0 mol 31 unq 0 iso 0 dist 8.54682 9.97586 3.57805 4.493 9.67338 9.95496 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 8.14146 8.06999 3.56619 5.19109 9.87699 7.7485 numMergedOcc 0
2 mol 93 unq 0 iso 0 dist 8.10296 9.90891 4.34681 13.5134 7.83506 10.8976 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 6.25088 7.98399 6.29259 9.26558 7.40338 5.31126 numMergedOcc 0
4 mol 113 unq 1 iso 0 dist 6.25088 9.72242 5.40648 9.26558 7.40338 9.75234 numMergedOcc 0
5 mol 113 unq 2 iso 0 dist 8.23837 7.98399 8.17309 11.6507 5.35711 11.772 numMergedOcc 0
6 mol 113 unq 3 iso 0 dist 8.23837 7.98399 8.17309 9.26558 6.23759 5.31126 numMergedOcc 0
7 mol 113 unq 4 iso 0 dist 8.23837 9.72242 3.52111 11.6507 5.35711 7.02358 numMergedOcc 0
8 mol 113 unq 5 iso 0 dist 8.23837 9.72242 3.52111 9.26558 6.23759 9.75234 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 6.10988 8.47667 4.73732 8.42353 7.84546 12.0386 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 6.10988 9.7638 4.94367 8.42353 7.84546 7.53342 numMergedOcc 0
11 mol 169 unq 0 iso 0 dist 6.66976 7.5669 6.28646 9.08641 7.85698 5.10589 numMergedOcc 0
12 mol 169 unq 1 iso 0 dist 6.66976 7.5669 6.28646 10.6507 8.75484 14.0788 numMergedOcc 0
13 mol 169 unq 2 iso 0 dist 8.36806 7.5669 7.83748 11.5877 5.41121 11.645 numMergedOcc 0
14 mol 169 unq 3 iso 0 dist 8.36806 7.5669 7.83748 9.08641 6.35799 5.10589 numMergedOcc 0
15 mol 196 unq 0 iso 0 dist 9.36505 5.71508 12.8544 15.0588 6.14222 18.6988 numMergedOcc 0
16 mol 256 unq 0 iso 0 dist 8.96004 6.87466 3.96807 9.16839 6.96483 5.58222 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 7.12219 9.59154 7.78509 8.22733 7.63543 13.7134 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 7.12219 8.54753 4.60397 8.22733 7.63543 12.0398 numMergedOcc 0
19 mol 291 unq 0 iso 0 dist 7.14458 9.60522 14.4259 6.24497 5.40381 15.4527 numMergedOcc 0
