0 mol 1 unq 0 iso 0 dist 6.82022 8.395 8.59108 10.8776 7.68779 15.7528 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 5.90559 6.62911 8.6173 4.9861 8.59022 11.5632 numMergedOcc 0
2 mol 44 unq 1 iso 0 dist 6.93541 6.62911 9.94707 4.9861 8.54284 11.5632 numMergedOcc 0
3 mol 44 unq 2 iso 0 dist 9.55067 8.60575 4.66466 16.5476 8.54284 12.8069 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.46683 5.47819 7.75261 5.01578 8.24879 10.052 numMergedOcc 0
5 mol 132 unq 0 iso 0 dist 8.49299 6.71787 9.07803 13.8837 9.0339 12.625 numMergedOcc 0
6 mol 132 unq 1 iso 0 dist 8.49299 6.71787 9.07803 14.8844 8.48641 14.9674 numMergedOcc 0
7 mol 132 unq 2 iso 0 dist 8.49299 6.71787 9.07803 8.02299 6.23573 12.4587 numMergedOcc 0
8 mol 136 unq 0 iso 0 dist 9.44126 7.827 6.29723 10.7369 6.53519 11.8469 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 5.77564 8.39237 7.19462 5.48717 8.03567 10.7663 numMergedOcc 0
10 mol 192 unq 0 iso 0 dist 8.64985 5.91901 4.64973 14.2151 9.05666 13.125 numMergedOcc 0
11 mol 198 unq 0 iso 0 dist 8.80787 5.42463 9.58202 14.9605 9.4363 18.0204 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 8.04498 9.92924 13.46 4.65392 7.92766 9.44947 numMergedOcc 0
13 mol 204 unq 1 iso 0 dist 8.04498 9.92924 13.46 11.0965 6.32652 18.8751 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 9.95776 6.92032 12.8125 5.02064 7.14277 10.6624 numMergedOcc 0
15 mol 271 unq 0 iso 0 dist 8.25189 8.56431 11.3948 14.0548 9.04738 13.0634 numMergedOcc 0
16 mol 271 unq 1 iso 0 dist 8.25189 8.56431 11.3948 9.14741 8.68046 13.8251 numMergedOcc 0
17 mol 271 unq 2 iso 0 dist 8.25189 8.56431 11.3948 11.3554 5.98336 16.3236 numMergedOcc 0
18 mol 271 unq 3 iso 0 dist 8.25189 8.56431 11.3948 5.46826 9.67453 13.9532 numMergedOcc 0
19 mol 276 unq 0 iso 0 dist 5.39708 7.64844 6.40983 5.58984 7.11272 11.5159 numMergedOcc 0
20 mol 276 unq 1 iso 0 dist 5.39708 7.64844 6.40983 5.82952 6.24808 10.1908 numMergedOcc 0
