0 mol 15 unq 0 iso 0 dist 8.83891 7.49229 6.23015 6.82187 6.91314 5.89412 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 8.83891 7.49229 6.23015 12.0227 5.49251 7.07399 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 5.95472 9.80375 6.21128 18.1516 13.4019 8.51663 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.79061 5.00474 6.14542 11.6724 5.70116 9.24757 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 9.84288 5.06999 8.77355 9.87709 12.6799 9.30539 numMergedOcc 0
5 mol 96 unq 0 iso 0 dist 9.62431 8.0334 9.13187 13.9613 8.75437 8.39111 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.88752 12.8098 8.83732 17.1647 13.0405 6.16242 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 8.88752 12.8098 8.83732 14.4401 13.7612 5.87634 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 7.95751 4.1584 7.42144 10.0313 4.32342 8.10291 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 5.39002 4.1584 6.27658 10.0313 7.17845 8.10291 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 8.99128 11.7393 9.16358 12.9795 4.91785 7.92304 numMergedOcc 0
11 mol 155 unq 1 iso 0 dist 8.99128 10.7516 9.24038 15.3124 12.6999 8.69157 numMergedOcc 0
12 mol 155 unq 2 iso 0 dist 8.99128 10.7516 9.24038 8.57712 7.10286 6.53347 numMergedOcc 0
13 mol 159 unq 0 iso 0 dist 9.45909 17.2892 9.35202 12.2567 4.48323 8.4858 numMergedOcc 0
14 mol 170 unq 0 iso 0 dist 9.66676 4.11212 6.47164 11.0677 4.12764 9.10511 numMergedOcc 0
15 mol 170 unq 1 iso 0 dist 9.66676 4.11212 6.47164 9.32245 4.78249 6.35982 numMergedOcc 0
16 mol 170 unq 2 iso 0 dist 9.66676 9.2613 9.65126 9.32245 4.78249 7.51126 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 5.97971 7.18433 5.99437 7.7544 5.71898 9.39829 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 5.97971 7.18433 5.99437 11.1074 5.93724 6.41453 numMergedOcc 0
19 mol 181 unq 2 iso 0 dist 8.72747 6.37887 5.99437 11.7328 5.71898 9.39829 numMergedOcc 0
20 mol 181 unq 3 iso 0 dist 8.72747 6.37887 5.99437 12.2168 5.93724 6.41453 numMergedOcc 0
21 mol 181 unq 4 iso 0 dist 8.23845 4.94211 5.99437 9.88721 5.71898 9.39829 numMergedOcc 0
22 mol 181 unq 5 iso 0 dist 8.23845 4.94211 5.99437 10.8515 5.93724 6.41453 numMergedOcc 0
23 mol 195 unq 0 iso 0 dist 9.20541 8.71774 6.22742 10.999 5.41635 7.36683 numMergedOcc 0
24 mol 195 unq 1 iso 0 dist 9.20541 8.71774 6.22742 7.04524 6.04871 9.26504 numMergedOcc 0
25 mol 222 unq 0 iso 0 dist 7.99441 4.07008 8.43195 8.86173 6.84862 7.67576 numMergedOcc 0
26 mol 222 unq 1 iso 0 dist 6.71817 4.07008 8.23406 8.86173 9.53117 7.67576 numMergedOcc 0
27 mol 244 unq 0 iso 0 dist 8.93589 4.89551 6.53416 9.21656 6.1597 5.50492 numMergedOcc 0
