0 mol 20 unq 0 iso 0 dist 9.14371 4.71011 9.4228 14.3246 16.7341 9.74724 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 9.14371 4.71011 9.4228 13.7531 14.3516 9.13347 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.80849 11.5035 6.48457 17.224 13.2846 7.18124 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.80849 11.5035 6.48457 17.9463 12.3897 6.47026 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.45835 17.3921 8.72013 21.6916 12.3916 9.15754 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 4.75701 9.78119 9.78235 6.02596 4.79453 9.33968 numMergedOcc 0
6 mol 90 unq 1 iso 0 dist 9.89618 15.2751 9.78235 8.17454 4.79453 9.33968 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 9.17862 3.65935 8.69749 7.97266 4.23405 9.24005 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 9.17862 6.43064 5.96576 7.97266 4.23405 7.88846 numMergedOcc 0
9 mol 95 unq 2 iso 0 dist 8.27456 8.49903 8.69749 11.6899 4.23405 9.24005 numMergedOcc 0
10 mol 95 unq 3 iso 0 dist 8.27456 5.11555 5.96576 11.6899 4.23405 7.88846 numMergedOcc 0
11 mol 116 unq 0 iso 0 dist 7.55822 8.18719 8.10448 6.98134 5.49724 7.39112 numMergedOcc 0
12 mol 178 unq 0 iso 0 dist 5.41229 4.4872 8.4173 6.3472 4.69387 6.53017 numMergedOcc 0
13 mol 178 unq 1 iso 0 dist 5.41229 4.4872 8.4173 12.6017 13.6551 8.83695 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 7.23126 9.74325 6.11835 9.91401 12.4987 8.94198 numMergedOcc 0
15 mol 196 unq 1 iso 0 dist 7.23126 13.0049 9.93668 9.91401 12.4987 9.49159 numMergedOcc 0
16 mol 196 unq 2 iso 0 dist 7.82805 8.87549 6.11835 12.5 12.4987 8.94198 numMergedOcc 0
17 mol 196 unq 3 iso 0 dist 7.82805 10.4831 9.93668 12.5 12.4987 9.49159 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 7.94694 6.84129 9.73419 9.97895 4.46135 9.24832 numMergedOcc 0
19 mol 206 unq 1 iso 0 dist 7.51923 6.84129 6.11803 9.97895 3.56132 9.24832 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 5.71825 7.44283 8.95821 6.23243 3.57917 8.15802 numMergedOcc 0
