0 mol 13 unq 0 iso 0 dist 8.37063 5.6314 6.44408 6.39939 5.99004 4.56335 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 8.34361 13.2619 6.54183 14.9943 9.57335 4.15717 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 8.34361 13.2619 6.54183 11.5332 8.60653 5.99981 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 9.91313 7.49081 9.70415 11.5851 5.67362 13.5488 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.40355 10.1498 8.41567 5.53482 4.73362 4.85247 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 6.40355 10.1498 8.41567 5.26304 9.61367 12.7241 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 6.40355 4.57694 5.56964 5.53482 4.73362 6.45686 numMergedOcc 0
7 mol 76 unq 3 iso 0 dist 6.40355 4.57694 5.56964 5.26304 9.61367 4.3931 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.04448 8.91618 6.78839 17.0849 9.40173 11.3905 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 8.04448 14.8024 8.02354 17.0849 9.40173 4.67519 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.27253 10.7421 7.85527 4.09788 8.05937 7.45148 numMergedOcc 0
11 mol 180 unq 0 iso 0 dist 9.19555 8.09743 9.90787 4.11186 9.59587 5.67701 numMergedOcc 0
12 mol 185 unq 0 iso 0 dist 7.55408 8.20407 6.89879 12.6211 8.94849 4.74713 numMergedOcc 0
13 mol 185 unq 1 iso 0 dist 7.18997 6.98598 9.87065 6.26644 8.7695 4.86576 numMergedOcc 0
14 mol 185 unq 2 iso 0 dist 8.38127 4.83776 6.89879 5.9439 8.94849 4.74713 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 6.64749 5.97308 5.16813 4.11297 5.77158 5.4141 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 8.18597 5.92777 7.71761 3.86003 6.65275 6.48027 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 9.87224 9.86326 6.83046 5.38925 9.25097 9.59042 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 7.30582 11.3529 8.98668 10.7816 9.14228 4.90279 numMergedOcc 0
19 mol 256 unq 0 iso 0 dist 8.88264 6.4717 5.98967 12.1216 9.31961 7.7384 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 7.91992 10.8591 7.07459 4.60075 7.88238 9.87336 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 8.8643 7.84864 8.68797 12.9629 5.21664 12.6502 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 9.24895 4.79698 5.70546 15.0891 8.6522 12.6264 numMergedOcc 0
23 mol 279 unq 2 iso 0 dist 8.34154 10.5081 5.70546 4.01471 8.6522 12.6264 numMergedOcc 0
24 mol 279 unq 3 iso 0 dist 5.90456 11.6042 8.68797 4.01471 5.21664 12.6502 numMergedOcc 0
25 mol 280 unq 0 iso 0 dist 4.26671 10.0206 8.80588 8.48093 9.55885 14.1713 numMergedOcc 0
