0 mol 62 unq 0 iso 0 dist 9.58156 11.1016 8.1599 13.9877 5.9487 6.35779 numMergedOcc 0
1 mol 62 unq 1 iso 0 dist 7.59416 7.04908 8.1599 10.5084 5.9487 6.35779 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 9.32453 4.35001 6.4551 8.63792 3.69293 6.46582 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 4.75701 4.14427 5.9179 6.02596 4.79453 6.10053 numMergedOcc 0
4 mol 90 unq 1 iso 0 dist 9.89618 10.1669 5.9179 8.17454 4.79453 6.10053 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 4.31067 9.91645 5.9747 16.2627 13.6536 9.68556 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 6.5258 4.32161 5.17585 11.7325 5.53441 9.60648 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 8.29529 6.68968 8.89481 9.68191 13.0914 9.86767 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 8.20009 11.9512 7.04864 9.65403 3.35803 8.03124 numMergedOcc 0
9 mol 120 unq 1 iso 0 dist 8.14799 10.1556 7.04864 8.44206 3.35803 8.03124 numMergedOcc 0
10 mol 123 unq 0 iso 0 dist 9.99727 11.1664 8.67193 15.9572 7.16564 8.40319 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 6.29975 7.49664 9.3894 6.01995 6.12885 4.82356 numMergedOcc 0
12 mol 196 unq 0 iso 0 dist 7.84536 7.42251 6.25429 14.6868 12.1426 8.3151 numMergedOcc 0
13 mol 196 unq 1 iso 0 dist 7.07723 10.0417 6.25429 17.2727 12.1426 8.3151 numMergedOcc 0
14 mol 196 unq 2 iso 0 dist 6.40064 8.51719 6.25429 16.1211 12.1426 8.3151 numMergedOcc 0
15 mol 196 unq 3 iso 0 dist 8.69629 7.06113 6.87731 11.5181 7.02978 8.3151 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 7.86668 4.04112 8.62103 8.20259 9.97638 9.49242 numMergedOcc 0
17 mol 210 unq 1 iso 0 dist 7.86668 4.04112 8.62103 10.2968 4.29623 9.25184 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 5.71825 4.12315 7.75084 6.23243 3.57917 7.45831 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 9.64889 14.9226 9.29635 14.1815 7.75371 5.11998 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 9.64889 14.9226 9.29635 16.4637 11.3546 5.79925 numMergedOcc 0
