0 mol 7 unq 0 iso 0 dist 6.36911 10.2446 7.45262 9.87885 7.92429 8.15894 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.36911 12.3097 6.96586 9.87885 7.92429 8.45544 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.31201 5.44992 9.55056 6.1206 4.40641 8.15894 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.31201 4.74523 7.57354 6.1206 4.40641 8.45544 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 9.36807 5.44992 7.45262 6.1206 7.92429 8.15894 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 9.36807 4.74523 6.96586 6.1206 7.92429 8.45544 numMergedOcc 0
6 mol 9 unq 0 iso 0 dist 8.47421 3.98483 8.04924 5.8245 3.91075 7.05919 numMergedOcc 0
7 mol 39 unq 0 iso 0 dist 7.33969 11.962 8.19733 12.3745 5.94068 7.99016 numMergedOcc 0
8 mol 39 unq 1 iso 0 dist 7.33969 11.962 8.19733 11.7171 6.96883 6.41793 numMergedOcc 0
9 mol 39 unq 2 iso 0 dist 7.33969 11.962 8.19733 15.6429 9.56481 6.50101 numMergedOcc 0
10 mol 45 unq 0 iso 0 dist 6.99408 6.18811 7.95778 5.94756 4.51883 7.72462 numMergedOcc 0
11 mol 45 unq 1 iso 0 dist 9.3403 6.67086 7.95778 10.7728 4.51883 7.72462 numMergedOcc 0
12 mol 74 unq 0 iso 0 dist 8.96501 4.79817 4.79413 7.93281 5.38404 6.3567 numMergedOcc 0
13 mol 107 unq 0 iso 0 dist 8.40312 8.71052 8.13921 10.3757 3.60392 6.61727 numMergedOcc 0
14 mol 114 unq 0 iso 0 dist 6.73814 5.6074 8.11094 5.7144 4.81369 7.59156 numMergedOcc 0
15 mol 115 unq 0 iso 0 dist 6.99777 7.3094 9.9928 11.8378 13.2709 8.4965 numMergedOcc 0
16 mol 130 unq 0 iso 0 dist 6.79146 7.55374 6.42785 14.0952 11.4437 6.5739 numMergedOcc 0
17 mol 130 unq 1 iso 0 dist 6.79146 9.44878 6.82089 10.4806 4.02212 8.24966 numMergedOcc 0
18 mol 130 unq 2 iso 0 dist 7.66168 11.576 6.42785 17.0951 11.4437 6.5739 numMergedOcc 0
19 mol 130 unq 3 iso 0 dist 7.66168 4.28797 6.82089 9.98797 4.02212 8.24966 numMergedOcc 0
20 mol 130 unq 4 iso 0 dist 6.89257 5.97111 6.42785 10.4778 11.4437 6.5739 numMergedOcc 0
21 mol 130 unq 5 iso 0 dist 6.89257 6.97875 6.82089 10.4564 4.02212 8.24966 numMergedOcc 0
22 mol 130 unq 6 iso 0 dist 9.12581 4.28797 5.38314 9.98797 5.46642 8.24966 numMergedOcc 0
23 mol 130 unq 7 iso 0 dist 8.74308 6.97875 5.38314 10.4564 5.46642 8.24966 numMergedOcc 0
24 mol 143 unq 0 iso 0 dist 7.31468 7.11704 7.88655 10.9972 4.38322 8.612 numMergedOcc 0
25 mol 143 unq 1 iso 0 dist 7.7056 9.53139 7.88655 10.7327 4.38322 8.612 numMergedOcc 0
26 mol 147 unq 0 iso 0 dist 8.33261 12.6979 7.01133 11.2941 7.68412 9.43989 numMergedOcc 0
27 mol 188 unq 0 iso 0 dist 6.90541 5.48276 7.48284 7.88013 6.39872 7.79115 numMergedOcc 0
28 mol 198 unq 0 iso 0 dist 7.90031 6.74772 8.15936 10.8478 4.12366 8.8864 numMergedOcc 0
29 mol 198 unq 1 iso 0 dist 7.90031 6.74772 8.15936 10.9848 8.27289 8.12201 numMergedOcc 0
30 mol 198 unq 2 iso 0 dist 7.90031 6.74772 8.15936 10.6446 7.09645 5.45162 numMergedOcc 0
31 mol 198 unq 3 iso 0 dist 7.21533 6.74772 8.16598 10.8478 5.7714 8.8864 numMergedOcc 0
32 mol 198 unq 4 iso 0 dist 7.21533 6.74772 8.16598 10.9848 5.50315 8.12201 numMergedOcc 0
33 mol 198 unq 5 iso 0 dist 7.21533 6.74772 8.16598 10.6446 8.18633 5.45162 numMergedOcc 0
34 mol 205 unq 0 iso 0 dist 9.19704 5.54129 9.83885 6.52816 13.4094 7.53395 numMergedOcc 0
35 mol 227 unq 0 iso 0 dist 8.17891 10.5813 7.1372 5.23634 4.09934 9.43618 numMergedOcc 0
36 mol 227 unq 1 iso 0 dist 6.95902 7.22396 7.1372 6.91318 4.09934 9.43618 numMergedOcc 0
37 mol 235 unq 0 iso 0 dist 9.58736 15.0089 9.31673 11.0129 4.47008 9.11454 numMergedOcc 0
38 mol 235 unq 1 iso 0 dist 9.43058 11.1908 9.31673 12.9086 4.47008 9.11454 numMergedOcc 0
39 mol 235 unq 2 iso 0 dist 8.75735 7.87789 9.31673 11.8988 4.47008 9.11454 numMergedOcc 0
40 mol 235 unq 3 iso 0 dist 6.98084 11.5211 9.31673 8.19317 4.47008 9.11454 numMergedOcc 0
41 mol 235 unq 4 iso 0 dist 7.32211 6.65703 9.31673 5.1823 4.47008 9.11454 numMergedOcc 0
42 mol 238 unq 0 iso 0 dist 7.67322 11.0349 7.61203 9.12776 9.75095 6.53286 numMergedOcc 0
43 mol 238 unq 1 iso 0 dist 9.68513 5.87253 9.47845 11.1002 11.7938 6.53286 numMergedOcc 0
44 mol 238 unq 2 iso 0 dist 9.29858 10.7551 9.47845 9.72188 11.7938 6.53286 numMergedOcc 0
45 mol 238 unq 3 iso 0 dist 9.90142 10.7508 6.92409 14.4013 11.7709 6.53286 numMergedOcc 0
46 mol 238 unq 4 iso 0 dist 5.9216 5.87253 6.92409 11.1002 11.7709 6.53286 numMergedOcc 0
47 mol 238 unq 5 iso 0 dist 7.49471 13.0113 6.89694 8.69015 6.12722 6.53286 numMergedOcc 0
48 mol 238 unq 6 iso 0 dist 7.19008 11.0349 6.89694 9.12776 6.12722 6.53286 numMergedOcc 0
49 mol 252 unq 0 iso 0 dist 7.66365 9.32326 6.57207 13.1298 9.43777 9.39658 numMergedOcc 0
50 mol 252 unq 1 iso 0 dist 7.66365 5.89666 5.2361 10.6424 4.21466 8.19529 numMergedOcc 0
51 mol 252 unq 2 iso 0 dist 7.66365 5.89666 5.2361 11.0129 6.19861 6.45396 numMergedOcc 0
52 mol 284 unq 0 iso 0 dist 8.41504 6.4399 8.27054 12.5394 9.97692 9.07503 numMergedOcc 0
53 mol 284 unq 1 iso 0 dist 8.41504 6.4399 8.27054 13.1224 10.6148 7.63256 numMergedOcc 0
