0 mol 4 unq 0 iso 0 dist 9.30799 5.65298 9.15878 11.314 5.39008 12.7019 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 7.28798 5.50862 7.17889 5.49213 6.82081 4.41085 numMergedOcc 0
2 mol 37 unq 1 iso 0 dist 7.28798 9.34813 8.38803 5.49213 6.82081 10.3951 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 6.64844 4.76522 5.02642 10.0955 7.43338 7.35107 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 7.15203 7.31459 8.95571 5.46652 9.34552 10.0549 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.49371 3.98395 8.92491 11.3498 9.26231 9.81264 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 9.49371 14.6064 7.41861 11.3498 9.26231 7.01534 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 5.05941 10.3277 8.92491 8.10722 9.26231 9.81264 numMergedOcc 0
8 mol 76 unq 3 iso 0 dist 5.05941 9.02965 7.41861 8.10722 9.26231 7.01534 numMergedOcc 0
9 mol 76 unq 4 iso 0 dist 9.66942 10.7432 8.92491 5.66928 9.26231 9.81264 numMergedOcc 0
10 mol 76 unq 5 iso 0 dist 9.66942 10.6763 7.41861 5.66928 9.26231 7.01534 numMergedOcc 0
11 mol 83 unq 0 iso 0 dist 9.55654 8.00727 6.77845 12.3414 7.9309 5.83828 numMergedOcc 0
12 mol 83 unq 1 iso 0 dist 9.55654 6.0402 5.48555 12.3414 7.9309 7.62986 numMergedOcc 0
13 mol 83 unq 2 iso 0 dist 9.55654 12.2939 5.39805 12.3414 7.9309 3.52321 numMergedOcc 0
14 mol 99 unq 0 iso 0 dist 7.55765 10.4215 5.61946 5.91888 4.82346 5.36117 numMergedOcc 0
15 mol 99 unq 1 iso 0 dist 7.55765 10.4215 5.61946 10.0064 8.07233 7.21001 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 9.94668 12.5652 9.1056 7.73766 4.59484 7.47696 numMergedOcc 0
17 mol 172 unq 0 iso 0 dist 9.91479 5.06659 8.03804 13.0825 7.77643 8.4248 numMergedOcc 0
18 mol 172 unq 1 iso 0 dist 9.91479 5.06659 8.03804 12.1824 4.90175 8.74106 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.39237 6.59916 6.36789 15.2663 9.60838 9.85164 numMergedOcc 0
20 mol 192 unq 0 iso 0 dist 5.91901 14.58 9.78743 5.88368 5.83093 9.99333 numMergedOcc 0
21 mol 213 unq 0 iso 0 dist 6.00865 5.29074 4.40476 4.76646 4.42112 4.7297 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 8.621 11.3391 6.97662 13.2093 7.0412 5.60637 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 6.45589 5.64063 9.91128 6.51571 5.77828 11.7437 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 7.90944 10.9366 4.53228 14.6255 7.10828 4.53635 numMergedOcc 0
25 mol 239 unq 1 iso 0 dist 7.90944 10.3819 8.54078 14.6255 7.10828 9.93977 numMergedOcc 0
26 mol 241 unq 0 iso 0 dist 8.92649 4.38729 9.55645 5.14928 8.00841 6.26153 numMergedOcc 0
