0 mol 0 unq 0 iso 0 dist 9.42137 4.59249 7.37981 14.5258 7.15528 13.3337 13.5016 5.47921 12.4868 6.94181 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.42137 12.6412 7.19621 14.5258 7.15528 6.83587 13.5016 5.47921 10.9707 6.94181 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 8.13983 5.2767 8.73627 5.63648 6.38364 9.18933 10.9956 5.49061 11.6708 6.89209 numMergedOcc 0
3 mol 14 unq 1 iso 0 dist 6.45858 8.1206 8.73627 4.05028 6.38364 9.18933 9.63512 5.49061 11.6708 6.89209 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.38387 7.67926 9.74445 11.0096 8.80331 10.323 11.0563 5.90113 7.53564 9.17086 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 5.97635 6.31564 6.59893 13.2619 8.10861 12.4254 8.34361 5.65405 10.4186 6.54183 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 5.97635 4.94741 5.59773 13.2619 8.10861 10.1356 8.34361 5.65405 6.10175 6.54183 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 6.90827 13.2842 9.85576 10.4485 7.90328 10.4589 11.6509 5.21051 8.30003 7.0318 numMergedOcc 0
8 mol 117 unq 1 iso 0 dist 8.90977 12.0106 9.85576 13.8755 7.90328 10.4589 13.1924 5.21051 8.30003 7.0318 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 5.63005 12.1048 9.42766 10.5268 8.73993 14.0677 15.5348 10.5726 13.776 8.88255 numMergedOcc 0
10 mol 126 unq 0 iso 0 dist 8.32241 9.63225 9.54928 4.84035 6.06638 7.01529 10.6754 5.50061 9.40608 6.24392 numMergedOcc 0
11 mol 227 unq 0 iso 0 dist 9.07872 9.99433 9.64299 9.9474 7.09863 7.69739 15.0689 6.38287 11.4993 9.60159 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 6.24928 9.87348 9.75174 5.33567 6.57393 13.477 9.18345 5.33697 14.9437 6.06422 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 6.44212 11.0479 6.37342 7.97883 6.16342 5.29737 10.9473 4.77446 4.21935 6.83046 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 5.73834 3.95075 8.58088 7.52881 6.42289 9.22664 6.41167 5.13233 6.59521 8.21585 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 5.90645 6.13878 6.77279 4.62072 8.53687 7.55268 5.16838 5.20592 9.16548 5.75874 numMergedOcc 0
