0 mol 17 unq 0 iso 0 dist 9.55169 10.6611 8.48453 11.1103 9.78331 12.9838 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 6.34277 8.65185 7.0928 6.14367 8.87757 11.7801 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 9.40763 6.94361 7.0928 8.83211 8.87757 11.7801 numMergedOcc 0
3 mol 52 unq 0 iso 0 dist 8.52979 4.25393 7.47417 14.261 6.31696 11.8458 numMergedOcc 0
4 mol 52 unq 1 iso 0 dist 8.52979 9.28685 7.68916 14.261 6.31696 9.04053 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 6.97244 10.7198 8.76613 6.85703 7.70232 5.45718 numMergedOcc 0
6 mol 117 unq 1 iso 0 dist 6.97244 10.7198 8.76613 9.39186 7.4671 6.25846 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 8.5778 5.11778 6.99089 6.89623 7.80532 10.0674 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 9.03233 6.47184 6.7319 10.7405 6.6554 8.10288 numMergedOcc 0
9 mol 176 unq 0 iso 0 dist 9.84636 6.38251 4.96326 6.84084 7.33273 5.19351 numMergedOcc 0
10 mol 176 unq 1 iso 0 dist 9.84636 11.9231 9.09976 6.84084 7.33273 7.10221 numMergedOcc 0
11 mol 176 unq 2 iso 0 dist 9.84636 11.3704 9.73567 6.84084 7.33273 10.2245 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 6.32172 9.96767 6.31492 5.00423 6.73956 7.00671 numMergedOcc 0
13 mol 182 unq 1 iso 0 dist 6.32172 9.96767 6.31492 5.41536 7.09394 11.1247 numMergedOcc 0
14 mol 182 unq 2 iso 0 dist 6.32172 10.2412 7.8621 5.00423 6.73956 9.23913 numMergedOcc 0
15 mol 182 unq 3 iso 0 dist 6.32172 10.2412 7.8621 5.41536 7.09394 5.77163 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 9.65951 9.46843 7.92766 16.909 9.68728 15.254 numMergedOcc 0
17 mol 204 unq 1 iso 0 dist 9.14829 14.3686 7.92766 14.2441 9.68728 15.254 numMergedOcc 0
18 mol 249 unq 0 iso 0 dist 9.14351 4.20982 6.42827 5.56847 5.48118 5.74889 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 9.80417 5.27451 7.22378 5.62207 7.21311 4.39424 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 9.89728 16.8784 9.47382 13.5186 7.08526 10.451 numMergedOcc 0
21 mol 292 unq 0 iso 0 dist 7.29148 4.70797 6.8133 6.48749 7.83341 7.95758 numMergedOcc 0
22 mol 292 unq 1 iso 0 dist 6.87804 5.50967 5.69465 13.9059 7.07965 11.7781 numMergedOcc 0
23 mol 292 unq 2 iso 0 dist 6.07571 11.1934 5.69465 4.59906 7.07965 11.7781 numMergedOcc 0
