0 mol 18 unq 0 iso 0 dist 9.4649 8.95573 10.3579 6.91413 15.2258 11.2059 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.45965 8.95573 5.867 6.91413 5.9929 11.2059 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.90242 5.97065 5.88467 8.8533 7.29236 4.80984 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 9.07029 5.97065 6.66387 8.8533 6.29311 4.80984 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.12062 5.73257 10.7494 8.8717 14.7325 8.15141 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 6.35249 6.21143 5.27577 6.22124 9.90457 5.99852 numMergedOcc 0
6 mol 70 unq 0 iso 0 dist 9.2794 8.06918 11.9871 4.67358 10.1805 11.6542 numMergedOcc 0
7 mol 70 unq 1 iso 0 dist 9.2794 7.52623 9.5704 4.67358 10.1805 11.7156 numMergedOcc 0
8 mol 70 unq 2 iso 0 dist 9.2794 5.62294 10.9277 4.67358 10.1805 4.95817 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 7.32868 9.62702 4.47011 7.05954 6.3035 6.39495 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 7.32868 6.97484 11.9916 7.05954 6.3035 8.23539 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 6.26722 4.95674 4.49984 8.37793 9.32138 7.68389 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 8.49649 5.98435 11.5532 5.8367 4.02705 8.05714 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 8.49649 8.80672 14.5276 5.8367 4.02705 13.6926 numMergedOcc 0
14 mol 154 unq 0 iso 0 dist 9.71025 5.81632 6.28784 6.03116 11.9291 8.33921 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 9.08229 9.4422 10.9873 6.6276 6.2621 7.04972 numMergedOcc 0
16 mol 167 unq 1 iso 0 dist 7.99057 9.4422 12.2296 6.6276 6.17537 7.04972 numMergedOcc 0
17 mol 195 unq 0 iso 0 dist 8.51112 8.64561 5.86183 8.22643 6.90444 5.15519 numMergedOcc 0
18 mol 209 unq 0 iso 0 dist 6.3344 5.20111 4.45815 9.95951 5.48319 9.89528 numMergedOcc 0
19 mol 209 unq 1 iso 0 dist 6.3344 5.20111 4.45815 6.43914 6.10304 9.02883 numMergedOcc 0
20 mol 226 unq 0 iso 0 dist 6.67272 9.51038 4.91346 6.06276 6.53326 11.3192 numMergedOcc 0
21 mol 226 unq 1 iso 0 dist 9.45332 9.51038 11.4807 6.06276 4.92768 11.3192 numMergedOcc 0
22 mol 233 unq 0 iso 0 dist 4.91191 7.99897 5.3674 7.07507 5.72267 11.0789 numMergedOcc 0
23 mol 247 unq 0 iso 0 dist 6.35578 6.34304 4.32191 9.27226 7.868 6.46689 numMergedOcc 0
24 mol 248 unq 0 iso 0 dist 8.4908 7.96942 8.23532 9.08064 11.3225 6.53154 numMergedOcc 0
25 mol 260 unq 0 iso 0 dist 7.90537 9.50619 5.51525 8.2776 8.0809 5.32038 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 6.38338 8.70062 4.26276 6.89742 5.43917 9.62906 numMergedOcc 0
27 mol 287 unq 1 iso 0 dist 6.38338 9.919 9.92609 6.89742 5.43917 6.09112 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 6.38338 8.70062 4.26276 6.89742 5.43917 9.62906 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 6.38338 9.919 9.92609 6.89742 5.43917 6.09112 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 6.38338 8.70062 4.26276 6.89742 5.43917 9.62906 numMergedOcc 0
31 mol 289 unq 1 iso 0 dist 6.38338 9.919 9.92609 6.89742 5.43917 6.09112 numMergedOcc 0
