0 mol 46 unq 0 iso 0 dist 8.78474 3.89419 8.55031 6.64053 8.16183 8.55766 numMergedOcc 0
1 mol 46 unq 1 iso 0 dist 8.24314 10.1729 8.55031 5.31335 8.16183 8.55766 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.76963 6.03473 9.06225 9.49124 8.5069 11.0447 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 8.29525 8.65165 9.81273 9.41457 9.71722 3.86836 numMergedOcc 0
4 mol 110 unq 0 iso 0 dist 9.64651 11.0512 6.70591 9.98341 9.24252 10.3414 numMergedOcc 0
5 mol 110 unq 1 iso 0 dist 9.64651 7.12329 5.43052 9.98341 9.24252 10.3403 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 9.4113 4.62506 9.53814 7.63804 8.86384 8.87807 numMergedOcc 0
7 mol 148 unq 1 iso 0 dist 6.89518 11.8881 9.22427 3.86182 8.3656 13.5761 numMergedOcc 0
8 mol 150 unq 0 iso 0 dist 6.84108 11.8345 9.32504 3.97184 8.44633 13.6344 numMergedOcc 0
9 mol 183 unq 0 iso 0 dist 9.84306 9.24396 9.92635 6.32333 8.41645 10.4828 numMergedOcc 0
10 mol 183 unq 1 iso 0 dist 9.84306 6.29417 7.85507 6.32333 8.41645 6.77174 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 8.67145 8.64161 5.79753 5.29397 8.18029 8.31631 numMergedOcc 0
12 mol 197 unq 1 iso 0 dist 8.67145 5.68443 7.56537 5.29397 8.18029 5.38951 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 8.61558 11.1744 6.74371 9.24969 5.07975 7.07952 numMergedOcc 0
14 mol 222 unq 1 iso 0 dist 8.61558 11.1744 6.74371 11.2636 4.85015 4.6646 numMergedOcc 0
15 mol 222 unq 2 iso 0 dist 8.61558 11.1744 6.74371 14.4003 8.15345 3.6886 numMergedOcc 0
16 mol 222 unq 3 iso 0 dist 8.61558 11.1744 6.74371 9.68423 5.71304 4.90032 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 9.4155 5.48066 8.38742 5.16584 7.87591 5.99784 numMergedOcc 0
