0 mol 10 unq 0 iso 0 dist 8.44864 8.55472 5.66059 5.94361 5.59965 6.77258 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.17217 5.36736 9.7004 4.29919 6.56527 6.81961 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 9.45566 9.70501 5.81645 4.83412 7.48846 5.51351 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 4.38047 12.1383 9.20373 10.5895 9.17082 17.3249 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 7.07989 7.11791 8.67118 8.57904 6.74766 9.54097 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 9.77272 10.2318 8.67118 4.05011 6.74766 9.54097 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 7.7913 13.8441 6.48163 11.9687 6.77241 5.60494 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 7.7913 13.8441 6.48163 12.841 5.50508 4.76916 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 5.94696 4.67787 8.48678 9.51607 7.36769 8.83348 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 5.94696 4.67787 8.48678 12.5752 6.88901 14.016 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 6.09626 4.59061 7.03339 6.43704 7.80873 5.54999 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 8.4733 9.90172 8.05937 5.73999 7.20249 7.21894 numMergedOcc 0
12 mol 184 unq 0 iso 0 dist 8.95598 11.2463 6.65725 12.4352 7.54099 4.84884 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 7.58256 9.4381 8.09667 5.98598 6.21159 5.96605 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 7.04477 12.8829 6.82883 11.378 5.70795 4.97624 numMergedOcc 0
15 mol 226 unq 1 iso 0 dist 7.04477 14.6433 8.22518 11.378 5.70795 5.55393 numMergedOcc 0
16 mol 226 unq 2 iso 0 dist 7.04477 7.06868 6.02803 11.378 5.70795 9.35407 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 9.41148 5.18593 6.71099 6.36084 9.78181 7.46856 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 7.26887 11.7437 8.52162 6.5335 5.92374 6.32646 numMergedOcc 0
19 mol 244 unq 0 iso 0 dist 8.08939 8.71894 5.60146 8.89726 7.95359 6.44798 numMergedOcc 0
20 mol 244 unq 1 iso 0 dist 8.08939 8.71894 5.60146 10.6799 6.22122 11.4169 numMergedOcc 0
21 mol 244 unq 2 iso 0 dist 8.08939 5.36127 9.80249 8.89726 7.95359 13.543 numMergedOcc 0
22 mol 244 unq 3 iso 0 dist 8.08939 5.36127 9.80249 10.6799 6.22122 12.7037 numMergedOcc 0
23 mol 244 unq 4 iso 0 dist 7.33574 8.52699 5.60146 4.55034 7.95359 6.44798 numMergedOcc 0
24 mol 244 unq 5 iso 0 dist 7.33574 8.52699 5.60146 8.05133 6.22122 11.4169 numMergedOcc 0
25 mol 244 unq 6 iso 0 dist 7.33574 11.2736 9.80249 4.55034 7.95359 13.543 numMergedOcc 0
26 mol 244 unq 7 iso 0 dist 7.33574 11.2736 9.80249 8.05133 6.22122 12.7037 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 8.42076 9.43796 8.53802 5.89772 6.95912 9.52438 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 8.42076 9.43796 8.53802 5.89772 6.95912 9.52438 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 8.42076 9.43796 8.53802 5.89772 6.95912 9.52438 numMergedOcc 0
30 mol 292 unq 0 iso 0 dist 6.68863 4.41308 9.55425 10.8497 8.25485 11.7492 numMergedOcc 0
