0 mol 12 unq 0 iso 0 dist 9.41745 8.79013 8.10227 4.13477 7.8865 9.79847 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.61029 7.54282 7.11305 7.53125 9.7522 9.90986 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 8.28463 9.21811 9.11842 8.69745 10.9434 6.56549 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 7.16036 6.86391 6.16718 11.0716 9.96265 7.61923 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 7.16036 6.86391 6.16718 7.93542 9.70459 5.11941 numMergedOcc 0
5 mol 44 unq 2 iso 0 dist 7.16036 6.86391 6.16718 4.61354 7.78905 5.84744 numMergedOcc 0
6 mol 44 unq 3 iso 0 dist 7.16036 6.86391 6.16718 6.95649 12.0965 7.7864 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 9.31319 4.61355 10.9054 11.6888 16.2666 7.57749 numMergedOcc 0
8 mol 46 unq 1 iso 0 dist 9.31319 4.61355 10.9054 5.79552 14.405 8.55202 numMergedOcc 0
9 mol 46 unq 2 iso 0 dist 8.2513 4.61355 12.3186 11.6888 18.7332 7.57749 numMergedOcc 0
10 mol 46 unq 3 iso 0 dist 8.2513 4.61355 12.3186 5.79552 11.2009 8.55202 numMergedOcc 0
11 mol 81 unq 0 iso 0 dist 8.93196 7.062 7.50394 4.79903 12.7796 8.38883 numMergedOcc 0
12 mol 148 unq 0 iso 0 dist 8.62898 6.02506 9.29878 3.9163 12.0995 7.55497 numMergedOcc 0
13 mol 148 unq 1 iso 0 dist 9.7168 9.8506 15.239 11.6478 20.2224 7.55497 numMergedOcc 0
14 mol 148 unq 2 iso 0 dist 7.38138 9.8506 8.68046 11.6478 14.2747 7.55497 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 8.6102 6.07854 9.35505 3.9243 12.1518 7.62236 numMergedOcc 0
16 mol 150 unq 1 iso 0 dist 9.61132 9.91991 15.2388 11.5974 20.1182 7.62236 numMergedOcc 0
17 mol 150 unq 2 iso 0 dist 7.34423 9.91991 8.55576 11.5974 14.1444 7.62236 numMergedOcc 0
18 mol 178 unq 0 iso 0 dist 6.01118 8.74572 10.8974 14.1762 18.6643 9.42866 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.29203 9.97859 16.7443 6.89134 15.9232 6.96382 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 7.62771 9.97859 13.1408 6.89134 13.609 6.96382 numMergedOcc 0
21 mol 238 unq 2 iso 0 dist 7.80166 9.97859 10.4706 6.89134 10.2894 6.96382 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 6.8133 6.98961 5.50627 9.57206 5.75596 9.7061 numMergedOcc 0
