0 mol 4 unq 0 iso 0 dist 4.88114 6.66589 7.86036 6.50919 8.35272 12.85 numMergedOcc 0
1 mol 5 unq 0 iso 0 dist 7.15734 6.77563 5.32128 10.5844 8.19185 13.018 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 9.79426 7.78708 9.55318 10.2789 8.92491 15.2272 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 9.79426 7.84393 9.84922 10.2789 8.92491 11.3543 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 5.86243 7.57586 5.39129 6.19943 5.17241 7.68478 numMergedOcc 0
5 mol 38 unq 1 iso 0 dist 7.55357 8.86547 5.29179 5.09927 5.17241 6.87122 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 6.01454 5.36645 9.26483 15.1442 9.77004 18.8726 numMergedOcc 0
7 mol 48 unq 1 iso 0 dist 6.01454 5.36645 9.26483 4.89976 8.36323 9.3774 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 7.19203 7.14865 9.51008 6.31365 6.7739 8.06267 numMergedOcc 0
9 mol 68 unq 1 iso 0 dist 7.19203 7.14865 9.51008 5.08329 8.3318 5.88334 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 8.63522 7.48277 10.8684 6.04036 9.49592 10.6142 numMergedOcc 0
11 mol 102 unq 1 iso 0 dist 8.63522 9.0361 10.2218 6.04036 9.49592 5.54256 numMergedOcc 0
12 mol 102 unq 2 iso 0 dist 5.43401 7.48277 9.76734 6.04036 5.88034 10.6142 numMergedOcc 0
13 mol 102 unq 3 iso 0 dist 5.43401 9.0361 8.17186 6.04036 5.88034 5.54256 numMergedOcc 0
14 mol 114 unq 0 iso 0 dist 9.6874 5.97879 8.15877 5.72803 8.2575 9.20432 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 9.6582 5.97805 12.6081 14.8338 6.30568 16.4171 numMergedOcc 0
16 mol 152 unq 0 iso 0 dist 7.53834 6.98781 7.24951 11.2878 8.78397 10.1605 numMergedOcc 0
17 mol 173 unq 0 iso 0 dist 5.97008 8.84671 8.75092 8.29493 9.26806 16.4861 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 9.94142 8.93307 11.5966 8.10448 6.7279 13.4622 numMergedOcc 0
19 mol 206 unq 0 iso 0 dist 8.93927 5.79186 11.2111 12.0094 9.00382 12.8964 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 5.92175 7.47238 4.90814 6.89215 9.69133 8.25985 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 5.33462 8.89538 7.22173 7.54878 9.91332 6.46771 numMergedOcc 0
22 mol 238 unq 1 iso 0 dist 5.33462 7.98022 5.96552 7.54878 9.91332 14.7015 numMergedOcc 0
23 mol 250 unq 0 iso 0 dist 8.18086 8.60184 8.69877 8.32095 8.54286 14.4262 numMergedOcc 0
24 mol 276 unq 0 iso 0 dist 8.14494 8.28881 12.431 6.79594 9.08396 14.6837 numMergedOcc 0
25 mol 276 unq 1 iso 0 dist 8.14494 5.30976 9.95911 6.79594 9.08396 11.0126 numMergedOcc 0
26 mol 280 unq 0 iso 0 dist 7.3304 8.27417 4.95798 5.97356 8.87017 6.01897 numMergedOcc 0
27 mol 285 unq 0 iso 0 dist 8.08495 7.66291 8.39941 4.39911 7.9002 11.2537 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 8.04003 9.22306 5.64519 4.57745 9.78064 9.18744 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 8.04003 9.22306 5.64519 4.57745 9.78064 9.18744 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 8.04003 9.22306 5.64519 4.57745 9.78064 9.18744 numMergedOcc 0
