0 mol 16 unq 0 iso 0 dist 6.32791 5.28404 4.7319 11.1182 7.65889 6.86055 15.6671 10.2656 11.0958 6.42835 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.46842 13.3513 7.57578 16.8735 9.48085 5.18617 17.4161 10.9391 12.7009 9.49421 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 8.46842 14.4516 7.17969 16.8735 9.48085 5.68041 17.4161 10.9391 12.8117 9.49421 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 7.09258 10.0936 9.78528 7.54321 6.21799 7.47371 13.6285 7.04035 10.8086 9.74228 numMergedOcc 0
4 mol 72 unq 1 iso 0 dist 7.09258 10.0936 9.78528 7.54321 6.21799 7.47371 13.592 8.24309 9.96708 7.12321 numMergedOcc 0
5 mol 72 unq 2 iso 0 dist 7.09258 10.0936 9.78528 5.2819 5.03251 9.67587 12.0429 5.8486 15.1902 9.56773 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 9.13413 9.79513 7.71338 11.7536 8.47988 6.95317 11.6374 4.8896 11.5121 9.02706 numMergedOcc 0
7 mol 112 unq 1 iso 0 dist 9.13413 9.79513 7.71338 5.8662 8.0427 7.57713 11.6374 4.8896 11.5121 9.39168 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 9.45717 4.28997 6.82262 5.815 9.05342 4.88025 11.7225 5.61668 8.22656 8.26547 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 5.47189 5.48717 7.54065 6.7954 6.61112 11.0961 11.0456 7.09479 14.4482 8.90571 numMergedOcc 0
10 mol 229 unq 0 iso 0 dist 9.68636 10.705 8.22528 9.76444 7.27993 5.70473 14.4454 5.1556 11.3979 9.51168 numMergedOcc 0
11 mol 229 unq 1 iso 0 dist 9.68636 10.705 8.22528 9.76444 7.27993 5.70473 11.9461 7.0298 11.7165 6.95201 numMergedOcc 0
12 mol 229 unq 2 iso 0 dist 9.68636 5.6419 7.03423 9.76444 7.27993 7.22525 14.4454 5.1556 11.9282 9.51168 numMergedOcc 0
13 mol 229 unq 3 iso 0 dist 9.68636 5.6419 7.03423 9.76444 7.27993 7.22525 11.9461 7.0298 11.4362 6.95201 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 7.17987 14.7629 9.45496 12.4759 7.81215 12.4252 12.6184 10.2693 17.458 5.64285 numMergedOcc 0
15 mol 234 unq 1 iso 0 dist 7.17987 13.5847 6.7625 12.4759 7.81215 5.75498 12.6184 10.2693 10.701 5.64285 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 9.09166 6.74773 6.22714 17.7087 9.08509 12.7938 17.3543 10.1813 11.0896 6.99888 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 9.09166 9.48707 7.31233 17.7087 9.08509 11.0772 17.3543 10.1813 11.5794 6.99888 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 9.89728 5.07898 7.46176 13.7396 5.85442 10.067 14.0886 9.98105 12.0576 6.9899 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 9.89728 5.07898 7.46176 15.7491 6.95511 11.6988 11.1914 6.96053 7.88519 9.46361 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 6.20796 6.9758 9.17653 4.66338 8.29262 10.7813 8.43682 4.92077 13.4025 9.19754 numMergedOcc 0
21 mol 264 unq 1 iso 0 dist 7.73693 5.00433 9.17653 10.3972 8.29262 10.7813 10.6405 4.92077 13.4025 9.19754 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 6.86014 4.83355 9.7748 14.6762 8.9682 17.6038 18.2066 11.8268 21.4606 9.57499 numMergedOcc 0
23 mol 277 unq 1 iso 0 dist 6.86014 4.83355 9.7748 14.6762 8.9682 17.6038 12.4435 7.08227 16.3537 5.46926 numMergedOcc 0
24 mol 277 unq 2 iso 0 dist 6.86014 4.83355 9.7748 11.68 6.92711 14.772 12.4435 7.08227 16.3537 5.13913 numMergedOcc 0
25 mol 277 unq 3 iso 0 dist 5.97073 11.2857 9.7748 11.3103 8.9682 17.6038 12.8364 11.8268 21.4606 9.57499 numMergedOcc 0
26 mol 277 unq 4 iso 0 dist 5.97073 11.2857 9.7748 11.3103 8.9682 17.6038 11.2713 7.08227 16.3537 5.46926 numMergedOcc 0
27 mol 277 unq 5 iso 0 dist 5.97073 11.2857 9.7748 10.5734 6.92711 14.772 11.2713 7.08227 16.3537 5.13913 numMergedOcc 0
28 mol 277 unq 6 iso 0 dist 6.49176 14.4976 9.7748 6.40883 8.9682 17.6038 10.0577 11.8268 21.4606 9.57499 numMergedOcc 0
29 mol 277 unq 7 iso 0 dist 6.49176 14.4976 9.7748 6.40883 8.9682 17.6038 8.23147 7.08227 16.3537 5.46926 numMergedOcc 0
30 mol 277 unq 8 iso 0 dist 6.49176 14.4976 9.7748 6.79352 6.92711 14.772 8.23147 7.08227 16.3537 5.13913 numMergedOcc 0
31 mol 292 unq 0 iso 0 dist 6.87804 11.634 8.2734 6.38012 8.38121 14.179 6.02089 11.8061 17.2013 9.90967 numMergedOcc 0
32 mol 292 unq 1 iso 0 dist 6.07571 8.66797 8.2734 14.3549 8.38121 14.179 16.459 11.8061 17.2013 9.90967 numMergedOcc 0
