0 mol 12 unq 0 iso 0 dist 7.68446 6.05244 4.40652 9.23849 5.44478 7.4036 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 9.16791 9.71247 7.94795 9.91575 8.44753 14.2842 numMergedOcc 0
2 mol 69 unq 1 iso 0 dist 9.16791 4.95459 9.41369 9.91575 8.44753 11.2757 numMergedOcc 0
3 mol 69 unq 2 iso 0 dist 6.57452 9.71247 10.3982 6.39837 7.33546 15.4177 numMergedOcc 0
4 mol 69 unq 3 iso 0 dist 6.57452 4.95459 5.25902 6.39837 7.33546 5.58337 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 7.60412 4.76028 6.08127 5.26707 9.25371 9.51367 numMergedOcc 0
6 mol 128 unq 0 iso 0 dist 9.82711 4.89256 11.1068 6.33346 9.30597 10.7588 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 8.65807 7.35647 9.37324 10.9875 6.5114 12.5281 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 6.7402 7.85849 10.8471 4.94726 8.2872 11.8229 numMergedOcc 0
9 mol 189 unq 0 iso 0 dist 6.77351 9.6509 6.41248 10.3814 8.81184 7.45329 numMergedOcc 0
10 mol 189 unq 1 iso 0 dist 8.4676 9.31137 13.375 16.383 8.81184 18.8254 numMergedOcc 0
11 mol 192 unq 0 iso 0 dist 6.6011 9.36089 11.6964 12.2483 5.99974 17.1696 numMergedOcc 0
12 mol 192 unq 1 iso 0 dist 6.6011 8.25221 8.7874 12.2483 5.99974 11.3625 numMergedOcc 0
13 mol 192 unq 2 iso 0 dist 6.6011 6.64416 7.84006 12.2483 5.99974 11.9486 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 5.99718 9.36738 6.23427 4.55979 7.42784 7.88169 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 5.99718 9.36738 6.23427 6.35303 6.11123 9.46179 numMergedOcc 0
16 mol 226 unq 0 iso 0 dist 6.3687 9.84017 8.87365 7.95454 7.6174 14.904 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 8.25412 9.45021 6.10844 14.3715 9.09371 8.85568 numMergedOcc 0
18 mol 260 unq 0 iso 0 dist 7.95918 4.76698 9.60961 9.01244 9.94532 10.5098 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 6.85288 5.02385 6.69582 5.00251 5.00402 7.37358 numMergedOcc 0
