0 mol 7 unq 0 iso 0 dist 9.25234 8.75465 6.89748 5.8785 8.83514 8.36111 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.25234 8.00249 3.67476 5.8785 8.83514 5.99898 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.25234 8.00249 3.67476 5.71606 7.18697 7.2834 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 6.31157 8.06584 6.18023 7.64554 9.36073 8.62771 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 5.64864 6.68114 5.03491 5.75907 9.49156 9.57919 numMergedOcc 0
5 mol 55 unq 1 iso 0 dist 8.93435 6.68114 11.1072 5.75907 12.6864 9.57919 numMergedOcc 0
6 mol 55 unq 2 iso 0 dist 4.74307 8.3736 5.03491 7.61589 9.49156 9.57919 numMergedOcc 0
7 mol 55 unq 3 iso 0 dist 6.36082 8.3736 11.1072 7.61589 12.6864 9.57919 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 6.74134 9.28726 9.4173 14.0065 16.8158 8.8326 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 7.7946 5.91797 4.54306 9.64715 3.90209 6.74197 numMergedOcc 0
10 mol 117 unq 0 iso 0 dist 4.79414 7.85205 7.44479 11.3792 13.4989 8.54233 numMergedOcc 0
11 mol 160 unq 0 iso 0 dist 8.67846 8.27864 12.789 14.004 20.601 9.78028 numMergedOcc 0
12 mol 160 unq 1 iso 0 dist 9.45291 8.27864 5.18035 14.004 13.2195 9.78028 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 5.97162 9.00537 6.7954 13.8548 10.3738 7.12029 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 9.54728 8.13526 13.6358 10.4034 18.6992 6.66653 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 8.15146 9.41353 12.485 5.68697 12.357 6.72624 numMergedOcc 0
16 mol 217 unq 1 iso 0 dist 8.15146 8.28155 14.7613 5.68697 12.357 4.92885 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 9.91899 9.77592 3.73109 10.3403 8.77271 6.0567 numMergedOcc 0
18 mol 243 unq 0 iso 0 dist 9.7462 5.78671 12.614 5.85313 15.3657 8.48003 numMergedOcc 0
19 mol 243 unq 1 iso 0 dist 9.7462 5.46817 14.1275 5.85313 15.3657 5.54003 numMergedOcc 0
