0 mol 2 unq 0 iso 0 dist 9.49821 7.99162 4.67907 6.38677 12.8366 9.58976 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 9.49821 7.99162 4.67907 5.59831 7.68766 6.35342 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.75898 6.35333 14.1805 5.97717 13.1495 9.18371 numMergedOcc 0
3 mol 110 unq 0 iso 0 dist 7.85994 7.77678 8.63598 11.5698 11.7281 5.25492 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 8.85912 6.99793 11.1664 5.67441 10.5582 7.25166 numMergedOcc 0
5 mol 114 unq 1 iso 0 dist 8.85912 6.71345 4.77991 5.67441 10.5582 8.42445 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 5.82681 9.52413 5.5366 4.62432 6.94326 7.66381 numMergedOcc 0
7 mol 206 unq 0 iso 0 dist 7.95458 5.82039 4.1887 10.3181 8.75124 8.31638 numMergedOcc 0
8 mol 206 unq 1 iso 0 dist 7.95458 5.82039 4.1887 8.09615 13.7429 9.72979 numMergedOcc 0
9 mol 206 unq 2 iso 0 dist 7.95458 6.22964 10.2285 5.85716 12.9727 9.38127 numMergedOcc 0
10 mol 206 unq 3 iso 0 dist 7.95458 6.22964 10.2285 8.09615 13.7429 6.97859 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 7.35578 8.14644 13.8822 14.5536 19.6341 7.31105 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 7.197 6.32302 5.88282 5.47886 7.32814 9.84492 numMergedOcc 0
13 mol 229 unq 1 iso 0 dist 7.06416 8.53615 9.17 14.8014 18.3065 9.84492 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 9.07461 5.60236 5.01259 7.33514 14.2083 9.71281 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 9.52945 7.49412 11.3652 11.7007 16.0858 9.31246 numMergedOcc 0
16 mol 241 unq 0 iso 0 dist 9.89398 6.90245 10.8667 10.121 19.0883 9.72526 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 4.66834 9.38793 8.31543 12.7183 10.6513 6.60309 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 8.90911 9.38793 10.6013 12.7183 16.1902 6.60309 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 9.23937 9.91518 14.0179 5.49004 11.6081 9.82774 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 8.43383 9.98268 7.26724 8.92414 11.8011 8.27793 numMergedOcc 0
21 mol 284 unq 1 iso 0 dist 8.89995 9.98268 10.0891 8.92414 15.0901 8.27793 numMergedOcc 0
