0 mol 68 unq 0 iso 0 dist 5.99047 9.46609 6.71645 8.75627 6.4776 8.80104 numMergedOcc 0
1 mol 105 unq 0 iso 0 dist 6.37212 8.32431 4.27067 11.2493 10.5157 8.76002 numMergedOcc 0
2 mol 128 unq 0 iso 0 dist 6.45731 6.12126 5.40594 12.3977 13.6081 9.89462 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 8.58727 4.95674 13.0351 8.01896 15.1309 8.07135 numMergedOcc 0
4 mol 133 unq 1 iso 0 dist 8.61597 4.95674 4.40152 8.01896 12.14 8.07135 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 8.11189 8.80672 9.50813 16.0482 18.13 8.77898 numMergedOcc 0
6 mol 151 unq 0 iso 0 dist 7.81284 9.74861 11.9263 6.94581 12.7475 5.63814 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 7.10634 9.34871 9.56606 8.07046 10.9872 7.345 numMergedOcc 0
8 mol 181 unq 1 iso 0 dist 7.10634 5.55727 4.69151 8.07046 10.9872 9.52987 numMergedOcc 0
9 mol 189 unq 0 iso 0 dist 8.49075 9.76153 6.70589 10.4343 13.8891 9.6013 numMergedOcc 0
10 mol 189 unq 1 iso 0 dist 8.49075 7.2571 5.88642 10.4343 13.8891 8.32712 numMergedOcc 0
11 mol 272 unq 0 iso 0 dist 7.49503 7.73965 4.62994 14.2413 10.5331 6.98048 numMergedOcc 0
12 mol 294 unq 0 iso 0 dist 9.00901 7.86196 12.6147 5.94806 11.4155 8.32473 numMergedOcc 0
