0 mol 7 unq 0 iso 0 dist 8.88982 11.2808 7.15434 13.9585 7.10621 11.2706 6.10226 5.70161 6.0323 12.2471 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 8.51112 13.0082 9.31271 12.3645 9.04767 10.3326 21.0226 16.5607 8.79533 18.2908 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 6.60918 8.99471 8.4361 5.05215 4.86568 5.39064 10.7526 5.64581 7.65729 6.29703 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 8.51213 10.2716 6.39243 11.0081 9.51761 15.2831 12.376 4.96555 6.72533 13.7283 numMergedOcc 0
4 mol 18 unq 1 iso 0 dist 8.51213 10.2716 6.39243 11.3758 7.3094 9.30561 12.376 4.96555 6.72533 11.0264 numMergedOcc 0
5 mol 18 unq 2 iso 0 dist 8.51213 10.3407 9.1715 11.0081 9.51761 17.8306 12.376 4.96555 8.29216 13.7283 numMergedOcc 0
6 mol 18 unq 3 iso 0 dist 8.51213 10.3407 9.1715 11.3758 7.3094 14.3582 12.376 4.96555 8.29216 11.0264 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 6.04163 4.33482 6.10011 6.34076 5.93252 8.3449 11.3999 8.04817 7.84699 11.905 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 6.04163 4.33482 6.10011 6.34076 5.93252 8.3449 12.0249 9.76331 8.40844 14.8258 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 6.04163 4.33482 6.10011 6.34076 5.93252 8.3449 11.2944 10.4402 6.99156 14.0323 numMergedOcc 0
10 mol 73 unq 3 iso 0 dist 8.88953 9.08957 6.10011 3.92763 5.93252 8.3449 12.6863 8.04817 7.84699 11.905 numMergedOcc 0
11 mol 73 unq 4 iso 0 dist 8.88953 9.08957 6.10011 3.92763 5.93252 8.3449 16.1646 9.76331 8.40844 14.8258 numMergedOcc 0
12 mol 73 unq 5 iso 0 dist 8.88953 9.08957 6.10011 3.92763 5.93252 8.3449 14.2743 10.4402 6.99156 14.0323 numMergedOcc 0
13 mol 90 unq 0 iso 0 dist 6.31203 5.50714 8.44515 4.53359 5.83409 6.1985 10.4836 10.4263 8.39015 12.6828 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 9.60425 6.63536 8.81172 5.17524 9.84395 5.34484 5.38954 6.29427 5.24519 7.70533 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 6.92721 5.32735 6.83046 9.00069 6.16342 4.77446 5.62744 5.29737 4.21935 6.37342 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 5.31858 5.06393 8.21585 6.60345 6.42289 5.13233 8.8726 9.22664 6.59521 8.58088 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 6.68878 4.94144 9.05762 4.31412 6.05727 5.79827 11.6871 8.80293 9.56414 10.2386 numMergedOcc 0
