0 mol 4 unq 0 iso 0 dist 8.66947 7.95976 6.66589 6.80703 9.71908 4.70233 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 8.66947 6.30863 9.80478 6.80703 9.71908 7.10738 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 6.35333 7.27221 9.05728 5.97717 9.18371 11.2948 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 9.16277 13.2915 9.05728 5.63651 9.18371 11.2948 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.72872 5.64505 8.62769 10.3388 5.38191 9.80109 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 6.72872 9.04212 6.09782 10.3388 5.38191 8.65318 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 5.84326 7.84309 8.54845 4.88072 6.80741 12.3451 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 8.00286 6.26411 6.53758 5.88616 7.02715 5.2941 numMergedOcc 0
8 mol 188 unq 0 iso 0 dist 8.67271 11.2733 7.63268 7.70994 6.02561 4.54544 numMergedOcc 0
9 mol 188 unq 1 iso 0 dist 7.24099 5.11822 7.95028 5.13959 9.24118 6.11696 numMergedOcc 0
10 mol 206 unq 0 iso 0 dist 5.82039 7.18271 7.0119 10.3181 8.31638 4.85877 numMergedOcc 0
11 mol 206 unq 1 iso 0 dist 5.82039 7.18271 7.0119 8.09615 9.72979 8.77652 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 8.58471 10.4085 6.53736 15.9233 9.67457 14.0406 numMergedOcc 0
13 mol 210 unq 1 iso 0 dist 8.58471 9.24214 8.18851 15.9233 9.67457 11.7201 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.14644 6.4634 8.9077 14.5536 7.31105 15.8912 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 9.66521 9.54396 6.095 5.34424 9.18675 11.1791 numMergedOcc 0
16 mol 284 unq 0 iso 0 dist 9.98268 10.318 7.2795 8.92414 8.27793 6.69796 numMergedOcc 0
17 mol 284 unq 1 iso 0 dist 9.98268 4.57881 7.35866 8.92414 8.27793 5.09231 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 9.82717 16.9394 7.66291 14.401 8.71213 12.6654 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 8.33653 5.60271 7.66291 8.64319 8.71213 12.6654 numMergedOcc 0
20 mol 285 unq 2 iso 0 dist 6.44657 4.8011 7.66291 14.1417 8.71213 12.6654 numMergedOcc 0
