0 mol 11 unq 0 iso 0 dist 8.38501 5.92328 4.61088 4.93136 6.86684 5.96346 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.78536 5.35721 4.86568 5.56205 5.39089 6.62144 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 7.86009 14.9943 8.86116 18.3426 14.012 9.41441 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.71137 4.50067 7.71095 10.6114 9.64444 6.73347 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 9.76242 4.50067 8.25513 10.6114 6.66692 6.73347 numMergedOcc 0
5 mol 60 unq 0 iso 0 dist 9.51311 6.34274 8.7531 8.97793 7.04075 9.90939 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 7.10826 12.5046 9.96396 10.1732 5.11416 9.24757 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 9.21974 4.98767 7.47541 14.6783 13.5116 9.82915 numMergedOcc 0
8 mol 85 unq 1 iso 0 dist 9.21974 7.47375 7.66905 10.802 4.65335 7.54568 numMergedOcc 0
9 mol 85 unq 2 iso 0 dist 9.21974 6.7801 5.73196 10.802 4.65335 9.39864 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 7.92708 12.5527 7.17106 15.3543 10.6848 7.10378 numMergedOcc 0
11 mol 100 unq 1 iso 0 dist 6.26262 5.96628 6.45675 11.5999 7.11701 7.38135 numMergedOcc 0
12 mol 100 unq 2 iso 0 dist 5.1385 5.96628 7.47343 11.5999 11.2312 7.38135 numMergedOcc 0
13 mol 100 unq 3 iso 0 dist 4.86758 9.59578 7.47343 16.0423 12.2861 8.30845 numMergedOcc 0
14 mol 100 unq 4 iso 0 dist 4.86758 9.59578 7.47343 15.6286 15.5385 8.76378 numMergedOcc 0
15 mol 115 unq 0 iso 0 dist 6.62424 11.3434 6.90986 11.8688 5.31484 5.88249 numMergedOcc 0
16 mol 115 unq 1 iso 0 dist 6.62424 9.09842 5.39945 11.8688 5.31484 6.97707 numMergedOcc 0
17 mol 131 unq 0 iso 0 dist 7.30166 7.3338 7.12972 6.66175 8.23791 9.90168 numMergedOcc 0
18 mol 131 unq 1 iso 0 dist 9.82508 7.3338 6.85062 6.66175 13.7237 9.90168 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 9.69505 8.29338 9.361 14.9231 11.1431 7.16853 numMergedOcc 0
