0 mol 25 unq 0 iso 0 dist 8.41008 7.0928 12.4427 9.67946 15.9786 4.3253 6.32132 8.23292 5.04899 9.28244 numMergedOcc 0
1 mol 66 unq 0 iso 0 dist 7.1612 7.69019 5.95767 5.75397 6.97546 5.61937 5.89221 8.31793 8.96624 10.4691 numMergedOcc 0
2 mol 66 unq 1 iso 0 dist 7.1612 7.69019 5.95767 9.11975 6.70072 7.22146 5.89221 8.31793 8.96624 13.2323 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 9.52282 5.09688 6.89762 8.22984 10.0156 9.75737 9.65979 9.57498 6.45675 15.8683 numMergedOcc 0
4 mol 100 unq 1 iso 0 dist 9.52282 5.09688 6.89762 8.22984 10.0156 9.75737 12.2879 10.0165 7.47343 16.5404 numMergedOcc 0
5 mol 100 unq 2 iso 0 dist 9.52282 5.09688 6.89762 8.22984 10.0156 9.75737 10.2364 15.6218 8.86688 16.3323 numMergedOcc 0
6 mol 125 unq 0 iso 0 dist 4.81596 8.38646 6.06241 8.6317 6.22139 9.20086 6.5815 9.63302 8.62381 12.7356 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 8.95717 6.38977 11.3296 8.74658 10.0563 7.7567 6.82985 15.0724 8.40312 9.90168 numMergedOcc 0
8 mol 131 unq 1 iso 0 dist 8.95717 9.69757 15.665 8.74658 10.0563 8.23791 6.82985 15.0724 7.12972 9.90168 numMergedOcc 0
9 mol 192 unq 0 iso 0 dist 9.67207 9.05666 15.8138 7.27051 13.2917 12.717 5.64431 11.6579 5.59424 12.0486 numMergedOcc 0
10 mol 192 unq 1 iso 0 dist 9.67207 9.05666 15.8138 7.27051 13.2917 12.717 10.8223 16.8322 7.00794 16.9245 numMergedOcc 0
11 mol 192 unq 2 iso 0 dist 9.67207 9.05666 15.8138 7.35424 10.3343 14.8459 5.64431 11.6579 5.59424 12.708 numMergedOcc 0
12 mol 192 unq 3 iso 0 dist 9.67207 9.05666 15.8138 7.35424 10.3343 14.8459 10.8223 16.8322 7.00794 18.1003 numMergedOcc 0
13 mol 227 unq 0 iso 0 dist 9.09371 9.93154 5.71921 5.87056 7.15779 6.00424 6.78651 12.1015 9.34734 7.43071 numMergedOcc 0
14 mol 227 unq 1 iso 0 dist 9.09371 9.93154 5.71921 9.84311 13.3228 10.7656 6.78651 12.1015 9.34734 5.41321 numMergedOcc 0
15 mol 227 unq 2 iso 0 dist 9.09371 9.93154 5.71921 8.85568 6.10844 10.3825 6.78651 12.1015 9.34734 13.0798 numMergedOcc 0
16 mol 227 unq 3 iso 0 dist 9.09371 9.18218 9.08864 5.87056 7.15779 9.76735 6.78651 12.1015 7.56888 7.43071 numMergedOcc 0
17 mol 227 unq 4 iso 0 dist 9.09371 9.18218 9.08864 9.84311 13.3228 5.10635 6.78651 12.1015 7.56888 5.41321 numMergedOcc 0
18 mol 227 unq 5 iso 0 dist 9.09371 9.18218 9.08864 8.85568 6.10844 8.86483 6.78651 12.1015 7.56888 13.0798 numMergedOcc 0
19 mol 227 unq 6 iso 0 dist 9.09371 6.18486 8.98613 5.87056 7.15779 9.32448 6.78651 12.1015 7.55216 7.43071 numMergedOcc 0
20 mol 227 unq 7 iso 0 dist 9.09371 6.18486 8.98613 9.84311 13.3228 6.48027 6.78651 12.1015 7.55216 5.41321 numMergedOcc 0
21 mol 227 unq 8 iso 0 dist 9.09371 6.18486 8.98613 8.85568 6.10844 6.67321 6.78651 12.1015 7.55216 13.0798 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 8.27377 7.0247 12.8819 8.70383 10.9823 5.78064 10.9027 18.9173 9.02271 13.07 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 9.0643 7.26647 6.80146 5.83338 6.78245 7.86966 4.95196 11.0098 7.73141 10.3119 numMergedOcc 0
24 mol 261 unq 1 iso 0 dist 9.0643 7.26647 6.80146 5.83338 6.78245 7.86966 9.29412 14.3256 8.43057 11.0912 numMergedOcc 0
25 mol 261 unq 2 iso 0 dist 9.0643 7.7309 9.00992 5.83338 6.78245 6.65675 9.29412 14.3256 6.05727 11.0912 numMergedOcc 0
26 mol 261 unq 3 iso 0 dist 7.4202 7.26647 12.9384 5.83338 5.85813 7.86966 4.95196 12.1654 7.73141 10.3119 numMergedOcc 0
27 mol 261 unq 4 iso 0 dist 7.4202 7.26647 12.9384 5.83338 5.85813 7.86966 9.29412 13.9054 8.43057 11.0912 numMergedOcc 0
28 mol 261 unq 5 iso 0 dist 7.4202 7.7309 11.479 5.83338 5.85813 6.65675 9.29412 13.9054 6.05727 11.0912 numMergedOcc 0
29 mol 276 unq 0 iso 0 dist 8.0652 7.11272 11.0506 8.74282 7.57645 6.51623 5.75852 11.1221 6.87396 11.2569 numMergedOcc 0
30 mol 282 unq 0 iso 0 dist 7.28238 7.70229 6.17747 5.94224 5.64774 8.2662 8.93697 12.9555 8.76532 10.6906 numMergedOcc 0
31 mol 282 unq 1 iso 0 dist 7.28238 7.90792 7.94567 5.94224 5.64774 6.6348 8.93697 12.9555 6.33524 10.6906 numMergedOcc 0
32 mol 282 unq 2 iso 0 dist 7.3389 7.70229 13.1327 5.94224 5.61995 8.2662 8.93697 12.9821 8.76532 10.6906 numMergedOcc 0
33 mol 282 unq 3 iso 0 dist 7.3389 7.90792 11.2762 5.94224 5.61995 6.6348 8.93697 12.9821 6.33524 10.6906 numMergedOcc 0
