0 mol 10 unq 0 iso 0 dist 8.03458 5.3273 8.61887 10.0741 3.58347 9.39886 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.69637 5.06937 9.34846 10.7555 6.43093 9.03541 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.12541 5.31555 6.12735 9.28146 3.76356 8.91529 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 5.06188 6.47086 8.5859 7.78899 4.55422 7.95815 numMergedOcc 0
4 mol 87 unq 0 iso 0 dist 6.22441 4.40643 9.42123 6.21094 6.42891 7.51011 numMergedOcc 0
5 mol 87 unq 1 iso 0 dist 6.22441 4.40643 9.42123 8.44482 10.8407 8.74603 numMergedOcc 0
6 mol 87 unq 2 iso 0 dist 5.91543 4.40643 9.18848 6.21094 4.13495 7.51011 numMergedOcc 0
7 mol 87 unq 3 iso 0 dist 5.91543 4.40643 9.18848 8.44482 6.37184 8.74603 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 9.84762 5.81849 9.53895 12.3882 12.7313 7.14258 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 5.2184 5.7998 9.53895 11.495 12.7313 7.14258 numMergedOcc 0
10 mol 127 unq 0 iso 0 dist 5.83719 9.81852 9.62885 13.1374 9.49228 9.17001 numMergedOcc 0
11 mol 139 unq 0 iso 0 dist 9.70154 10.5769 8.66615 6.79625 3.82037 9.07404 numMergedOcc 0
12 mol 139 unq 1 iso 0 dist 8.78382 6.5333 8.66615 7.20542 3.82037 9.07404 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 5.61326 6.15002 6.77515 7.75518 4.3166 5.08438 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 4.81837 6.89035 5.8325 5.63283 4.7106 8.71347 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 6.52136 10.9533 9.24348 11.8272 7.9981 5.83021 numMergedOcc 0
16 mol 229 unq 0 iso 0 dist 8.4208 10.4845 7.32814 13.1357 6.70152 8.70717 numMergedOcc 0
17 mol 268 unq 0 iso 0 dist 7.87089 13.1353 8.56839 10.8903 4.74092 8.87653 numMergedOcc 0
18 mol 286 unq 0 iso 0 dist 6.83763 5.69037 8.98417 6.64391 3.67621 8.09566 numMergedOcc 0
19 mol 286 unq 1 iso 0 dist 6.83763 6.54635 8.60873 6.64391 3.67621 5.6343 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 6.96774 4.38561 8.05825 7.19568 3.85958 9.5356 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 6.96774 4.38561 8.05825 7.19568 3.85958 9.5356 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 6.96774 4.38561 8.05825 7.19568 3.85958 9.5356 numMergedOcc 0
