0 mol 5 unq 0 iso 0 dist 8.25372 10.7254 7.44029 16.0058 12.2037 9.13041 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.25372 10.7254 7.44029 17.9602 10.5084 9.43038 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 7.36963 6.41686 6.50444 7.47015 3.92592 8.44864 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 7.39124 6.57152 8.55202 10.6191 4.07933 9.27409 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 5.15951 4.3613 6.67635 6.65318 7.60413 8.48774 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 6.53198 8.97892 6.12348 9.07597 3.84573 5.37302 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 6.53198 5.45975 7.2672 9.07597 3.84573 8.47541 numMergedOcc 0
7 mol 116 unq 0 iso 0 dist 8.59846 9.33983 9.87191 10.0267 3.82942 7.6005 numMergedOcc 0
8 mol 116 unq 1 iso 0 dist 8.59846 5.16799 9.21528 10.0267 3.82942 8.7583 numMergedOcc 0
9 mol 116 unq 2 iso 0 dist 9.6001 13.5296 9.87191 10.5172 3.82942 7.6005 numMergedOcc 0
10 mol 116 unq 3 iso 0 dist 9.6001 11.9052 9.21528 10.5172 3.82942 8.7583 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 6.31404 9.27523 5.56446 15.4091 9.84473 7.6793 numMergedOcc 0
12 mol 146 unq 0 iso 0 dist 8.82192 3.96561 6.93154 6.28491 8.9669 7.13378 numMergedOcc 0
13 mol 168 unq 0 iso 0 dist 8.65328 9.52243 9.23064 8.80059 12.6805 8.90876 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 6.4644 8.878 6.27683 9.25217 3.95773 5.51388 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 6.4644 5.51046 7.1757 9.25217 3.95773 8.68909 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 5.98495 7.0159 6.76574 6.08141 4.88147 6.21194 numMergedOcc 0
17 mol 206 unq 0 iso 0 dist 8.91548 9.64485 8.79378 12.0107 5.70985 8.15381 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 9.48525 13.2026 9.49163 13.4401 5.8463 8.37379 numMergedOcc 0
