0 mol 5 unq 0 iso 0 dist 7.8351 9.12986 6.45374 9.59917 7.95876 10.1441 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.87895 9.58718 6.39013 6.87351 8.87744 8.10694 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 5.87895 9.58718 6.39013 7.79018 7.27472 6.63216 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 5.87895 9.31263 8.94148 6.87351 8.87744 9.39956 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 5.87895 9.31263 8.94148 7.79018 7.27472 10.2808 numMergedOcc 0
5 mol 30 unq 0 iso 0 dist 8.37503 7.75449 9.86672 10.5203 6.74179 15.3504 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 6.87176 8.02624 13.8724 8.41932 7.39665 11.4648 numMergedOcc 0
7 mol 68 unq 1 iso 0 dist 6.87176 9.63119 15.9935 8.41932 7.39665 13.262 numMergedOcc 0
8 mol 68 unq 2 iso 0 dist 6.87176 7.12992 10.0669 8.41932 7.39665 9.68196 numMergedOcc 0
9 mol 68 unq 3 iso 0 dist 7.45675 8.02624 13.5622 11.3486 6.17207 16.0737 numMergedOcc 0
10 mol 68 unq 4 iso 0 dist 7.45675 9.63119 12.8986 11.3486 6.17207 14.7335 numMergedOcc 0
11 mol 68 unq 5 iso 0 dist 7.45675 7.12992 3.78133 11.3486 6.17207 9.33549 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 5.79954 7.55565 8.00278 11.5216 9.73086 8.95637 numMergedOcc 0
13 mol 78 unq 0 iso 0 dist 9.99029 7.85668 5.40759 14.4224 6.85523 10.5655 numMergedOcc 0
14 mol 78 unq 1 iso 0 dist 9.99029 7.85668 5.40759 14.5688 5.77326 10.9538 numMergedOcc 0
15 mol 127 unq 0 iso 0 dist 8.62711 7.34368 12.4721 9.74982 6.08673 15.8154 numMergedOcc 0
16 mol 132 unq 0 iso 0 dist 6.495 9.77766 15.0415 7.05332 6.89918 12.7199 numMergedOcc 0
17 mol 132 unq 1 iso 0 dist 6.495 9.11314 13.8574 7.05332 6.89918 13.4908 numMergedOcc 0
18 mol 132 unq 2 iso 0 dist 9.43748 9.77766 15.784 7.05332 7.89457 12.7199 numMergedOcc 0
19 mol 132 unq 3 iso 0 dist 9.43748 9.11314 14.5559 7.05332 7.89457 13.4908 numMergedOcc 0
20 mol 154 unq 0 iso 0 dist 9.04554 8.9675 9.20471 5.93188 8.33439 13.197 numMergedOcc 0
21 mol 162 unq 0 iso 0 dist 9.42819 9.98649 16.1113 8.39434 7.37333 17.1387 numMergedOcc 0
22 mol 162 unq 1 iso 0 dist 9.42819 9.98649 16.1113 4.92282 7.45998 13.4244 numMergedOcc 0
23 mol 170 unq 0 iso 0 dist 7.15418 7.4819 4.06625 10.4801 9.08274 12.542 numMergedOcc 0
24 mol 180 unq 0 iso 0 dist 7.08676 8.16047 6.26263 5.83274 8.82325 12.1881 numMergedOcc 0
25 mol 182 unq 0 iso 0 dist 9.36307 9.96156 3.8657 5.62883 9.56028 12.0026 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 9.27989 7.55125 11.1638 3.28983 6.73665 9.24224 numMergedOcc 0
27 mol 250 unq 0 iso 0 dist 8.21206 9.2861 12.4477 5.16962 6.59244 13.7377 numMergedOcc 0
28 mol 284 unq 0 iso 0 dist 7.34344 8.45942 15.2862 12.1528 5.83329 19.5185 numMergedOcc 0
