0 mol 33 unq 0 iso 0 dist 8.41842 10.1727 7.44828 7.41772 5.2746 9.54828 15.6953 9.9897 8.74487 14.8637 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 8.34804 10.7182 8.27009 12.6838 6.0478 12.4017 14.4837 10.6111 6.04303 15.1251 numMergedOcc 0
2 mol 67 unq 1 iso 0 dist 8.34804 10.7182 8.27009 12.6838 6.0478 12.4017 9.59265 6.9953 6.12267 12.7723 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 8.01516 15.8477 8.64686 11.7786 6.07578 6.15669 20.5433 12.6473 8.61089 12.9634 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 8.01516 15.8477 8.64686 8.13672 9.56449 13.819 20.5433 12.6473 8.61089 20.744 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 7.52954 6.38538 8.078 8.05738 9.7695 12.8915 11.6041 6.73664 7.66418 14.9164 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 9.34752 10.0813 5.2184 10.6499 8.84146 6.3404 10.7186 4.76384 9.84762 13.1776 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 8.41858 4.62337 5.2184 10.2473 8.84146 6.3404 12.3363 4.76384 9.84762 13.1776 numMergedOcc 0
8 mol 139 unq 0 iso 0 dist 5.77343 4.19005 8.78382 4.61769 9.84729 5.53327 10.5546 9.781 9.70154 14.5588 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 8.40718 12.4189 6.20044 13.4719 9.42862 4.07871 12.2846 8.63339 6.62514 6.13963 numMergedOcc 0
10 mol 204 unq 1 iso 0 dist 8.40718 12.4189 6.20044 13.4719 9.42862 4.07871 17.6118 11.09 9.41996 10.8464 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 8.55805 4.74145 6.39087 8.04161 8.31564 8.13432 10.9802 6.99846 9.86144 14.5312 numMergedOcc 0
12 mol 243 unq 0 iso 0 dist 7.93817 4.73439 7.70472 5.81296 8.54245 6.65791 13.2923 10.9243 8.78924 12.9841 numMergedOcc 0
13 mol 243 unq 1 iso 0 dist 7.93817 9.17097 9.16988 5.81296 8.54245 8.93852 13.2923 10.9243 4.64178 12.9841 numMergedOcc 0
14 mol 250 unq 0 iso 0 dist 5.43868 9.96947 8.51703 6.97343 6.46092 5.0005 9.80833 6.53265 5.07895 7.65382 numMergedOcc 0
15 mol 250 unq 1 iso 0 dist 9.80833 9.96947 5.07895 6.97343 7.65382 5.0005 5.43868 6.53265 8.51703 6.46092 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 9.33791 8.55958 8.8646 10.7175 9.98606 16.41 10.8595 6.70676 7.9555 15.2583 numMergedOcc 0
