0 mol 6 unq 0 iso 0 dist 9.93354 14.8942 7.74208 15.1795 7.46244 4.26359 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 6.86352 8.08867 9.5209 3.91563 7.48994 6.49199 numMergedOcc 0
2 mol 32 unq 1 iso 0 dist 8.5448 5.91961 9.5209 6.78305 7.48994 6.49199 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 7.77613 6.68767 9.4815 4.33564 6.887 10.4688 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 6.24764 12.3084 7.46478 10.6609 6.24296 7.2898 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 6.24764 12.3084 7.46478 11.2518 6.83218 4.13305 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 6.98104 11.6272 9.77482 7.44479 5.20001 6.95589 numMergedOcc 0
7 mol 117 unq 1 iso 0 dist 6.98104 11.7596 9.0428 7.44479 5.20001 13.3894 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 5.79433 5.76685 6.33375 13.9642 9.13631 11.3936 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 5.79433 6.60331 8.06229 13.9642 9.13631 13.7562 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 6.55143 9.94855 9.71611 6.82908 4.54218 6.8823 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 6.55143 5.29975 7.1093 6.82908 4.54218 4.22522 numMergedOcc 0
12 mol 141 unq 2 iso 0 dist 4.35548 5.29975 7.36421 6.82908 8.36316 4.22522 numMergedOcc 0
13 mol 141 unq 3 iso 0 dist 7.5024 6.38237 7.36421 10.0459 8.36316 4.22522 numMergedOcc 0
14 mol 146 unq 0 iso 0 dist 8.64781 11.995 6.66451 13.2008 6.76896 4.23789 numMergedOcc 0
15 mol 213 unq 0 iso 0 dist 8.22702 12.2431 8.6925 8.45746 9.27411 6.24057 numMergedOcc 0
16 mol 213 unq 1 iso 0 dist 8.22702 12.2431 8.6925 6.86914 5.81317 5.9858 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 8.08007 4.43794 7.40764 8.76165 9.79864 6.80416 numMergedOcc 0
