0 mol 0 unq 0 iso 0 dist 7.79297 7.88527 7.20999 11.9798 8.82102 4.36715 11.7303 7.65806 5.56011 4.87624 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 9.28341 9.08594 6.89209 12.5091 8.39221 6.09608 5.58255 6.38364 5.49061 7.00835 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 6.68517 7.67331 8.59049 10.1407 8.47315 10.2869 5.65481 4.7319 5.70228 5.59769 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 5.50504 12.0885 9.70415 5.25196 9.62468 14.0458 7.62418 6.65721 5.46309 10.7369 numMergedOcc 0
4 mol 61 unq 1 iso 0 dist 5.50504 12.0885 9.70415 5.25196 9.62468 14.0458 6.53977 6.72123 11.9897 11.5608 numMergedOcc 0
5 mol 61 unq 2 iso 0 dist 5.50504 12.0885 9.70415 6.97911 5.92705 6.47853 7.62418 6.65721 5.46309 5.4671 numMergedOcc 0
6 mol 61 unq 3 iso 0 dist 5.50504 12.0885 9.70415 6.97911 5.92705 6.47853 6.53977 6.72123 11.9897 10.1513 numMergedOcc 0
7 mol 102 unq 0 iso 0 dist 8.84131 8.38008 9.84673 10.8385 9.10229 12.6508 8.90571 7.36792 5.09542 8.17186 numMergedOcc 0
8 mol 210 unq 0 iso 0 dist 8.58471 4.922 8.71409 15.9233 9.67457 17.7409 10.3518 6.18308 12.9212 5.82028 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 8.14644 11.7698 6.21273 14.5536 7.31105 9.98645 12.2116 9.23153 5.1021 14.6296 numMergedOcc 0
10 mol 220 unq 1 iso 0 dist 8.14644 11.7698 6.21273 14.5536 7.31105 9.98645 12.2916 8.24498 6.29601 9.52692 numMergedOcc 0
11 mol 229 unq 0 iso 0 dist 6.32302 5.75801 8.8557 5.47886 9.84492 9.61847 6.52416 8.22528 5.65373 11.9226 numMergedOcc 0
12 mol 229 unq 1 iso 0 dist 8.53615 11.8915 8.8557 14.8014 9.84492 9.61847 6.81165 8.22528 5.65373 11.9226 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 8.82778 16.7643 8.61729 12.7518 6.37342 5.39741 11.4665 6.16342 7.02319 5.29737 numMergedOcc 0
14 mol 278 unq 0 iso 0 dist 9.91518 15.3461 8.83775 5.49004 9.82774 14.331 12.8387 8.44326 4.66992 10.5903 numMergedOcc 0
