0 mol 9 unq 0 iso 0 dist 7.25179 8.90391 9.62394 13.4599 11.3797 9.8978 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.25179 8.90391 9.62394 11.3949 11.7623 6.26276 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.72522 12.2488 9.62394 12.6785 11.3797 9.8978 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 8.72522 12.2488 9.62394 12.0424 11.7623 6.26276 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 6.00307 9.60684 7.92503 9.59327 5.59268 7.05148 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 6.56664 6.71938 7.56205 7.92027 4.47138 8.2746 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 9.58156 6.71938 4.74544 7.92027 10.9596 8.2746 numMergedOcc 0
7 mol 62 unq 2 iso 0 dist 7.99003 5.31715 7.56205 6.08756 4.47138 8.2746 numMergedOcc 0
8 mol 62 unq 3 iso 0 dist 9.96382 6.76473 7.56205 12.3861 4.47138 8.2746 numMergedOcc 0
9 mol 62 unq 4 iso 0 dist 7.59416 6.76473 4.74544 12.3861 10.9596 8.2746 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 8.00525 5.75219 9.30539 7.62621 10.2967 5.51406 numMergedOcc 0
11 mol 95 unq 0 iso 0 dist 8.13273 15.7943 9.49454 13.1868 5.69671 9.49995 numMergedOcc 0
12 mol 113 unq 0 iso 0 dist 8.29529 5.89952 8.8822 13.4674 16.3524 9.66068 numMergedOcc 0
13 mol 113 unq 1 iso 0 dist 8.29529 5.58964 9.66219 8.28452 14.0364 5.37302 numMergedOcc 0
14 mol 113 unq 2 iso 0 dist 8.29529 5.58964 9.66219 13.4674 16.3524 8.03783 numMergedOcc 0
15 mol 113 unq 3 iso 0 dist 8.29529 5.58964 9.66219 13.3163 12.1308 8.47541 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 6.53153 5.42142 9.97654 11.0898 10.0114 8.6561 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 6.29975 5.42142 6.66772 11.0898 7.36833 8.6561 numMergedOcc 0
18 mol 133 unq 2 iso 0 dist 8.29673 5.42142 7.71248 11.0898 5.27217 8.6561 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 9.50454 6.15536 5.9176 8.94464 9.32503 9.07527 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 7.15963 10.5886 8.90963 13.6065 9.47799 5.66363 numMergedOcc 0
21 mol 181 unq 2 iso 0 dist 7.15963 10.5886 8.90963 11.4115 9.09989 5.97968 numMergedOcc 0
22 mol 181 unq 3 iso 0 dist 7.15963 10.5886 8.90963 10.6505 12.4243 8.50382 numMergedOcc 0
23 mol 181 unq 4 iso 0 dist 7.15963 10.5886 8.90963 8.63713 4.98009 8.63119 numMergedOcc 0
24 mol 181 unq 5 iso 0 dist 8.80581 10.5065 5.9176 17.7828 9.32503 9.07527 numMergedOcc 0
25 mol 197 unq 0 iso 0 dist 9.14737 14.372 7.50013 11.8525 4.57437 8.98598 numMergedOcc 0
26 mol 197 unq 1 iso 0 dist 9.14737 14.6749 5.81233 11.8525 4.57437 7.06689 numMergedOcc 0
27 mol 197 unq 2 iso 0 dist 9.14737 5.9589 6.92924 7.91999 5.29309 7.40027 numMergedOcc 0
28 mol 197 unq 3 iso 0 dist 9.14737 5.9589 6.92924 11.8525 4.57437 9.69601 numMergedOcc 0
29 mol 204 unq 0 iso 0 dist 6.20646 11.1093 9.68728 19.0956 18.2283 8.62191 numMergedOcc 0
30 mol 204 unq 1 iso 0 dist 6.73266 5.39256 9.68728 12.6619 18.2283 8.62191 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 6.51823 12.1252 8.67864 14.0822 10.9854 7.26887 numMergedOcc 0
