0 mol 26 unq 0 iso 0 dist 8.36742 8.10028 6.92384 4.52042 7.98005 8.31381 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.10028 8.36742 6.92384 4.52042 8.31381 7.98005 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.07773 9.36493 13.9162 4.30086 9.99939 11.3695 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 7.07773 9.0665 9.25715 4.30086 9.99939 13.0621 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 4.39888 5.29595 3.20411 6.13436 8.06267 5.88334 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 5.29595 4.39888 3.20411 6.13436 5.88334 8.06267 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 6.50622 4.45433 3.46822 5.58109 9.85512 8.97888 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 4.45433 6.50622 3.46822 5.58109 8.97888 9.85512 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 7.39733 8.07518 5.16472 7.07865 8.29467 8.86172 numMergedOcc 0
9 mol 184 unq 0 iso 0 dist 7.72354 9.511 3.67493 7.25468 9.84566 11.0396 numMergedOcc 0
10 mol 194 unq 0 iso 0 dist 7.26295 7.31316 3.78714 15.6354 9.52922 11.7672 numMergedOcc 0
11 mol 194 unq 1 iso 0 dist 7.31316 7.26295 3.78714 14.1448 9.38984 13.001 numMergedOcc 0
12 mol 194 unq 2 iso 0 dist 7.31316 7.26295 3.78714 12.1716 9.91118 13.1712 numMergedOcc 0
13 mol 253 unq 0 iso 0 dist 8.24401 8.44543 5.00013 7.24315 8.93741 11.3445 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 5.57978 6.92906 8.91869 9.65708 6.76495 12.1509 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 5.57978 6.92906 8.91869 10.4505 5.4557 11.3432 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 8.90108 9.98144 5.57024 7.64772 8.12739 6.09853 numMergedOcc 0
17 mol 274 unq 1 iso 0 dist 9.98144 8.90108 5.57024 7.64772 6.09853 8.12739 numMergedOcc 0
