0 mol 43 unq 0 iso 0 dist 6.61704 4.64617 8.03914 12.5474 11.4038 9.04174 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 8.51894 6.50345 9.13371 8.27592 3.83043 9.43916 numMergedOcc 0
2 mol 69 unq 1 iso 0 dist 8.27592 6.50345 9.43916 8.51894 3.83043 9.13371 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 6.41105 5.29991 5.9443 10.5281 5.60823 9.07681 numMergedOcc 0
4 mol 88 unq 1 iso 0 dist 6.41105 5.29991 5.9443 10.8692 6.01921 9.24666 numMergedOcc 0
5 mol 108 unq 0 iso 0 dist 9.24001 8.96376 5.60118 16.016 6.97715 9.91024 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 9.29439 5.02595 6.39945 11.0387 7.15643 7.14258 numMergedOcc 0
7 mol 178 unq 0 iso 0 dist 7.82796 4.16734 9.26238 10.0941 5.82281 9.32853 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 7.72242 10.2336 7.578 19.1725 13.9864 9.24926 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 4.3362 4.14896 7.27248 5.51565 5.88344 9.50216 numMergedOcc 0
10 mol 220 unq 1 iso 0 dist 5.51565 4.14896 9.50216 4.3362 5.88344 7.27248 numMergedOcc 0
11 mol 220 unq 2 iso 0 dist 9.74776 4.55332 9.50216 10.181 5.88344 7.27248 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 4.21935 8.15025 7.69491 12.5656 10.5674 6.64008 numMergedOcc 0
13 mol 269 unq 0 iso 0 dist 9.91093 11.5175 7.92043 13.2128 6.37992 9.71909 numMergedOcc 0
14 mol 279 unq 0 iso 0 dist 8.66917 6.23517 8.16952 12.2169 8.52622 9.67649 numMergedOcc 0
15 mol 279 unq 1 iso 0 dist 8.36655 5.03816 8.9352 10.6842 10.71 5.8845 numMergedOcc 0
16 mol 279 unq 2 iso 0 dist 8.76889 7.51644 5.8845 15.937 10.71 8.9352 numMergedOcc 0
17 mol 279 unq 3 iso 0 dist 7.04397 3.75346 5.8845 12.2658 10.71 8.9352 numMergedOcc 0
18 mol 283 unq 0 iso 0 dist 6.15136 5.83652 5.05882 14.051 11.6786 9.4181 numMergedOcc 0
19 mol 286 unq 0 iso 0 dist 8.30708 6.2267 8.09566 8.9718 5.58226 5.6343 numMergedOcc 0
20 mol 286 unq 1 iso 0 dist 8.9718 6.2267 5.6343 8.30708 5.58226 8.09566 numMergedOcc 0
