0 mol 4 unq 0 iso 0 dist 5.66218 11.8342 8.23852 9.44131 5.39008 4.46089 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 7.32584 5.93707 8.70005 4.71641 9.05939 6.20881 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 7.32584 5.93707 8.70005 7.5586 9.38747 11.4016 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 7.34695 10.6593 6.10175 9.34149 6.29755 12.1689 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 7.34695 10.6593 6.10175 13.5048 7.4038 11.8364 numMergedOcc 0
5 mol 71 unq 0 iso 0 dist 8.25891 10.9987 4.87423 12.796 7.12853 5.01302 numMergedOcc 0
6 mol 71 unq 1 iso 0 dist 8.25891 5.14057 7.75237 12.796 7.12853 9.08204 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 6.68748 7.76377 8.26758 5.68565 4.7588 5.33623 numMergedOcc 0
8 mol 99 unq 0 iso 0 dist 7.55911 9.81127 8.23566 13.3825 9.39801 12.5118 numMergedOcc 0
9 mol 99 unq 1 iso 0 dist 7.55911 9.81127 8.23566 6.06914 4.82346 4.74328 numMergedOcc 0
10 mol 99 unq 2 iso 0 dist 7.55911 9.81127 8.23566 6.72932 8.89165 6.55763 numMergedOcc 0
11 mol 104 unq 0 iso 0 dist 7.00359 8.20161 8.53028 5.30572 7.32917 12.6757 numMergedOcc 0
12 mol 118 unq 0 iso 0 dist 9.38422 5.30422 8.27853 7.42775 9.9757 7.55669 numMergedOcc 0
13 mol 180 unq 0 iso 0 dist 7.8826 5.46268 8.86377 11.5873 9.68557 14.9732 numMergedOcc 0
14 mol 180 unq 1 iso 0 dist 7.8826 9.01948 8.47156 11.5873 9.68557 6.88051 numMergedOcc 0
15 mol 180 unq 2 iso 0 dist 9.88068 6.22797 6.83301 8.24668 8.2817 5.63195 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 6.66619 3.95306 5.13722 9.52044 8.49577 8.78766 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 5.06235 10.7067 5.98076 10.5955 9.11823 10.7072 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 8.95183 7.21934 9.56271 6.48083 9.57625 13.0906 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 8.95183 7.21934 9.56271 6.54824 8.08702 4.56028 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 5.42327 6.68415 7.74647 8.80713 4.91772 7.39139 numMergedOcc 0
21 mol 261 unq 0 iso 0 dist 9.86439 17.8598 9.64886 5.40393 8.96253 14.3335 numMergedOcc 0
