0 mol 25 unq 0 iso 0 dist 6.5461 6.98291 4.66733 5.93887 7.8701 11.0995 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 6.5461 6.98291 4.66733 9.28575 9.78326 13.452 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 7.96846 6.69917 13.5709 6.87634 7.13468 11.0343 numMergedOcc 0
3 mol 28 unq 1 iso 0 dist 7.96846 6.69917 13.5709 5.80563 9.50693 11.1812 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 6.63128 8.64844 12.7696 5.56904 8.32116 12.5629 numMergedOcc 0
5 mol 44 unq 0 iso 0 dist 7.89468 5.06773 11.6185 8.6173 6.15703 13.6189 numMergedOcc 0
6 mol 44 unq 1 iso 0 dist 8.44721 5.06773 7.95554 6.54204 6.24688 9.16411 numMergedOcc 0
7 mol 44 unq 2 iso 0 dist 5.31062 8.2444 7.95554 4.66466 6.24688 9.16411 numMergedOcc 0
8 mol 54 unq 0 iso 0 dist 7.01149 8.30888 4.53455 4.86646 8.76844 7.40997 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 6.75545 7.65992 12.2139 6.84424 7.89895 8.23849 numMergedOcc 0
10 mol 68 unq 1 iso 0 dist 8.99095 7.65992 12.213 6.84424 9.54996 8.23849 numMergedOcc 0
11 mol 71 unq 0 iso 0 dist 6.01135 8.87417 11.197 5.1167 6.20435 13.8165 numMergedOcc 0
12 mol 151 unq 0 iso 0 dist 5.37884 8.40211 5.04333 8.34293 9.62391 7.28671 numMergedOcc 0
13 mol 151 unq 1 iso 0 dist 6.24917 8.24746 5.04333 7.90899 9.62391 7.28671 numMergedOcc 0
14 mol 167 unq 0 iso 0 dist 9.08844 8.28222 12.7516 6.63124 9.50912 9.94406 numMergedOcc 0
15 mol 167 unq 1 iso 0 dist 9.08844 8.28222 12.7516 12.0166 5.74367 16.4638 numMergedOcc 0
16 mol 176 unq 0 iso 0 dist 8.44087 7.2799 6.19655 6.05742 8.41194 9.78837 numMergedOcc 0
17 mol 176 unq 1 iso 0 dist 8.44087 8.84411 13.6815 6.05742 8.41194 13.2736 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 8.22461 7.04167 3.84531 7.37579 9.44905 11.057 numMergedOcc 0
19 mol 186 unq 1 iso 0 dist 8.22461 7.04167 3.84531 5.12892 4.95355 6.13396 numMergedOcc 0
20 mol 261 unq 0 iso 0 dist 5.85932 9.39571 9.46424 5.40393 5.46946 11.0057 numMergedOcc 0
21 mol 261 unq 1 iso 0 dist 5.69181 9.39571 7.48263 5.40393 8.24264 11.0057 numMergedOcc 0
22 mol 261 unq 2 iso 0 dist 5.69181 9.39571 7.48263 5.86761 9.66703 10.2554 numMergedOcc 0
