0 mol 2 unq 0 iso 0 dist 9.58976 9.57645 13.0675 6.23988 6.35342 12.3504 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.59893 9.06005 13.0997 5.42328 5.59773 14.3381 numMergedOcc 0
2 mol 60 unq 0 iso 0 dist 8.82095 6.27749 6.54743 10.9023 5.83937 10.9217 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.68526 7.26679 15.7123 4.4628 9.72442 10.1503 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 9.68526 9.30776 13.7412 4.4628 9.72442 13.2514 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 9.72442 9.02288 17.8791 4.4628 9.68526 9.75201 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 7.26679 9.68526 15.7123 5.47475 6.89722 11.7436 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 7.26679 9.30776 12.016 5.47475 6.89722 14.4206 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 9.02288 9.72442 17.8791 7.64038 9.58544 16.0684 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 9.80678 9.43411 9.15076 7.56811 9.01767 12.9236 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 7.83619 8.54461 8.38345 15.0214 9.91643 17.231 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 5.08206 9.57611 9.24932 7.01839 8.69888 11.3646 numMergedOcc 0
12 mol 206 unq 0 iso 0 dist 8.31638 9.99185 5.18293 13.4033 9.72979 14.2547 numMergedOcc 0
13 mol 206 unq 1 iso 0 dist 9.72979 6.97859 7.08143 13.4033 8.31638 14.4113 numMergedOcc 0
14 mol 206 unq 2 iso 0 dist 6.97859 9.72979 7.08143 6.09091 9.38127 10.0788 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 9.34636 9.79616 4.70378 14.4585 6.56437 9.2491 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 9.34636 9.79616 4.70378 14.027 6.23882 10.6031 numMergedOcc 0
17 mol 224 unq 2 iso 0 dist 9.34636 9.79616 4.70378 7.4034 9.53131 10.7064 numMergedOcc 0
18 mol 249 unq 0 iso 0 dist 7.29898 5.78121 8.34718 5.2966 8.91685 10.4288 numMergedOcc 0
19 mol 257 unq 0 iso 0 dist 4.97263 5.36776 5.6276 6.0137 7.0132 10.3341 numMergedOcc 0
20 mol 273 unq 0 iso 0 dist 9.96963 8.90885 5.96724 6.80715 7.89852 10.8195 numMergedOcc 0
21 mol 274 unq 0 iso 0 dist 7.80446 9.86142 5.34251 10.3541 9.91395 13.506 numMergedOcc 0
22 mol 274 unq 1 iso 0 dist 7.79904 9.02749 12.8986 12.757 9.86142 18.734 numMergedOcc 0
23 mol 274 unq 2 iso 0 dist 9.86142 7.80446 5.34251 12.757 7.79904 12.4776 numMergedOcc 0
