0 mol 18 unq 0 iso 0 dist 9.2978 8.25905 5.01478 5.53781 8.69189 9.42201 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 9.2978 8.25905 5.01478 4.84965 6.41856 5.03976 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 7.37356 8.25905 7.04695 4.84965 8.51213 5.03976 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.36524 5.73257 8.90278 9.05146 8.16494 12.5362 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 6.84521 7.84444 8.01951 5.00932 8.99509 10.5823 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 8.90024 7.84444 12.2025 5.00932 8.47617 10.5823 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 6.78532 7.84444 7.68348 5.00932 5.73331 10.5823 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 8.27156 4.89196 5.49555 11.3515 9.58156 12.7273 numMergedOcc 0
8 mol 62 unq 1 iso 0 dist 8.27156 4.89196 5.49555 11.2658 7.59416 11.5202 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 8.07365 6.47401 8.73564 4.90339 9.17862 10.2692 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 8.07365 6.47401 8.73564 12.9365 8.27456 16.4186 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 7.2443 8.94447 8.69934 8.94648 9.57352 6.32393 numMergedOcc 0
12 mol 120 unq 0 iso 0 dist 5.06555 9.68343 8.94259 7.08572 8.20009 16.1118 numMergedOcc 0
13 mol 120 unq 1 iso 0 dist 5.06555 9.68343 8.94259 9.04066 8.14799 16.8896 numMergedOcc 0
14 mol 122 unq 0 iso 0 dist 8.47907 9.55337 5.41882 8.96396 8.054 10.9191 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 8.94541 4.87879 5.9915 9.35663 8.75736 10.996 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 8.94541 4.87879 5.9915 4.4033 6.76166 6.33375 numMergedOcc 0
17 mol 134 unq 2 iso 0 dist 7.30919 5.98435 11.4638 14.4662 8.75736 16.1059 numMergedOcc 0
18 mol 134 unq 3 iso 0 dist 7.30919 5.98435 11.4638 12.021 6.76166 14.9843 numMergedOcc 0
19 mol 134 unq 4 iso 0 dist 7.30919 8.80672 5.9915 14.4662 8.75736 10.996 numMergedOcc 0
20 mol 134 unq 5 iso 0 dist 7.30919 8.80672 5.9915 12.021 6.76166 6.33375 numMergedOcc 0
21 mol 178 unq 0 iso 0 dist 8.04723 5.85439 5.25267 11.2444 7.14849 8.71031 numMergedOcc 0
22 mol 178 unq 1 iso 0 dist 8.04723 5.85439 5.25267 12.3996 8.63718 13.0808 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 9.79816 7.89694 11.0503 12.3761 9.85348 17.6412 numMergedOcc 0
24 mol 218 unq 1 iso 0 dist 9.79816 5.66171 7.47048 12.3761 9.85348 13.0683 numMergedOcc 0
25 mol 248 unq 0 iso 0 dist 7.40475 7.96942 10.1857 11.4636 9.5107 17.8606 numMergedOcc 0
26 mol 280 unq 0 iso 0 dist 6.52188 6.78323 6.24406 9.78637 7.1704 12.284 numMergedOcc 0
27 mol 280 unq 1 iso 0 dist 6.52188 6.78323 6.24406 4.78798 5.59626 7.10608 numMergedOcc 0
28 mol 281 unq 0 iso 0 dist 9.27716 9.26654 6.82073 5.25454 7.04661 10.7812 numMergedOcc 0
