0 mol 29 unq 0 iso 0 dist 8.26334 4.10356 6.34665 5.36278 11.1943 7.28761 numMergedOcc 0
1 mol 29 unq 1 iso 0 dist 7.68854 10.6804 6.34665 15.2186 11.1943 7.28761 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 9.28146 6.87625 8.40203 8.12541 3.76356 6.39025 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.04117 5.22412 9.96858 14.3281 12.9114 9.90029 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 6.34215 10.6245 9.96858 16.9556 12.9114 9.90029 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 6.34748 11.7172 8.66216 9.58606 3.54989 8.15885 numMergedOcc 0
6 mol 56 unq 1 iso 0 dist 6.34748 14.0881 9.42328 9.58606 3.54989 7.43523 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 9.90923 13.2862 9.68196 11.9706 3.89663 7.71942 numMergedOcc 0
8 mol 170 unq 0 iso 0 dist 8.82169 9.23684 6.2845 15.8196 10.6961 7.45761 numMergedOcc 0
9 mol 187 unq 0 iso 0 dist 5.7938 4.8196 8.25559 8.0501 3.94358 8.38922 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 8.63649 3.96711 9.24563 6.39087 4.4227 7.01486 numMergedOcc 0
11 mol 220 unq 1 iso 0 dist 8.63649 3.96711 9.24563 10.269 5.06972 8.86569 numMergedOcc 0
12 mol 220 unq 2 iso 0 dist 8.63649 3.96711 9.24563 10.7459 10.5297 9.06824 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 9.32928 17.7672 8.44521 13.2286 7.26668 9.90442 numMergedOcc 0
14 mol 239 unq 1 iso 0 dist 7.98794 10.7751 8.44521 7.58554 7.26668 9.90442 numMergedOcc 0
15 mol 273 unq 0 iso 0 dist 6.95569 11.9479 5.3725 14.457 9.23419 9.85536 numMergedOcc 0
16 mol 273 unq 1 iso 0 dist 6.95569 11.9479 5.3725 11.835 7.85073 9.44914 numMergedOcc 0
17 mol 286 unq 0 iso 0 dist 6.64391 6.06584 9.2551 6.83763 3.67621 9.91859 numMergedOcc 0
