0 mol 26 unq 0 iso 0 dist 9.90242 5.97065 5.88467 8.8533 7.29236 4.80984 4.18634 10.8911 5.84066 6.73167 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.07029 5.97065 6.66387 8.8533 6.29311 4.80984 4.18634 9.63803 5.84066 6.73167 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.12062 5.73257 10.7494 8.8717 14.7325 8.15141 6.65242 15.7464 8.63635 9.58596 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 6.26722 4.95674 4.49984 8.37793 9.32138 7.68389 7.44092 12.3021 8.55349 11.9059 numMergedOcc 0
4 mol 134 unq 0 iso 0 dist 8.49649 5.98435 11.5532 5.8367 4.02705 8.05714 4.72407 10.6236 6.44575 6.99345 numMergedOcc 0
5 mol 134 unq 1 iso 0 dist 8.49649 5.98435 11.5532 5.8367 4.02705 8.05714 7.97297 8.78303 7.43401 5.11043 numMergedOcc 0
6 mol 134 unq 2 iso 0 dist 8.49649 8.80672 14.5276 5.8367 4.02705 13.6926 6.67639 14.5055 5.73203 12.1815 numMergedOcc 0
7 mol 134 unq 3 iso 0 dist 8.49649 8.80672 14.5276 5.8367 4.02705 13.6926 4.4987 10.2498 6.57379 8.48313 numMergedOcc 0
8 mol 195 unq 0 iso 0 dist 8.51112 8.64561 5.86183 8.22643 6.90444 5.15519 11.5968 14.1607 9.74988 7.87972 numMergedOcc 0
9 mol 233 unq 0 iso 0 dist 4.91191 7.99897 5.3674 7.07507 5.72267 11.0789 9.1334 8.7831 8.24424 12.3936 numMergedOcc 0
10 mol 233 unq 1 iso 0 dist 4.91191 7.99897 5.3674 7.07507 5.72267 11.0789 9.81222 9.61071 7.0942 14.3003 numMergedOcc 0
11 mol 233 unq 2 iso 0 dist 4.91191 7.99897 5.3674 7.07507 5.72267 11.0789 5.17683 7.1229 6.01775 11.6407 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 7.90537 9.50619 5.51525 8.2776 8.0809 5.32038 9.31424 7.27503 5.7791 9.65775 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 6.38338 8.70062 4.26276 6.89742 5.43917 9.62906 9.8719 10.251 8.59762 13.329 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 6.38338 8.70062 4.26276 6.89742 5.43917 9.62906 9.8719 10.251 8.59762 13.329 numMergedOcc 0
15 mol 289 unq 0 iso 0 dist 6.38338 8.70062 4.26276 6.89742 5.43917 9.62906 9.8719 10.251 8.59762 13.329 numMergedOcc 0
