0 mol 15 unq 0 iso 0 dist 4.27439 4.89563 5.63041 6.05868 9.99382 6.82187 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 5.68303 9.74289 13.0823 8.78462 13.8493 7.89424 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.37476 8.85981 7.52996 4.49648 7.48556 6.4104 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 7.37476 9.37314 9.80866 4.50556 9.47045 9.85884 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 9.26301 7.91231 7.65733 13.76 9.45174 8.14429 numMergedOcc 0
5 mol 116 unq 0 iso 0 dist 7.64107 6.12388 9.1425 5.2815 11.4197 9.64597 numMergedOcc 0
6 mol 116 unq 1 iso 0 dist 7.53333 6.12388 6.29219 5.2815 6.90966 9.64597 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 9.83241 9.54663 4.80675 12.8233 7.6453 8.00624 numMergedOcc 0
8 mol 168 unq 0 iso 0 dist 8.66519 7.53748 12.8964 7.36888 13.4678 7.79893 numMergedOcc 0
9 mol 211 unq 0 iso 0 dist 7.49132 7.66285 8.75747 4.83833 11.3087 7.3748 numMergedOcc 0
10 mol 211 unq 1 iso 0 dist 7.49132 7.66285 8.75747 8.77878 13.5158 8.323 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 9.66105 6.9028 8.22716 4.47683 11.4104 9.9693 numMergedOcc 0
12 mol 220 unq 1 iso 0 dist 9.64006 6.9028 9.18635 4.47683 8.57174 9.9693 numMergedOcc 0
13 mol 233 unq 0 iso 0 dist 9.06221 4.94074 10.2837 4.67806 6.9103 7.41931 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 7.73969 6.67907 5.52669 11.1044 4.71683 9.44496 numMergedOcc 0
15 mol 271 unq 0 iso 0 dist 7.90629 7.59727 7.30308 6.04262 9.50884 9.42899 numMergedOcc 0
16 mol 275 unq 0 iso 0 dist 8.55256 9.94511 9.41448 4.78957 11.4141 8.33337 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 9.60879 6.86014 7.44724 4.00063 6.66936 4.81916 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 6.92271 6.86014 5.77904 4.00063 8.15119 4.81916 numMergedOcc 0
19 mol 277 unq 2 iso 0 dist 8.62666 5.97073 5.77904 9.31316 8.15119 4.81916 numMergedOcc 0
20 mol 278 unq 0 iso 0 dist 4.86518 6.23184 6.42903 4.36007 8.83873 6.84604 numMergedOcc 0
