0 mol 10 unq 0 iso 0 dist 7.57901 9.05199 8.44864 9.8934 3.92592 6.50444 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.01993 14.7592 8.99751 10.9645 5.29055 9.90986 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.01993 14.4804 8.25567 14.4485 6.64374 9.22183 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.64736 6.61758 7.57443 7.10218 12.669 9.42184 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 8.4204 4.84407 9.49995 5.96246 5.88327 9.70292 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 8.4204 4.84407 9.49995 10.1197 3.96826 9.59704 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 5.21813 9.55396 5.94696 5.91797 3.92737 5.08983 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 7.89276 6.62277 5.94696 9.93764 3.92737 5.08983 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 9.88541 11.9833 8.48774 14.696 7.60413 6.67635 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 5.55446 6.61244 5.37302 5.32773 3.84573 6.12348 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 5.55446 4.80164 8.47541 5.32773 3.84573 7.2672 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 5.53978 8.73594 7.6793 13.0371 9.84473 5.56446 numMergedOcc 0
12 mol 146 unq 0 iso 0 dist 6.4477 9.75979 7.13378 12.8464 8.9669 6.93154 numMergedOcc 0
13 mol 146 unq 1 iso 0 dist 7.92203 9.5782 7.13378 15.1013 8.9669 6.93154 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 5.77897 6.54652 5.51388 5.30818 3.95773 6.27683 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 5.77897 4.85063 8.68909 5.30818 3.95773 7.1757 numMergedOcc 0
16 mol 169 unq 2 iso 0 dist 9.71763 14.3008 5.51388 8.89822 3.95773 6.27683 numMergedOcc 0
17 mol 169 unq 3 iso 0 dist 9.71763 12.1929 8.68909 8.89822 3.95773 7.1757 numMergedOcc 0
18 mol 184 unq 0 iso 0 dist 6.71675 3.76321 8.95598 8.09403 4.67256 8.27396 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 7.51337 14.2286 8.37379 11.8377 5.8463 9.49163 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 5.27184 5.05085 8.37813 5.9625 3.86189 9.94117 numMergedOcc 0
21 mol 278 unq 0 iso 0 dist 6.9592 4.46246 6.81257 10.9713 5.08871 9.54428 numMergedOcc 0
