0 mol 19 unq 0 iso 0 dist 6.8824 9.79426 13.3381 6.31174 13.0619 9.04865 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.33492 9.79426 6.1852 6.31174 5.36258 9.04865 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.65989 6.01454 11.7008 4.16088 9.10314 9.18584 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 8.66272 6.01454 5.82846 4.16088 10.5108 9.18584 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 7.4963 4.83134 11.7196 6.24842 11.8194 8.25207 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 7.74278 4.83134 4.27464 6.24842 11.8153 8.25207 numMergedOcc 0
6 mol 133 unq 2 iso 0 dist 8.54607 5.17734 4.27464 9.07684 11.8153 8.25207 numMergedOcc 0
7 mol 133 unq 3 iso 0 dist 8.08807 4.83134 8.08082 6.24842 6.61636 8.25207 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 7.78154 6.68364 4.62682 9.50497 9.84953 5.90772 numMergedOcc 0
9 mol 143 unq 1 iso 0 dist 5.9183 6.68364 9.74045 9.50497 13.9913 5.90772 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 8.22267 8.94671 4.39505 14.6819 12.0424 9.23118 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.87204 9.94142 8.42816 6.42195 10.9075 9.9753 numMergedOcc 0
12 mol 211 unq 0 iso 0 dist 6.70983 9.8921 5.63202 11.2747 13.0116 9.97733 numMergedOcc 0
13 mol 219 unq 0 iso 0 dist 9.48678 4.67452 4.86182 6.05882 13.8189 9.52444 numMergedOcc 0
14 mol 223 unq 0 iso 0 dist 9.03969 5.75896 4.44076 12.3056 7.97754 9.67035 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 9.31156 7.62593 12.0777 7.32238 12.0468 6.4508 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 9.31156 7.58998 5.66462 4.10214 8.15582 4.64336 numMergedOcc 0
17 mol 254 unq 0 iso 0 dist 9.62779 7.53352 9.73538 12.4482 8.5372 9.89583 numMergedOcc 0
18 mol 254 unq 1 iso 0 dist 8.8044 7.53352 14.2144 12.4482 21.1368 9.89583 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 8.48012 8.12204 4.62446 11.3259 10.6205 6.36049 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 8.48012 8.12204 4.62446 8.72736 12.9915 9.19928 numMergedOcc 0
21 mol 293 unq 0 iso 0 dist 9.15753 8.42712 6.51518 7.13343 11.3258 7.96687 numMergedOcc 0
