0 mol 13 unq 0 iso 0 dist 9.11447 7.98465 8.85788 10.2416 14.6038 6.00107 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.42581 9.06516 9.45442 15.5391 10.7672 8.13863 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.72896 6.52887 6.9277 4.10412 12.1488 7.60427 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 6.62481 6.52887 6.94466 4.10412 8.28877 7.60427 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 8.80104 7.95451 9.40469 6.29218 5.44028 6.33905 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 9.05798 9.08536 13.2984 9.54775 15.9765 4.22806 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 9.87025 6.13374 6.29394 4.15435 8.81779 4.22806 numMergedOcc 0
7 mol 119 unq 2 iso 0 dist 5.85818 9.08536 6.29394 9.54775 8.81779 4.22806 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.07135 8.55349 9.82696 11.2663 14.8544 5.47256 numMergedOcc 0
9 mol 182 unq 0 iso 0 dist 8.89822 7.25621 5.82684 3.88566 6.03308 7.21093 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 9.71865 9.27218 15.0713 15.7582 23.0819 8.53485 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 5.13453 8.91356 6.35462 15.824 13.3023 9.12682 numMergedOcc 0
12 mol 225 unq 1 iso 0 dist 7.95883 8.91356 16.563 15.824 23.6893 9.12682 numMergedOcc 0
13 mol 286 unq 0 iso 0 dist 8.72146 7.31896 11.4701 10.5287 11.8474 9.2551 numMergedOcc 0
