0 mol 18 unq 0 iso 0 dist 9.4649 8.81762 7.29441 6.91413 15.2258 11.6899 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 9.4649 5.32149 10.4194 6.91413 15.2258 5.53824 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 6.45965 8.81762 8.32004 6.91413 5.9929 11.6899 numMergedOcc 0
3 mol 18 unq 3 iso 0 dist 6.45965 5.32149 6.47139 6.91413 5.9929 5.53824 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.12062 8.36524 15.5673 8.8717 14.7325 14.0576 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 9.073 5.9651 5.71797 5.94459 12.7728 8.53692 numMergedOcc 0
6 mol 70 unq 0 iso 0 dist 9.2794 6.77833 5.51579 4.67358 10.1805 9.03317 numMergedOcc 0
7 mol 83 unq 0 iso 0 dist 9.31349 9.86416 5.66477 9.93908 9.75651 4.64184 numMergedOcc 0
8 mol 83 unq 1 iso 0 dist 7.61666 9.86416 4.09882 9.93908 6.60621 4.64184 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 7.32868 9.96446 9.29076 7.05954 6.3035 5.69731 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 7.32868 6.70686 4.39652 7.05954 6.3035 4.14907 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 6.26722 8.66715 12.7925 8.37793 9.32138 8.28698 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 6.26722 9.00172 12.7637 8.37793 9.32138 5.74088 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 8.49649 8.31276 15.5462 5.8367 4.02705 11.7434 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 8.49649 5.79157 6.36794 5.8367 4.02705 5.12325 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 8.49649 5.50687 5.73965 5.8367 4.02705 6.02179 numMergedOcc 0
16 mol 134 unq 3 iso 0 dist 8.49649 7.30919 11.0638 5.8367 4.02705 10.9332 numMergedOcc 0
17 mol 154 unq 0 iso 0 dist 9.71025 6.44195 5.88662 6.03116 11.9291 6.45768 numMergedOcc 0
18 mol 154 unq 1 iso 0 dist 9.71025 7.34207 12.461 6.03116 11.9291 6.55507 numMergedOcc 0
19 mol 167 unq 0 iso 0 dist 9.08229 7.9895 12.473 6.6276 6.2621 6.44546 numMergedOcc 0
20 mol 167 unq 1 iso 0 dist 9.08229 6.53913 5.48405 6.6276 6.2621 5.48292 numMergedOcc 0
21 mol 167 unq 2 iso 0 dist 7.99057 7.9895 8.28846 6.6276 6.17537 6.44546 numMergedOcc 0
22 mol 167 unq 3 iso 0 dist 7.99057 6.53913 10.8859 6.6276 6.17537 5.48292 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 6.22466 9.52413 11.7795 6.59729 7.41978 10.3944 numMergedOcc 0
24 mol 206 unq 0 iso 0 dist 8.90607 9.90891 14.4831 7.47477 8.679 12.7863 numMergedOcc 0
25 mol 209 unq 0 iso 0 dist 6.3344 5.92907 4.1329 9.95951 5.48319 5.96694 numMergedOcc 0
26 mol 209 unq 1 iso 0 dist 6.3344 5.92907 4.1329 6.43914 6.10304 4.90038 numMergedOcc 0
27 mol 233 unq 0 iso 0 dist 4.91191 6.48196 6.52848 7.07507 5.72267 8.2372 numMergedOcc 0
28 mol 248 unq 0 iso 0 dist 8.4908 7.40475 11.014 9.08064 11.3225 5.99459 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 9.45685 9.2067 11.716 8.43941 6.73942 5.27959 numMergedOcc 0
30 mol 258 unq 1 iso 0 dist 9.45685 9.16078 12.9218 8.43941 6.73942 8.25921 numMergedOcc 0
31 mol 261 unq 0 iso 0 dist 8.07113 9.80409 4.49913 5.67349 3.67304 6.04016 numMergedOcc 0
32 mol 278 unq 0 iso 0 dist 8.79625 9.91518 13.5373 9.06043 16.2355 6.54009 numMergedOcc 0
33 mol 278 unq 1 iso 0 dist 9.9609 9.91518 11.4765 9.06043 5.89139 6.54009 numMergedOcc 0
