0 mol 32 unq 0 iso 0 dist 7.45041 7.25232 5.78878 10.3304 4.99112 4.62858 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 9.00943 5.40878 6.02731 4.89196 7.29999 6.04903 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 8.6786 10.516 9.33276 9.9443 11.3473 7.09065 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 9.47443 4.65553 6.75179 10.0149 10.6528 7.70313 numMergedOcc 0
4 mol 128 unq 0 iso 0 dist 5.4104 7.00257 9.38149 6.12126 6.31583 7.75012 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 7.82774 14.8567 8.21272 20.6396 13.0233 6.87262 numMergedOcc 0
6 mol 181 unq 0 iso 0 dist 9.1484 5.06341 9.89987 13.5786 13.7713 9.06217 numMergedOcc 0
7 mol 181 unq 1 iso 0 dist 9.1484 5.06341 9.89987 10.0904 9.77651 7.13252 numMergedOcc 0
8 mol 225 unq 0 iso 0 dist 6.89242 7.13133 6.27438 6.31342 6.4725 9.47117 numMergedOcc 0
9 mol 243 unq 0 iso 0 dist 8.41696 7.02674 7.24253 11.9535 5.32118 7.12785 numMergedOcc 0
10 mol 243 unq 1 iso 0 dist 8.41696 7.02674 7.24253 13.5433 11.4546 6.66959 numMergedOcc 0
11 mol 271 unq 0 iso 0 dist 6.67008 12.1942 8.97962 11.9518 6.75816 5.81266 numMergedOcc 0
