0 mol 20 unq 0 iso 0 dist 9.21476 7.89368 7.68245 11.9329 6.51584 9.55686 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.84552 10.0962 7.18124 17.2313 14.4339 8.10168 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 7.75449 4.83638 9.13786 10.5022 7.07772 8.28218 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 7.85668 9.69493 9.86479 13.2004 7.24261 8.70827 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 8.96872 9.99421 8.87977 10.1106 3.94863 9.43843 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 8.72121 12.1308 6.69121 10.2819 4.05115 5.16779 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 9.56199 6.3119 7.02043 15.0048 6.75352 9.8911 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 9.87656 15.3246 7.78215 24.0211 15.2465 9.981 numMergedOcc 0
8 mol 152 unq 1 iso 0 dist 5.35463 9.74508 7.78215 16.6161 15.2465 9.981 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 8.9675 15.0962 9.82522 11.1859 5.46363 9.69903 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 9.49617 13.1148 8.42716 11.4912 5.97362 5.69652 numMergedOcc 0
11 mol 205 unq 1 iso 0 dist 9.15508 3.50159 8.42716 8.54088 5.97362 5.69652 numMergedOcc 0
12 mol 205 unq 2 iso 0 dist 8.54088 3.50159 5.69652 9.15508 5.97362 8.42716 numMergedOcc 0
13 mol 230 unq 0 iso 0 dist 7.5725 4.45276 8.89873 10.4583 7.09965 8.46558 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 7.7033 6.4179 5.3772 14.0432 11.653 8.70007 numMergedOcc 0
15 mol 261 unq 0 iso 0 dist 9.42131 9.44548 9.39727 7.01147 6.88668 7.8647 numMergedOcc 0
16 mol 261 unq 1 iso 0 dist 7.01147 9.44548 7.8647 9.42131 6.88668 9.39727 numMergedOcc 0
17 mol 261 unq 2 iso 0 dist 6.24373 4.93849 9.39727 8.69549 6.88668 7.8647 numMergedOcc 0
18 mol 261 unq 3 iso 0 dist 8.69549 4.93849 7.8647 6.24373 6.88668 9.39727 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 9.83528 5.01922 5.90121 12.8944 12.4866 9.90494 numMergedOcc 0
20 mol 283 unq 1 iso 0 dist 6.69313 14.4844 9.90494 18.4924 12.4866 5.90121 numMergedOcc 0
