0 mol 12 unq 0 iso 0 dist 9.20201 5.33905 4.76018 10.0413 7.03296 6.6691 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 9.20201 8.09014 7.13046 16.3295 8.98903 9.7652 numMergedOcc 0
2 mol 12 unq 2 iso 0 dist 9.20201 8.09014 7.13046 10.0413 7.03296 9.23807 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 9.57238 8.76497 6.61977 13.7346 9.39741 8.23202 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.80334 14.2257 7.34031 16.3967 9.78889 8.50475 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 8.80334 14.2257 7.34031 11.2983 5.52962 7.66163 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 8.80334 14.2257 7.34031 13.3536 10.1477 9.48288 numMergedOcc 0
7 mol 48 unq 3 iso 0 dist 8.45484 13.7393 7.281 10.6561 5.20585 7.1796 numMergedOcc 0
8 mol 48 unq 4 iso 0 dist 8.45484 13.7393 7.281 12.5275 9.98618 9.16212 numMergedOcc 0
9 mol 64 unq 0 iso 0 dist 8.64746 7.07433 9.32552 5.41357 4.97497 5.94373 numMergedOcc 0
10 mol 105 unq 0 iso 0 dist 9.3724 8.65154 5.03173 13.4095 5.03194 6.09256 numMergedOcc 0
11 mol 105 unq 1 iso 0 dist 9.3724 8.65154 5.03173 6.11833 6.10266 8.40598 numMergedOcc 0
12 mol 128 unq 0 iso 0 dist 9.11128 5.21856 7.75012 12.6189 5.53962 9.05678 numMergedOcc 0
13 mol 128 unq 1 iso 0 dist 9.11128 13.0031 6.98158 12.6189 5.53962 8.73383 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 6.26422 9.37324 6.90634 12.6873 8.88349 7.7461 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 7.33162 6.34062 6.64779 10.8711 13.5257 8.14167 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 4.57548 5.86546 7.02079 8.86185 4.81796 8.87182 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 4.57548 8.35939 5.88802 8.86185 4.81796 5.95622 numMergedOcc 0
18 mol 239 unq 2 iso 0 dist 8.02916 14.6713 8.08764 10.2655 4.47004 8.99609 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 6.59786 7.10817 8.68913 5.78262 8.67797 9.16554 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 6.59786 7.10817 8.68913 14.2673 17.2732 9.65597 numMergedOcc 0
21 mol 273 unq 2 iso 0 dist 7.96519 4.30863 8.85779 5.78262 13.2599 8.83491 numMergedOcc 0
22 mol 273 unq 3 iso 0 dist 7.96519 4.30863 8.85779 7.6489 10.9195 9.02711 numMergedOcc 0
