0 mol 26 unq 0 iso 0 dist 9.43688 7.34549 6.4487 11.0672 15.7779 9.7522 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.64424 7.34549 4.52042 11.0672 8.62527 9.7522 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 8.97337 8.09068 6.4487 15.3987 15.7779 9.7522 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 7.04006 9.72289 6.4487 18.4863 15.7779 9.7522 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 4.22514 6.13476 5.65405 10.5752 8.34361 5.97635 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 5.25083 7.63534 6.71804 10.4745 13.2925 8.58841 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 8.04064 9.89618 16.1433 9.88666 17.7428 9.44078 numMergedOcc 0
7 mol 90 unq 1 iso 0 dist 8.04064 9.89618 16.1433 10.1669 17.2601 5.9179 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 7.55581 8.94909 14.5299 6.45157 10.3551 5.86531 numMergedOcc 0
9 mol 196 unq 0 iso 0 dist 8.52655 7.07723 9.06413 10.0417 14.9075 6.25429 numMergedOcc 0
10 mol 213 unq 0 iso 0 dist 9.82428 9.1663 7.02346 11.0215 14.4816 7.88794 numMergedOcc 0
11 mol 234 unq 0 iso 0 dist 9.24896 8.9413 7.54044 16.6823 11.7673 7.86368 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 9.42047 8.39522 17.8038 5.58605 13.5778 6.24928 numMergedOcc 0
13 mol 241 unq 0 iso 0 dist 4.66398 8.18588 9.64766 5.06075 7.30582 8.40773 numMergedOcc 0
14 mol 241 unq 1 iso 0 dist 4.66398 8.18588 9.64766 13.1806 16.3629 9.18476 numMergedOcc 0
15 mol 257 unq 0 iso 0 dist 8.5835 7.80336 6.64096 12.1004 9.27027 7.82899 numMergedOcc 0
16 mol 257 unq 1 iso 0 dist 7.86554 8.95261 12.6476 15.2818 19.4332 7.82899 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 5.80603 5.29682 5.20592 6.00285 5.16838 5.90645 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 9.4945 6.70123 7.0797 4.31756 11.633 9.77689 numMergedOcc 0
19 mol 277 unq 1 iso 0 dist 9.4945 6.70123 7.0797 11.7666 15.491 8.51931 numMergedOcc 0
