0 mol 33 unq 0 iso 0 dist 8.41842 5.73206 4.77227 10.1727 7.44828 5.52908 13.689 5.7655 8.90634 9.79966 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 8.41842 5.73206 4.77227 10.1727 7.44828 5.52908 12.2459 5.62472 7.71372 5.52992 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 9.1662 7.09184 13.0828 3.86843 6.49343 7.7106 8.94945 7.01367 8.95233 5.41831 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 5.01633 9.01568 5.19081 4.18109 8.25597 12.4284 6.95595 5.56574 4.95201 9.20448 numMergedOcc 0
4 mol 75 unq 1 iso 0 dist 5.01633 9.01568 5.19081 4.01868 4.76466 9.28944 6.95595 5.56574 4.95201 6.96759 numMergedOcc 0
5 mol 75 unq 2 iso 0 dist 5.01633 9.01568 5.19081 6.54389 8.67172 11.393 6.95595 5.56574 4.95201 6.97318 numMergedOcc 0
6 mol 176 unq 0 iso 0 dist 8.49376 7.80506 10.0449 8.23203 7.98755 13.7944 15.5268 11.6341 18.7378 8.02366 numMergedOcc 0
7 mol 176 unq 1 iso 0 dist 8.49376 7.80506 10.0449 8.23203 7.98755 13.7944 10.9816 5.17719 14.4797 8.93118 numMergedOcc 0
8 mol 176 unq 2 iso 0 dist 6.9705 9.32606 10.0449 4.84752 7.98755 13.7944 11.8605 11.6341 18.7378 8.02366 numMergedOcc 0
9 mol 176 unq 3 iso 0 dist 6.9705 9.32606 10.0449 4.84752 7.98755 13.7944 9.66407 5.17719 14.4797 8.93118 numMergedOcc 0
10 mol 226 unq 0 iso 0 dist 9.5942 9.03261 4.1635 4.31761 8.52996 9.8349 9.18697 9.00536 11.0623 5.90092 numMergedOcc 0
11 mol 226 unq 1 iso 0 dist 9.5942 7.67573 9.6805 4.31761 8.52996 6.72708 9.18697 9.00536 4.66606 5.90092 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 8.20542 9.51001 13.8826 4.60599 8.63249 13.7761 5.66569 10.2557 10.5269 5.90804 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 9.17911 5.9223 14.8337 15.4705 8.10903 20.5145 18.9271 9.78068 24.5342 9.04358 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 6.28023 7.8547 6.75848 5.02003 9.34051 10.5453 8.49076 7.23876 13.2618 8.88221 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 7.47179 9.38187 10.1749 6.53276 6.45597 12.9982 7.26542 5.10722 11.2254 9.32175 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 7.47179 9.38187 10.1749 6.53276 6.45597 12.9982 7.26542 5.10722 11.2254 9.32175 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 7.47179 9.38187 10.1749 6.53276 6.45597 12.9982 7.26542 5.10722 11.2254 9.32175 numMergedOcc 0
18 mol 293 unq 0 iso 0 dist 7.67909 8.04021 5.48105 5.86662 7.41524 10.2129 10.6063 8.15525 12.7881 5.44043 numMergedOcc 0
19 mol 293 unq 1 iso 0 dist 6.83404 8.04021 4.88851 5.86662 6.42608 10.2129 10.6063 9.35524 12.7881 5.44043 numMergedOcc 0
