0 mol 18 unq 0 iso 0 dist 8.51213 5.03976 7.04695 10.2716 6.39243 8.95294 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 8.51213 5.03976 7.04695 10.3407 9.1715 7.19022 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 9.02927 7.41523 5.0364 10.1432 8.52313 9.98411 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 6.31203 9.25984 4.88519 5.50714 8.44515 12.2857 numMergedOcc 0
4 mol 90 unq 1 iso 0 dist 6.31203 9.25984 4.88519 6.63665 9.41382 11.7653 numMergedOcc 0
5 mol 111 unq 0 iso 0 dist 7.42431 9.02541 7.59143 9.73916 9.04546 15.587 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 9.60425 9.77482 11.3679 6.63536 8.81172 11.3437 numMergedOcc 0
7 mol 117 unq 1 iso 0 dist 9.60425 9.0428 15.2823 6.63536 8.81172 11.7168 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 6.32178 6.77398 8.47569 5.58691 6.54987 11.4135 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 6.32178 5.68207 5.99395 5.58691 6.54987 9.45709 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 7.2977 6.33375 10.7186 5.35536 6.54987 10.6753 numMergedOcc 0
11 mol 134 unq 3 iso 0 dist 7.2977 8.06229 8.47569 5.35536 6.54987 11.4135 numMergedOcc 0
12 mol 140 unq 0 iso 0 dist 6.40792 7.59889 4.90549 6.09043 7.83582 6.29125 numMergedOcc 0
13 mol 174 unq 0 iso 0 dist 6.90813 8.79469 8.37744 10.67 6.04817 14.169 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 6.04106 9.70674 6.23291 5.60686 6.15806 7.70781 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 8.69345 5.68415 5.20486 5.66783 6.94113 7.88151 numMergedOcc 0
