0 mol 32 unq 0 iso 0 dist 7.6082 5.07106 7.66677 11.1937 9.24687 10.3801 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 7.6082 4.92166 10.2379 11.1937 9.24687 14.7692 numMergedOcc 0
2 mol 132 unq 0 iso 0 dist 5.73579 8.72039 4.88005 4.05522 8.08406 11.5671 numMergedOcc 0
3 mol 154 unq 0 iso 0 dist 8.5081 8.65008 9.3097 14.3979 8.40395 13.6505 numMergedOcc 0
4 mol 181 unq 0 iso 0 dist 9.99964 8.90161 4.12983 6.3591 6.93144 7.11262 numMergedOcc 0
5 mol 181 unq 1 iso 0 dist 9.99964 8.90161 4.12983 10.1046 7.04782 6.60648 numMergedOcc 0
6 mol 181 unq 2 iso 0 dist 6.93144 7.11262 4.12983 6.3591 9.99964 8.90161 numMergedOcc 0
7 mol 181 unq 3 iso 0 dist 6.93144 7.11262 4.12983 4.53746 7.04782 6.60648 numMergedOcc 0
8 mol 181 unq 4 iso 0 dist 7.04782 6.60648 4.12983 4.53746 6.93144 7.11262 numMergedOcc 0
9 mol 181 unq 5 iso 0 dist 7.04782 6.60648 4.12983 10.1046 9.99964 8.90161 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 4.86882 9.35664 8.32665 3.98055 6.9612 12.6286 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 6.64341 8.12934 6.13765 3.70232 7.31315 10.9575 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 8.75001 7.12027 7.49582 12.1075 6.75599 13.6001 numMergedOcc 0
13 mol 241 unq 0 iso 0 dist 7.44279 8.48816 4.91384 5.34154 9.69499 12.4483 numMergedOcc 0
14 mol 241 unq 1 iso 0 dist 7.44279 9.8198 4.58996 5.34154 9.69499 10.4603 numMergedOcc 0
15 mol 244 unq 0 iso 0 dist 8.19381 9.06357 13.4361 11.9396 9.16789 16.7534 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 8.70514 8.5774 4.85294 5.78969 8.6462 8.01664 numMergedOcc 0
17 mol 265 unq 1 iso 0 dist 8.6462 8.01664 4.85294 5.78969 8.70514 8.5774 numMergedOcc 0
18 mol 276 unq 0 iso 0 dist 8.9021 9.57019 5.9082 4.22267 9.51947 11.9457 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 9.027 8.99435 7.20929 5.96716 8.12461 9.78915 numMergedOcc 0
