0 mol 1 unq 0 iso 0 dist 8.40848 6.03793 7.90928 8.7275 5.06184 5.96833 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 9.1093 7.49522 9.18487 12.2759 6.54276 7.98465 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.07937 17.0437 9.97117 14.5987 12.2008 9.96121 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 6.42206 7.23551 9.97117 13.5781 12.2008 9.96121 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 9.66602 8.34836 9.97117 14.7493 12.2008 9.96121 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 5.16558 4.39526 5.70192 6.89527 3.77705 8.96498 numMergedOcc 0
6 mol 67 unq 1 iso 0 dist 5.16558 4.39526 5.70192 11.8705 11.7466 7.5228 numMergedOcc 0
7 mol 67 unq 2 iso 0 dist 9.62459 4.39526 7.65646 6.89527 7.64337 8.96498 numMergedOcc 0
8 mol 67 unq 3 iso 0 dist 9.62459 4.39526 7.65646 11.8705 10.1845 7.5228 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 6.12404 5.26498 5.58063 9.26505 8.29196 7.65255 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 9.72877 6.85166 7.50392 11.7422 5.68679 7.29911 numMergedOcc 0
11 mol 155 unq 1 iso 0 dist 9.72877 9.22235 8.77391 11.7422 5.68679 5.36254 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 7.76856 9.00192 9.56248 11.0639 15.8873 8.62366 numMergedOcc 0
13 mol 173 unq 1 iso 0 dist 7.76856 9.00192 9.56248 12.2224 14.9274 9.44973 numMergedOcc 0
14 mol 173 unq 2 iso 0 dist 7.76856 9.00192 9.56248 5.82174 9.35913 6.52508 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 5.08796 4.56814 6.17129 11.1968 7.19461 9.09234 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 5.08796 4.56814 6.17129 9.45579 9.77747 6.76746 numMergedOcc 0
17 mol 181 unq 2 iso 0 dist 5.08796 4.56814 6.17129 11.3781 10.0615 8.92098 numMergedOcc 0
18 mol 181 unq 3 iso 0 dist 5.93515 4.56814 5.83596 11.1968 11.195 9.09234 numMergedOcc 0
19 mol 181 unq 4 iso 0 dist 5.93515 4.56814 5.83596 9.45579 4.76079 6.76746 numMergedOcc 0
20 mol 181 unq 5 iso 0 dist 5.93515 4.56814 5.83596 11.3781 6.38851 8.92098 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 8.61953 7.69844 8.32685 12.0075 15.7632 9.27218 numMergedOcc 0
22 mol 197 unq 1 iso 0 dist 7.91999 7.69844 6.74777 12.0075 15.6628 9.27218 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 8.92585 6.04481 6.24435 13.6578 11.7967 8.69525 numMergedOcc 0
