0 mol 21 unq 0 iso 0 dist 5.27589 9.24767 8.60952 4.2995 7.30688 7.05407 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 5.27589 9.24767 8.60952 5.73645 6.70786 14.1789 numMergedOcc 0
2 mol 21 unq 2 iso 0 dist 5.27589 9.24767 8.60952 5.29979 8.16395 14.0991 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 7.32436 6.94712 5.17091 5.61075 9.87963 10.1596 numMergedOcc 0
4 mol 128 unq 0 iso 0 dist 7.94925 6.78833 9.41812 9.02609 5.23695 11.2119 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 8.65807 9.47287 5.23445 9.41378 7.15213 7.5573 numMergedOcc 0
6 mol 130 unq 1 iso 0 dist 8.65807 9.47287 5.23445 7.46055 8.86516 9.58633 numMergedOcc 0
7 mol 195 unq 0 iso 0 dist 8.3941 8.08491 13.7639 11.5968 7.75518 16.4813 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 6.58174 7.59666 5.9546 5.10199 5.81438 9.26214 numMergedOcc 0
9 mol 204 unq 1 iso 0 dist 6.58174 6.51936 5.9943 5.10199 5.81438 5.00369 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 9.292 9.94292 4.86533 5.11101 8.25288 11.1983 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 7.24175 6.28826 5.77142 10.996 8.44407 8.25329 numMergedOcc 0
12 mol 214 unq 1 iso 0 dist 7.24175 6.28826 5.77142 5.055 6.0155 4.85332 numMergedOcc 0
13 mol 214 unq 2 iso 0 dist 7.24175 6.28826 5.77142 10.6488 8.89981 13.526 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 8.78219 7.30349 15.1414 8.86075 7.97711 15.971 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 4.49395 7.12723 5.62841 7.14335 5.49829 10.5486 numMergedOcc 0
16 mol 285 unq 1 iso 0 dist 4.49395 7.12723 5.62841 7.67857 6.24134 10.4537 numMergedOcc 0
