0 mol 4 unq 0 iso 0 dist 8.60134 9.82659 8.68164 13.2248 5.46803 9.25752 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 8.44727 4.86477 9.46349 7.66002 9.98735 6.19657 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 6.09085 11.023 5.64092 10.5465 4.58473 4.90093 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 6.09085 8.24064 8.71074 10.7148 6.5455 8.82347 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 7.21134 16.036 9.08745 21.7039 14.9271 7.41719 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 7.21134 16.036 9.08745 16.5888 10.2162 8.93237 numMergedOcc 0
6 mol 69 unq 2 iso 0 dist 7.40698 11.2122 9.08745 14.9117 14.9271 7.41719 numMergedOcc 0
7 mol 69 unq 3 iso 0 dist 7.40698 11.2122 9.08745 13.9276 10.2162 8.93237 numMergedOcc 0
8 mol 70 unq 0 iso 0 dist 8.63204 5.00416 7.99194 10.3745 8.44671 8.19398 numMergedOcc 0
9 mol 70 unq 1 iso 0 dist 9.19079 4.00828 7.99194 11.9722 8.44671 8.19398 numMergedOcc 0
10 mol 70 unq 2 iso 0 dist 5.4014 5.00416 7.80313 10.3745 9.65514 8.19398 numMergedOcc 0
11 mol 70 unq 3 iso 0 dist 8.37742 4.00828 7.80313 11.9722 9.65514 8.19398 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 5.91019 4.05022 4.27766 9.39392 5.17759 6.8173 numMergedOcc 0
13 mol 93 unq 0 iso 0 dist 7.49235 8.52218 7.24956 16.163 10.3243 9.15802 numMergedOcc 0
14 mol 116 unq 0 iso 0 dist 8.71812 6.28158 7.54274 13.5221 5.81344 9.82654 numMergedOcc 0
15 mol 152 unq 0 iso 0 dist 9.4275 14.7423 8.60651 23.4741 16.0705 8.78397 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.95209 4.59453 9.4366 7.21359 8.23952 8.51947 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 6.95744 3.68745 7.97504 5.72633 7.07738 7.01673 numMergedOcc 0
18 mol 252 unq 0 iso 0 dist 7.95045 14.1621 9.81261 18.651 12.4427 6.71152 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 6.19564 9.96926 7.49606 14.4614 9.97342 7.30584 numMergedOcc 0
