0 mol 34 unq 0 iso 0 dist 6.887 6.16589 8.3307 4.47917 7.882 10.3925 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 6.887 6.16589 8.3307 4.6013 6.016 4.39214 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 6.887 6.16589 8.3307 9.12499 8.38156 4.76457 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 6.89527 11.6107 9.83555 4.39526 8.96498 15.3438 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 8.8014 4.3044 7.50377 9.66967 7.95451 6.71645 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.18572 5.51994 6.55112 8.36307 9.4866 6.14439 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 8.18572 5.51994 6.55112 10.4617 9.40363 5.70125 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.33743 4.88407 8.88752 12.7763 8.55349 14.4059 numMergedOcc 0
8 mol 197 unq 0 iso 0 dist 9.67667 7.15682 7.86042 10.4381 9.27218 10.8745 numMergedOcc 0
9 mol 218 unq 0 iso 0 dist 5.4767 7.89559 9.70462 6.81684 9.59426 14.4994 numMergedOcc 0
10 mol 218 unq 1 iso 0 dist 5.4767 7.89559 9.70462 4.40481 8.61306 11.5876 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 6.58055 7.24465 6.93465 7.2107 9.74902 13.4147 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 7.51385 10.5276 8.43856 4.80828 8.9466 9.88579 numMergedOcc 0
13 mol 287 unq 1 iso 0 dist 7.51385 8.40959 5.83857 4.80828 8.9466 6.756 numMergedOcc 0
14 mol 287 unq 2 iso 0 dist 7.51385 6.45653 5.32839 4.80828 8.9466 7.93717 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 7.51385 10.5276 8.43856 4.80828 8.9466 9.88579 numMergedOcc 0
16 mol 288 unq 1 iso 0 dist 7.51385 8.40959 5.83857 4.80828 8.9466 6.756 numMergedOcc 0
17 mol 288 unq 2 iso 0 dist 7.51385 6.45653 5.32839 4.80828 8.9466 7.93717 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 7.51385 10.5276 8.43856 4.80828 8.9466 9.88579 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 7.51385 8.40959 5.83857 4.80828 8.9466 6.756 numMergedOcc 0
20 mol 289 unq 2 iso 0 dist 7.51385 6.45653 5.32839 4.80828 8.9466 7.93717 numMergedOcc 0
