0 mol 16 unq 0 iso 0 dist 6.04965 6.32791 9.99279 5.8404 4.86568 11.061 11.1182 16.4215 7.65889 16.7058 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 9.07927 8.50987 4.51512 6.44262 7.31767 6.03987 9.55844 11.0249 7.99919 4.77954 numMergedOcc 0
2 mol 45 unq 0 iso 0 dist 9.73896 6.96797 5.24762 5.84852 6.43774 7.2846 4.4519 11.5679 9.33906 6.42339 numMergedOcc 0
3 mol 229 unq 0 iso 0 dist 7.81415 9.68636 6.84129 5.6419 9.06952 7.03423 9.76444 11.9869 7.27993 7.22525 numMergedOcc 0
4 mol 234 unq 0 iso 0 dist 8.58958 7.17987 5.88703 16.0172 8.34494 12.9605 12.4759 11.6391 7.81215 14.898 numMergedOcc 0
5 mol 234 unq 1 iso 0 dist 8.58958 7.17987 5.88703 14.7629 6.56247 9.45496 12.4759 11.6391 7.81215 12.4252 numMergedOcc 0
6 mol 234 unq 2 iso 0 dist 8.58958 7.17987 5.88703 13.5847 9.36357 6.7625 12.4759 11.6391 7.81215 5.75498 numMergedOcc 0
7 mol 236 unq 0 iso 0 dist 6.0087 6.67907 7.43758 11.2678 8.03456 15.1853 7.15922 11.5798 8.23087 17.777 numMergedOcc 0
8 mol 236 unq 1 iso 0 dist 6.0087 6.67907 7.43758 12.338 6.84306 13.5269 7.15922 11.5798 8.23087 18.3836 numMergedOcc 0
9 mol 236 unq 2 iso 0 dist 6.0087 6.67907 7.43758 12.431 9.99038 15.7308 7.15922 11.5798 8.23087 15.3396 numMergedOcc 0
10 mol 236 unq 3 iso 0 dist 6.0087 6.67907 7.43758 8.71933 9.78037 14.9122 7.15922 11.5798 8.23087 14.5556 numMergedOcc 0
11 mol 236 unq 4 iso 0 dist 6.0087 6.67907 7.43758 5.81354 8.35971 8.04248 7.15922 11.5798 8.23087 4.66414 numMergedOcc 0
12 mol 259 unq 0 iso 0 dist 8.70852 9.89728 7.64658 5.07898 7.84554 7.46176 13.7396 12.8546 5.85442 10.067 numMergedOcc 0
13 mol 259 unq 1 iso 0 dist 8.70852 9.89728 7.64658 5.07898 7.84554 7.46176 15.7491 12.8903 6.95511 11.6988 numMergedOcc 0
14 mol 259 unq 2 iso 0 dist 6.42437 9.89728 10.5239 5.07898 9.18903 7.46176 13.7396 16.0301 5.85442 10.067 numMergedOcc 0
15 mol 259 unq 3 iso 0 dist 6.42437 9.89728 10.5239 5.07898 9.18903 7.46176 15.7491 17.104 6.95511 11.6988 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 6.20796 8.43682 4.92077 6.9758 9.17653 13.4025 4.66338 8.29262 9.19754 10.7813 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 6.49176 8.23147 7.08227 14.4976 9.7748 16.3537 6.40883 8.9682 5.46926 17.6038 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 6.49176 8.23147 7.08227 14.4976 9.7748 16.3537 6.79352 6.92711 5.13913 14.772 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 6.87804 6.02089 11.8061 11.634 8.2734 17.2013 6.38012 8.38121 9.90967 14.179 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 6.87804 6.02089 11.8061 11.634 8.2734 17.2013 6.03672 10.9396 9.9886 12.241 numMergedOcc 0
