0 mol 17 unq 0 iso 0 dist 5.41678 8.44037 5.22923 4.67446 7.30541 8.55161 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.9175 9.80453 3.42062 12.7412 9.66461 12.6509 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 8.68096 8.96181 7.84103 6.94523 6.95021 12.5246 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 6.34231 9.02073 3.30756 12.6645 9.12873 7.93498 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 6.24764 7.61514 3.81285 5.55433 6.27877 7.51319 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 6.24764 8.21116 6.17121 5.55433 6.27877 8.49887 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 6.95777 7.91691 9.06356 6.99545 8.10965 14.2555 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 6.98104 5.56913 8.97988 12.1721 9.26609 15.4038 numMergedOcc 0
8 mol 136 unq 0 iso 0 dist 5.95839 6.99374 7.8989 9.86783 5.00698 12.7237 numMergedOcc 0
9 mol 136 unq 1 iso 0 dist 5.95839 6.99374 7.8989 5.72482 8.99371 10.4569 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 9.44435 9.3776 5.0146 10.073 4.95077 9.71586 numMergedOcc 0
11 mol 176 unq 0 iso 0 dist 4.60553 5.23992 3.71345 7.86601 9.24242 8.79752 numMergedOcc 0
12 mol 176 unq 1 iso 0 dist 4.60553 7.91974 6.55919 7.86601 9.24242 10.0335 numMergedOcc 0
13 mol 176 unq 2 iso 0 dist 4.60553 9.1617 7.10617 7.86601 9.24242 7.58281 numMergedOcc 0
14 mol 249 unq 0 iso 0 dist 5.98732 5.3865 3.89698 5.7486 9.19506 6.62413 numMergedOcc 0
15 mol 278 unq 0 iso 0 dist 5.41035 8.69111 5.40345 9.05496 9.79758 15.1396 numMergedOcc 0
