0 mol 24 unq 0 iso 0 dist 6.03041 14.4605 8.80127 13.5328 7.6222 5.54419 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.03041 14.4605 8.80127 15.54 11.7026 7.36323 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.03041 4.42703 6.48457 11.8431 9.9259 8.86116 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.03041 4.42703 6.48457 12.7246 12.2071 8.38394 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 4.44406 8.14351 9.07906 8.99509 8.42544 5.73819 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 4.44406 8.14351 9.07906 8.47617 6.09486 6.20293 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 4.44406 8.14351 9.07906 5.73331 4.40385 8.93915 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 7.27074 12.8517 8.82395 14.8139 7.85262 7.2658 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 9.67848 5.15479 8.43667 10.5366 6.62208 7.34473 numMergedOcc 0
9 mol 120 unq 0 iso 0 dist 9.09944 7.63664 8.1671 8.93752 4.98499 6.44653 numMergedOcc 0
10 mol 120 unq 1 iso 0 dist 6.05523 5.6257 8.1671 8.20009 4.98499 6.44653 numMergedOcc 0
11 mol 120 unq 2 iso 0 dist 7.81657 5.0256 8.1671 8.14799 4.98499 6.44653 numMergedOcc 0
12 mol 127 unq 0 iso 0 dist 9.61323 5.05588 8.82676 10.9725 6.3084 8.14887 numMergedOcc 0
13 mol 127 unq 1 iso 0 dist 9.61323 5.05588 8.82676 11.5669 12.4721 9.30299 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 4.58432 8.41711 8.86966 9.37459 8.18329 5.87555 numMergedOcc 0
15 mol 152 unq 1 iso 0 dist 4.58432 8.41711 8.86966 9.0847 5.97115 6.70283 numMergedOcc 0
16 mol 152 unq 2 iso 0 dist 4.58432 8.41711 8.86966 6.00061 4.36394 8.67331 numMergedOcc 0
17 mol 152 unq 3 iso 0 dist 4.58432 4.82496 5.7527 9.37459 8.18329 8.87437 numMergedOcc 0
18 mol 152 unq 4 iso 0 dist 4.58432 4.82496 5.7527 9.0847 5.97115 7.16148 numMergedOcc 0
19 mol 152 unq 5 iso 0 dist 4.58432 4.82496 5.7527 6.00061 4.36394 8.05741 numMergedOcc 0
20 mol 182 unq 0 iso 0 dist 6.17569 11.8631 9.07173 12.8688 9.87473 9.31746 numMergedOcc 0
21 mol 252 unq 0 iso 0 dist 9.76717 10.2202 7.48298 12.2862 6.56535 7.19638 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 6.85252 12.641 9.00426 19.1885 15.4874 9.14619 numMergedOcc 0
23 mol 272 unq 0 iso 0 dist 9.04583 4.4556 8.97468 12.4356 9.96676 8.48753 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 8.90491 4.51764 7.83245 13.0233 6.36192 9.70696 numMergedOcc 0
