0 mol 46 unq 0 iso 0 dist 7.99847 8.1129 6.19084 5.86337 9.27409 5.79552 numMergedOcc 0
1 mol 83 unq 0 iso 0 dist 8.82069 10.4538 9.42195 10.9416 9.97781 5.8771 numMergedOcc 0
2 mol 83 unq 1 iso 0 dist 7.03997 8.10358 9.42195 4.89289 9.97781 5.8771 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 9.92781 15.9557 7.43804 14.5779 5.94696 6.39965 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 6.56349 5.67331 7.43804 9.30319 5.94696 6.39965 numMergedOcc 0
5 mol 116 unq 0 iso 0 dist 9.6596 13.9149 7.85045 11.5791 7.6005 12.6384 numMergedOcc 0
6 mol 116 unq 1 iso 0 dist 9.6596 13.9149 7.85045 8.29258 8.7583 14.5749 numMergedOcc 0
7 mol 116 unq 2 iso 0 dist 9.07912 6.53557 7.85045 15.8278 7.6005 12.6384 numMergedOcc 0
8 mol 116 unq 3 iso 0 dist 9.07912 6.53557 7.85045 16.1224 8.7583 14.5749 numMergedOcc 0
9 mol 120 unq 0 iso 0 dist 8.13828 8.73643 8.41086 7.66137 8.73484 11.0066 numMergedOcc 0
10 mol 120 unq 1 iso 0 dist 8.13828 12.7982 7.41599 7.66137 8.73484 8.42157 numMergedOcc 0
11 mol 253 unq 0 iso 0 dist 8.78468 5.18736 8.30852 11.5768 9.34735 14.4712 numMergedOcc 0
12 mol 278 unq 0 iso 0 dist 7.39778 7.50114 5.79682 6.46749 9.21145 6.9408 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 5.72538 7.77692 5.62568 3.81488 8.42076 7.85119 numMergedOcc 0
14 mol 287 unq 1 iso 0 dist 5.72538 11.263 8.82948 3.81488 8.42076 13.9294 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 5.72538 7.77692 5.62568 3.81488 8.42076 7.85119 numMergedOcc 0
16 mol 288 unq 1 iso 0 dist 5.72538 11.263 8.82948 3.81488 8.42076 13.9294 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 5.72538 7.77692 5.62568 3.81488 8.42076 7.85119 numMergedOcc 0
18 mol 289 unq 1 iso 0 dist 5.72538 11.263 8.82948 3.81488 8.42076 13.9294 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 6.78832 7.04499 5.67671 4.45463 6.68863 6.32057 numMergedOcc 0
