0 mol 48 unq 0 iso 0 dist 8.80334 14.2257 7.34031 15.7674 7.13338 6.28603 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 8.80334 14.2257 7.34031 16.3703 8.64653 8.80303 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 8.80334 14.2257 7.34031 8.26877 4.28224 7.11491 numMergedOcc 0
3 mol 48 unq 3 iso 0 dist 8.45484 13.7393 7.281 15.2873 7.08546 5.73454 numMergedOcc 0
4 mol 48 unq 4 iso 0 dist 8.45484 13.7393 7.281 16.0126 8.61607 8.2012 numMergedOcc 0
5 mol 48 unq 5 iso 0 dist 8.45484 13.7393 7.281 7.49794 4.12075 7.1829 numMergedOcc 0
6 mol 61 unq 0 iso 0 dist 9.46217 9.89377 7.46994 17.3131 10.3452 9.83914 numMergedOcc 0
7 mol 87 unq 0 iso 0 dist 7.2668 6.57984 8.31175 6.21471 3.63275 9.41934 numMergedOcc 0
8 mol 128 unq 0 iso 0 dist 9.11128 13.0031 6.98158 18.9733 10.624 7.4442 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 8.22353 11.6598 9.30424 9.99012 4.19541 7.2932 numMergedOcc 0
10 mol 143 unq 1 iso 0 dist 8.57285 8.28318 9.30424 5.33772 4.19541 7.2932 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 7.77669 10.3139 6.26365 8.06007 3.63393 4.51777 numMergedOcc 0
12 mol 175 unq 1 iso 0 dist 7.77669 7.04147 7.04177 8.06007 3.63393 4.9606 numMergedOcc 0
13 mol 254 unq 0 iso 0 dist 9.84153 10.7426 8.94909 11.3743 5.67608 9.50951 numMergedOcc 0
14 mol 273 unq 0 iso 0 dist 6.59786 7.10817 8.68913 13.5584 9.83412 9.81919 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 8.40198 8.32567 5.59555 14.6295 8.99193 9.25759 numMergedOcc 0
16 mol 287 unq 1 iso 0 dist 9.11967 7.04567 5.59555 16.0429 8.99193 9.25759 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 8.40198 8.32567 5.59555 14.6295 8.99193 9.25759 numMergedOcc 0
18 mol 288 unq 1 iso 0 dist 9.11967 7.04567 5.59555 16.0429 8.99193 9.25759 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 8.40198 8.32567 5.59555 14.6295 8.99193 9.25759 numMergedOcc 0
20 mol 289 unq 1 iso 0 dist 9.11967 7.04567 5.59555 16.0429 8.99193 9.25759 numMergedOcc 0
