0 mol 54 unq 0 iso 0 dist 6.46263 7.51978 9.65953 6.11985 5.76314 6.13476 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 8.61203 6.27528 6.77896 7.65009 10.2756 9.37524 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 9.32172 7.80757 9.0996 5.53214 14.3299 9.45835 numMergedOcc 0
3 mol 89 unq 0 iso 0 dist 9.48877 8.25651 10.5017 4.80369 9.91926 5.25504 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 8.56547 7.47827 7.45926 7.15993 8.42914 8.00525 numMergedOcc 0
5 mol 91 unq 1 iso 0 dist 5.23177 7.47827 5.55005 7.15993 8.17327 8.00525 numMergedOcc 0
6 mol 91 unq 2 iso 0 dist 6.77052 7.47827 9.57561 7.15993 9.52936 8.00525 numMergedOcc 0
7 mol 110 unq 0 iso 0 dist 8.74224 6.59361 4.65767 7.35494 12.5447 8.1306 numMergedOcc 0
8 mol 110 unq 1 iso 0 dist 5.33139 6.59361 5.33778 7.35494 10.7279 8.1306 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 7.62006 4.93984 7.01116 7.78944 14.942 9.21386 numMergedOcc 0
10 mol 178 unq 0 iso 0 dist 5.79795 6.01118 6.96904 7.09944 7.55683 5.41229 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 8.46429 5.63906 7.37734 5.90884 10.1055 7.09426 numMergedOcc 0
12 mol 196 unq 0 iso 0 dist 7.21836 6.60651 12.7415 10.2953 16.6966 7.84536 numMergedOcc 0
13 mol 196 unq 1 iso 0 dist 7.21836 6.60651 12.7415 11.554 17.2988 7.07723 numMergedOcc 0
14 mol 196 unq 2 iso 0 dist 7.21836 6.60651 12.7415 6.29554 9.67795 6.40064 numMergedOcc 0
15 mol 261 unq 0 iso 0 dist 8.40312 7.26647 12.6092 6.15322 14.4206 6.85589 numMergedOcc 0
16 mol 261 unq 1 iso 0 dist 8.40312 7.7309 13.0522 6.15322 14.4206 6.68878 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 7.07268 8.27977 4.51764 11.9125 9.5174 7.63115 numMergedOcc 0
18 mol 282 unq 0 iso 0 dist 8.07221 7.70229 12.878 5.9433 13.9053 7.34596 numMergedOcc 0
19 mol 282 unq 1 iso 0 dist 8.07221 7.90792 12.8251 5.9433 13.9053 7.12228 numMergedOcc 0
