0 mol 7 unq 0 iso 0 dist 4.47024 4.91115 8.60435 13.3672 17.4118 9.97624 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 9.23617 12.9223 6.39966 14.662 6.34272 5.82366 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 8.59114 10.8426 6.39966 10.1117 6.34272 5.82366 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 8.63204 10.5195 6.39966 12.7832 6.34272 5.82366 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 6.14415 10.0156 9.5669 12.0659 10.2428 7.09065 numMergedOcc 0
5 mol 105 unq 0 iso 0 dist 5.74652 8.65154 7.09806 9.3724 6.14305 5.03173 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 7.73842 14.9324 9.35942 14.7865 8.36453 9.83981 numMergedOcc 0
7 mol 114 unq 1 iso 0 dist 7.73842 14.9324 9.35942 13.7685 6.22315 6.13559 numMergedOcc 0
8 mol 114 unq 2 iso 0 dist 7.73842 14.9324 9.35942 10.2626 6.18257 6.51395 numMergedOcc 0
9 mol 126 unq 0 iso 0 dist 7.68174 8.31794 5.94233 10.4418 5.83002 7.36017 numMergedOcc 0
10 mol 126 unq 1 iso 0 dist 7.68174 9.33341 8.56219 10.4418 5.83002 5.14819 numMergedOcc 0
11 mol 135 unq 0 iso 0 dist 5.97971 11.1112 9.40325 14.6275 9.3453 9.15377 numMergedOcc 0
12 mol 135 unq 1 iso 0 dist 5.97971 6.32401 7.62606 8.6132 6.50383 7.12936 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 6.93136 11.6598 6.95372 8.22353 7.12863 9.30424 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 7.70692 6.34062 8.03528 7.33162 10.2821 6.64779 numMergedOcc 0
15 mol 194 unq 0 iso 0 dist 8.63008 4.44921 5.68348 11.5995 7.69247 8.52969 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 8.768 12.7912 8.20162 12.4849 7.13893 7.73748 numMergedOcc 0
17 mol 243 unq 0 iso 0 dist 8.54245 9.97818 7.44706 14.5547 8.16841 7.12785 numMergedOcc 0
18 mol 243 unq 1 iso 0 dist 8.54245 9.97818 7.44706 12.3582 6.03041 6.66959 numMergedOcc 0
19 mol 250 unq 0 iso 0 dist 5.43238 4.45246 5.93798 10.0527 7.62569 6.28538 numMergedOcc 0
