0 mol 48 unq 0 iso 0 dist 9.40644 9.38206 5.79865 11.0398 7.66163 12.7031 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 5.35252 9.38206 4.91651 11.0398 9.48288 12.7031 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 9.53081 8.80334 16.9756 10.7098 8.82709 19.2791 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 5.41357 8.64746 4.97497 7.07433 5.94373 9.32552 numMergedOcc 0
4 mol 105 unq 0 iso 0 dist 6.1083 7.81122 11.0122 10.2375 6.09256 16.6192 numMergedOcc 0
5 mol 105 unq 1 iso 0 dist 6.11833 9.3724 6.10266 8.65154 8.40598 5.03173 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 9.52061 7.65371 13.0969 5.9261 6.52844 12.3422 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 5.40826 8.57285 6.60792 5.56677 9.58037 14.0516 numMergedOcc 0
8 mol 158 unq 0 iso 0 dist 9.38856 8.37022 11.9024 7.46548 6.69487 12.9399 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 6.39087 9.13234 7.56892 5.45485 5.75839 12.299 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 8.86185 4.57548 4.81796 5.86546 8.87182 7.02079 numMergedOcc 0
11 mol 239 unq 1 iso 0 dist 8.86185 4.57548 4.81796 8.35939 5.95622 5.88802 numMergedOcc 0
12 mol 273 unq 0 iso 0 dist 5.78262 6.59786 8.67797 7.10817 9.16554 8.68913 numMergedOcc 0
13 mol 273 unq 1 iso 0 dist 5.78262 6.59786 8.67797 4.30863 8.83491 10.5134 numMergedOcc 0
14 mol 273 unq 2 iso 0 dist 5.78262 7.96519 13.2599 7.10817 9.16554 10.8919 numMergedOcc 0
15 mol 273 unq 3 iso 0 dist 5.78262 7.96519 13.2599 4.30863 8.83491 8.85779 numMergedOcc 0
16 mol 273 unq 4 iso 0 dist 7.6489 6.59786 9.47855 4.30863 9.02711 10.5134 numMergedOcc 0
17 mol 273 unq 5 iso 0 dist 7.6489 7.96519 10.9195 4.30863 9.02711 8.85779 numMergedOcc 0
18 mol 293 unq 0 iso 0 dist 4.72125 5.50284 5.86908 5.82185 6.67882 10.8485 numMergedOcc 0
19 mol 293 unq 1 iso 0 dist 4.72125 8.88355 10.4612 5.82185 6.67882 13.8774 numMergedOcc 0
