 mol 238 unq 2 iso 0 dist 9.46582 9.23693 7.67322 14.9617 12.6986 7.31233 8.56975 9.75095 9.12776 10.3162 numMergedOcc 0
28 mol 238 unq 3 iso 0 dist 9.77231 9.18011 9.29858 8.59074 13.069 5.72887 8.56975 11.7938 9.72188 7.06793 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 8.46351 5.59901 7.76676 9.12507 5.32839 5.30224 10.7775 7.27192 8.03219 4.04513 numMergedOcc 0
30 mol 259 unq 1 iso 0 dist 8.46351 5.59901 7.76676 9.12507 5.32839 5.30224 4.95855 4.61451 6.9899 7.09907 numMergedOcc 0
31 mol 259 unq 2 iso 0 dist 9.53092 4.77548 7.48005 12.348 11.6195 7.88519 14.1938 9.98303 9.63573 7.20604 numMergedOcc 0
32 mol 259 unq 3 iso 0 dist 9.53092 4.77548 7.48005 12.348 11.6195 7.88519 10.2275 14.0829 7.66153 8.8603 numMergedOcc 0
33 mol 259 unq 4 iso 0 dist 9.53092 4.77548 7.48005 12.2873 11.8736 7.84554 14.1938 9.98303 9.63573 5.05362 numMergedOcc 0
34 mol 259 unq 5 iso 0 dist 9.53092 4.77548 7.48005 12.2873 11.8736 7.84554 10.2275 14.0829 7.66153 5.8801 numMergedOcc 0
35 mol 259 unq 6 iso 0 dist 9.53092 4.77548 7.48005 11.6963 5.79468 7.46176 14.1938 9.98303 9.63573 5.21606 numMergedOcc 0
36 mol 259 unq 7 iso 0 dist 9.53092 4.77548 7.48005 11.6963 5.79468 7.46176 10.2275 14.0829 7.66153 11.8896 numMergedOcc 0
37 mol 259 unq 8 iso 0 dist 9.53092 4.77548 7.48005 12.3184 12.6649 9.18903 14.1938 9.98303 9.63573 7.46841 numMergedOcc 0
38 mol 259 unq 9 iso 0 dist 9.53092 4.77548 7.48005 12.3184 12.6649 9.18903 10.2275 14.0829 7.66153 5.81576 numMergedOcc 0
