0 mol 4 unq 0 iso 0 dist 9.31285 8.60134 14.3737 4.54643 13.0335 5.51567 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 8.66947 8.60134 11.1776 4.54643 10.4453 5.51567 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 7.48808 7.01513 7.08873 7.42713 12.7952 9.39923 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.36524 6.47252 13.4762 6.00825 14.2228 5.55479 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.72872 7.72041 4.02037 5.95619 10.9482 9.63348 numMergedOcc 0
5 mol 55 unq 0 iso 0 dist 6.81152 8.3736 9.9157 7.61589 13.9737 9.57919 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 5.84326 7.07124 6.15355 6.3873 9.77018 5.91948 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 9.43143 9.73435 4.03844 8.83086 6.68311 9.26417 numMergedOcc 0
8 mol 72 unq 1 iso 0 dist 5.48831 9.20886 7.07356 5.50284 6.7212 5.49421 numMergedOcc 0
9 mol 72 unq 2 iso 0 dist 9.39178 9.20886 5.84044 5.50284 9.08821 5.49421 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 8.84131 9.16431 7.75097 5.89461 12.1389 8.24949 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 6.44195 8.59532 4.55687 9.05948 8.34737 6.91511 numMergedOcc 0
12 mol 154 unq 1 iso 0 dist 7.34207 8.59532 13.5599 9.05948 15.0423 6.91511 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.52413 8.9388 15.4336 12.2795 18.6562 7.12029 numMergedOcc 0
14 mol 217 unq 0 iso 0 dist 7.58097 9.41353 13.1665 5.68697 12.6976 6.72624 numMergedOcc 0
15 mol 217 unq 1 iso 0 dist 7.58097 8.28155 13.7271 5.68697 12.6976 4.92885 numMergedOcc 0
16 mol 229 unq 0 iso 0 dist 6.32302 6.92268 4.17276 5.75801 8.8557 8.3932 numMergedOcc 0
17 mol 229 unq 1 iso 0 dist 6.88694 6.92268 4.92403 5.75801 5.00457 8.3932 numMergedOcc 0
18 mol 232 unq 0 iso 0 dist 7.57253 8.1692 5.42461 4.97762 9.95045 7.53576 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 6.44657 7.12723 10.8644 14.0493 13.4993 9.26793 numMergedOcc 0
