0 mol 10 unq 0 iso 0 dist 6.50444 5.94361 6.18431 12.8281 7.06787 9.07726 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.54508 7.42417 5.78532 16.4556 13.2892 9.73647 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.54508 7.42417 5.78532 12.8618 7.46758 7.26334 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.54508 10.5851 8.49709 12.8618 7.46758 6.19899 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.36381 6.53276 4.44526 13.5933 8.40153 9.33304 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 6.36381 6.53276 4.44526 9.49646 3.73215 4.5711 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 5.61567 7.27795 6.00377 8.46981 3.6458 9.35623 numMergedOcc 0
7 mol 30 unq 1 iso 0 dist 5.61567 7.27795 6.00377 11.8367 6.23294 9.4577 numMergedOcc 0
8 mol 30 unq 2 iso 0 dist 8.46981 7.27795 9.35623 5.61567 3.6458 6.00377 numMergedOcc 0
9 mol 30 unq 3 iso 0 dist 8.46981 7.27795 9.35623 11.8367 4.77197 9.4577 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 9.43496 15.7834 6.87506 14.672 6.02822 6.59716 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 5.33961 11.2155 9.25444 10.5543 6.70343 9.84703 numMergedOcc 0
12 mol 98 unq 1 iso 0 dist 5.33961 9.96465 8.46823 10.5543 6.70343 4.62494 numMergedOcc 0
13 mol 98 unq 2 iso 0 dist 8.3505 11.9783 9.84703 14.2657 6.70343 9.25444 numMergedOcc 0
14 mol 98 unq 3 iso 0 dist 8.3505 7.43001 4.62494 14.2657 6.70343 8.46823 numMergedOcc 0
15 mol 98 unq 4 iso 0 dist 9.29816 18.3829 9.25444 12.9554 6.70343 9.84703 numMergedOcc 0
16 mol 98 unq 5 iso 0 dist 9.29816 13.7832 8.46823 12.9554 6.70343 4.62494 numMergedOcc 0
17 mol 98 unq 6 iso 0 dist 5.08983 9.51607 9.25444 9.58039 6.70343 9.84703 numMergedOcc 0
18 mol 98 unq 7 iso 0 dist 5.08983 12.5752 8.46823 9.58039 6.70343 4.62494 numMergedOcc 0
19 mol 112 unq 0 iso 0 dist 4.77996 6.43704 6.11407 9.80187 5.11 8.72725 numMergedOcc 0
20 mol 168 unq 0 iso 0 dist 9.23064 4.10406 9.85438 7.30338 13.6611 9.42807 numMergedOcc 0
21 mol 168 unq 1 iso 0 dist 7.30338 4.10406 9.42807 9.23064 13.6611 9.85438 numMergedOcc 0
22 mol 169 unq 0 iso 0 dist 8.54444 6.9276 6.05009 11.0814 3.71099 6.0859 numMergedOcc 0
23 mol 171 unq 0 iso 0 dist 6.76574 4.47323 5.74846 12.2168 6.47468 9.34834 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 9.18289 6.33168 6.56416 6.52441 8.40937 6.88127 numMergedOcc 0
25 mol 186 unq 1 iso 0 dist 6.52441 6.33168 6.88127 9.18289 8.40937 6.56416 numMergedOcc 0
26 mol 196 unq 0 iso 0 dist 8.76076 4.0207 8.48879 4.36496 7.12401 5.89591 numMergedOcc 0
27 mol 196 unq 1 iso 0 dist 8.76076 4.0207 8.48879 7.34995 13.9022 9.72376 numMergedOcc 0
28 mol 196 unq 2 iso 0 dist 4.36496 4.0207 5.89591 8.76076 7.12401 8.48879 numMergedOcc 0
29 mol 196 unq 3 iso 0 dist 4.36496 4.0207 5.89591 7.34995 6.81108 9.72376 numMergedOcc 0
30 mol 196 unq 4 iso 0 dist 7.34995 4.0207 9.72376 8.76076 13.9022 8.48879 numMergedOcc 0
31 mol 196 unq 5 iso 0 dist 7.34995 4.0207 9.72376 4.36496 6.81108 5.89591 numMergedOcc 0
32 mol 224 unq 0 iso 0 dist 6.32334 4.12728 9.25617 12.5547 17.5293 9.46687 numMergedOcc 0
33 mol 225 unq 0 iso 0 dist 9.27308 11.3186 9.89167 14.0586 11.1622 6.94762 numMergedOcc 0
34 mol 274 unq 0 iso 0 dist 4.97796 6.70266 9.65868 8.97249 13.5848 7.77765 numMergedOcc 0
35 mol 274 unq 1 iso 0 dist 7.15079 9.95931 7.77765 9.39896 13.5848 9.65868 numMergedOcc 0
