0 mol 5 unq 0 iso 0 dist 7.0627 8.59201 7.56229 5.04052 3.33561 9.22027 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 7.62938 4.07888 8.87945 6.46284 5.31713 4.98321 numMergedOcc 0
2 mol 143 unq 0 iso 0 dist 7.99127 9.42107 6.60366 13.0453 10.4448 9.29944 numMergedOcc 0
3 mol 158 unq 0 iso 0 dist 4.80508 5.65593 9.44964 6.22696 5.09517 9.10671 numMergedOcc 0
4 mol 168 unq 0 iso 0 dist 6.24232 9.56342 6.53038 10.4276 8.60565 8.32353 numMergedOcc 0
5 mol 168 unq 1 iso 0 dist 8.1953 6.11883 6.53038 4.68544 8.60565 8.32353 numMergedOcc 0
6 mol 184 unq 0 iso 0 dist 7.79098 7.85099 5.23187 10.5972 3.74437 4.61596 numMergedOcc 0
7 mol 184 unq 1 iso 0 dist 6.30144 6.97246 5.23187 8.32647 3.74437 4.61596 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 7.93815 14.5127 9.4366 16.65 10.872 8.36129 numMergedOcc 0
9 mol 186 unq 1 iso 0 dist 7.93815 14.5127 9.4366 17.399 11.366 5.86483 numMergedOcc 0
10 mol 198 unq 0 iso 0 dist 9.50184 5.8901 7.04521 11.6989 3.70259 9.91727 numMergedOcc 0
11 mol 198 unq 1 iso 0 dist 6.49746 5.9839 7.04521 9.42723 3.70259 9.91727 numMergedOcc 0
12 mol 198 unq 2 iso 0 dist 5.8917 5.9839 8.85265 9.42723 5.13258 9.91727 numMergedOcc 0
13 mol 198 unq 3 iso 0 dist 9.70373 12.5506 7.04521 7.70823 3.70259 9.91727 numMergedOcc 0
14 mol 198 unq 4 iso 0 dist 9.76877 10.8876 7.04521 8.16611 3.70259 9.91727 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 7.00278 6.59905 7.33774 9.58463 5.80328 5.00369 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 8.50234 6.76479 6.39122 9.63166 3.68217 5.00369 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 7.81831 6.3054 6.50654 13.9749 8.88633 8.25329 numMergedOcc 0
18 mol 214 unq 1 iso 0 dist 7.81831 6.3054 6.50654 8.70011 3.64285 4.85332 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 9.63067 6.50689 8.4338 11.3925 8.6503 9.01338 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 8.26365 10.2114 9.21469 11.1835 7.72653 8.1635 numMergedOcc 0
21 mol 292 unq 1 iso 0 dist 8.26365 10.2114 9.21469 10.3189 5.36842 6.22943 numMergedOcc 0
22 mol 292 unq 2 iso 0 dist 8.26365 10.2114 9.21469 7.18462 3.08474 9.23612 numMergedOcc 0
