0 mol 10 unq 0 iso 0 dist 7.93277 11.0459 6.02154 12.2644 7.14537 5.96121 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 5.63499 6.7198 7.11695 7.73958 5.40489 4.06789 numMergedOcc 0
2 mol 53 unq 1 iso 0 dist 5.63499 10.1162 7.58093 7.73958 5.40489 6.57749 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 7.50377 6.71645 7.95451 6.50041 5.7369 5.6999 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.55112 6.14439 9.4866 6.38237 9.59729 4.00608 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 6.55112 5.70125 9.40363 6.38237 9.59729 11.915 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 4.73115 9.50813 6.57379 6.98491 5.78982 4.44936 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 5.97971 5.20775 6.76746 8.70425 9.92831 5.82984 numMergedOcc 0
8 mol 181 unq 1 iso 0 dist 8.72747 8.17808 6.76746 8.28396 9.92831 5.82984 numMergedOcc 0
9 mol 181 unq 2 iso 0 dist 8.23845 5.64849 6.76746 4.60202 9.92831 5.82984 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 9.20541 10.9358 5.87439 14.0091 8.22795 4.89429 numMergedOcc 0
11 mol 195 unq 1 iso 0 dist 9.20541 7.60158 8.18059 14.0091 8.22795 9.60056 numMergedOcc 0
12 mol 195 unq 2 iso 0 dist 6.65077 6.80353 9.74988 6.04748 6.396 7.42365 numMergedOcc 0
13 mol 195 unq 3 iso 0 dist 8.84149 7.56699 9.32333 4.3166 6.396 4.18074 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 7.86042 10.8745 9.27218 3.35829 6.69042 12.627 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 8.99484 10.1352 9.59084 4.76575 9.37602 5.88376 numMergedOcc 0
16 mol 217 unq 1 iso 0 dist 8.99484 10.1352 9.59084 11.715 8.26522 4.22021 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 8.76745 6.20562 7.79951 8.30723 6.09335 4.09934 numMergedOcc 0
18 mol 227 unq 1 iso 0 dist 5.77762 6.92493 7.79951 5.92282 6.09335 4.09934 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 5.52788 13.4031 9.84652 4.70535 4.66186 9.79637 numMergedOcc 0
