0 mol 46 unq 0 iso 0 dist 9.31292 8.55031 13.8587 6.54685 14.4104 5.2568 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.09675 6.70925 7.78899 8.22845 4.8983 6.8173 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 9.02753 8.95756 7.78899 6.96897 4.8983 6.8173 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 5.53726 9.88184 7.30364 11.0283 6.34669 9.22123 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 5.53726 9.88184 7.30364 16.6198 13.6006 7.36335 numMergedOcc 0
5 mol 101 unq 0 iso 0 dist 7.22737 5.5199 6.63446 9.54415 12.1836 8.91685 numMergedOcc 0
6 mol 102 unq 0 iso 0 dist 9.22651 8.07962 6.43211 10.0473 9.51771 9.61193 numMergedOcc 0
7 mol 102 unq 1 iso 0 dist 5.32892 7.58908 6.43211 7.08749 9.51771 9.61193 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 9.09918 8.89412 4.1643 5.78374 7.75833 6.94015 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 4.69402 8.63817 5.16554 5.56456 6.67937 9.88156 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 9.28415 6.32669 7.38452 7.06015 8.12558 7.53168 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 9.28415 6.32669 7.38452 6 11.5996 5.18805 numMergedOcc 0
12 mol 141 unq 2 iso 0 dist 9.28415 6.32669 7.38452 8.90391 13.5014 7.11158 numMergedOcc 0
13 mol 183 unq 0 iso 0 dist 9.15795 9.92635 6.08414 5.27311 11.0859 8.58178 numMergedOcc 0
14 mol 183 unq 1 iso 0 dist 9.15795 9.92635 6.08414 6.58331 7.80268 4.77438 numMergedOcc 0
15 mol 183 unq 2 iso 0 dist 9.15795 9.92635 6.08414 12.5326 10.7359 5.73344 numMergedOcc 0
16 mol 183 unq 3 iso 0 dist 8.72128 7.85507 6.08414 3.84394 11.0859 8.58178 numMergedOcc 0
17 mol 183 unq 4 iso 0 dist 8.72128 7.85507 6.08414 5.46887 7.80268 4.77438 numMergedOcc 0
18 mol 183 unq 5 iso 0 dist 8.72128 7.85507 6.08414 11.1336 10.7359 5.73344 numMergedOcc 0
19 mol 185 unq 0 iso 0 dist 7.64068 5.40655 4.81985 3.82689 9.11629 4.91046 numMergedOcc 0
20 mol 199 unq 0 iso 0 dist 9.86694 8.22146 6.83716 3.78464 11.469 7.49503 numMergedOcc 0
21 mol 199 unq 1 iso 0 dist 9.86694 7.16849 5.88171 3.78464 11.469 9.2815 numMergedOcc 0
22 mol 244 unq 0 iso 0 dist 9.53211 9.91271 6.33602 3.29359 9.3491 9.32492 numMergedOcc 0
23 mol 244 unq 1 iso 0 dist 9.57082 9.91271 16.7499 3.29359 12.2072 9.32492 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 9.52903 9.4886 12.9877 10.3385 18.5953 9.30975 numMergedOcc 0
25 mol 265 unq 0 iso 0 dist 9.81689 6.98812 5.57706 13.0312 9.92016 6.80043 numMergedOcc 0
