0 mol 21 unq 0 iso 0 dist 9.50179 5.92388 4.56848 5.08834 10.7472 8.73484 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 6.72231 5.92388 4.71732 5.08834 11.1525 8.73484 numMergedOcc 0
2 mol 143 unq 0 iso 0 dist 7.64085 9.99012 5.64264 6.36527 9.07229 7.22 numMergedOcc 0
3 mol 152 unq 0 iso 0 dist 5.59682 6.68265 4.19899 12.755 12.0246 9.48674 numMergedOcc 0
4 mol 152 unq 1 iso 0 dist 7.71277 7.78842 4.19899 6.79236 12.0246 9.48674 numMergedOcc 0
5 mol 162 unq 0 iso 0 dist 8.98459 9.88912 4.06355 7.6506 10.751 9.56342 numMergedOcc 0
6 mol 165 unq 0 iso 0 dist 9.59989 5.93144 11.7431 6.35196 15.8804 7.61231 numMergedOcc 0
7 mol 182 unq 0 iso 0 dist 9.07183 6.55146 3.67039 13.9827 10.9112 9.19506 numMergedOcc 0
8 mol 194 unq 0 iso 0 dist 5.69763 7.96463 7.55666 9.6989 11.4221 8.95728 numMergedOcc 0
9 mol 210 unq 0 iso 0 dist 6.41444 7.95917 5.30972 4.60996 9.98717 9.0259 numMergedOcc 0
10 mol 230 unq 0 iso 0 dist 6.88683 8.01593 7.62813 5.02022 8.02209 6.31092 numMergedOcc 0
11 mol 253 unq 0 iso 0 dist 9.58767 9.31626 7.64377 9.18036 12.8625 6.3738 numMergedOcc 0
12 mol 274 unq 0 iso 0 dist 6.12202 8.67957 12.2201 5.1571 11.2081 7.66409 numMergedOcc 0
