0 mol 26 unq 0 iso 0 dist 5.97065 8.69142 4.98603 7.54726 8.62693 9.27369 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 7.12852 4.9737 6.78223 6.24786 7.7868 9.32718 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 4.89196 9.51503 7.12967 8.33049 8.84323 8.67162 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 6.97484 6.15011 6.50817 8.99211 7.00606 9.50373 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 9.6785 9.84391 15.0649 4.73128 9.78437 7.48533 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 5.81632 8.85675 4.70993 5.32921 8.46844 11.4264 numMergedOcc 0
6 mol 205 unq 0 iso 0 dist 6.37411 6.32542 11.9538 5.82036 7.31632 10.8631 numMergedOcc 0
7 mol 226 unq 0 iso 0 dist 9.51038 9.37981 5.70052 5.70516 9.31669 11.0668 numMergedOcc 0
8 mol 235 unq 0 iso 0 dist 6.43838 4.46919 4.29892 13.9461 9.74324 12.3837 numMergedOcc 0
9 mol 238 unq 0 iso 0 dist 6.89216 6.65465 10.3871 4.79969 9.88122 10.4741 numMergedOcc 0
10 mol 238 unq 1 iso 0 dist 6.50118 8.85202 10.5587 10.0091 9.77231 18.3884 numMergedOcc 0
11 mol 238 unq 2 iso 0 dist 6.50118 6.97527 10.3809 10.0091 9.77231 16.6167 numMergedOcc 0
12 mol 274 unq 0 iso 0 dist 8.8896 8.18864 7.38014 6.59723 8.62431 12.5978 numMergedOcc 0
