0 mol 11 unq 0 iso 0 dist 6.49709 7.4835 5.95165 5.51815 4.61088 3.77561 6.20956 4.73237 9.76946 6.89666 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 9.28341 4.97366 6.87018 5.58255 6.38364 5.45641 11.467 5.63648 11.2455 8.13983 numMergedOcc 0
2 mol 14 unq 1 iso 0 dist 9.28341 4.97366 6.87018 5.58255 6.38364 5.45641 8.31896 4.05028 8.25832 6.45858 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 8.94828 4.93826 8.40051 15.6642 7.17969 14.4191 12.2829 5.59268 13.0464 8.88413 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 8.66715 13.3005 9.50322 14.0905 7.11802 5.37072 12.5406 6.26797 7.12336 5.86531 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 9.00172 13.3005 5.82404 14.0905 8.00618 5.37072 12.5406 9.73435 7.12336 5.86531 numMergedOcc 0
6 mol 133 unq 2 iso 0 dist 8.95433 15.4773 9.50322 11.0811 7.11802 5.37072 13.6484 6.26797 7.12336 5.86531 numMergedOcc 0
7 mol 196 unq 0 iso 0 dist 9.79271 9.31621 9.99314 4.07683 9.62191 6.70722 6.28071 4.59462 7.556 6.87731 numMergedOcc 0
8 mol 235 unq 0 iso 0 dist 6.45574 9.7911 8.48065 6.70342 5.4638 5.23741 6.91126 6.84447 8.92054 9.11256 numMergedOcc 0
9 mol 235 unq 1 iso 0 dist 6.45574 9.7911 8.48065 6.70342 5.4638 5.23741 9.48967 7.38431 12.1257 7.08539 numMergedOcc 0
10 mol 235 unq 2 iso 0 dist 8.14407 10.656 8.48065 6.01036 5.4638 5.23741 11.4657 6.84447 8.92054 9.11256 numMergedOcc 0
11 mol 235 unq 3 iso 0 dist 8.14407 10.656 8.48065 6.01036 5.4638 5.23741 6.43002 7.38431 12.1257 7.08539 numMergedOcc 0
12 mol 235 unq 4 iso 0 dist 7.8128 12.3178 9.11256 5.49043 5.4638 6.84447 11.9334 5.23741 8.92054 8.48065 numMergedOcc 0
13 mol 235 unq 5 iso 0 dist 7.8128 4.27313 7.08539 5.49043 5.4638 7.38431 11.9334 5.23741 12.1257 8.48065 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 5.77925 8.55909 8.90987 8.93012 6.84306 3.82437 6.79115 4.38595 11.1162 9.89665 numMergedOcc 0
15 mol 236 unq 1 iso 0 dist 5.77925 8.55909 8.90987 12.1686 9.99038 13.8124 15.2153 11.2013 14.4736 5.66569 numMergedOcc 0
16 mol 236 unq 2 iso 0 dist 5.77925 8.55909 8.90987 12.1686 9.99038 13.8124 18.1054 15.1664 18.1269 6.11137 numMergedOcc 0
17 mol 236 unq 3 iso 0 dist 5.77925 8.55909 8.90987 10.5925 8.35971 16.8883 6.79115 4.38595 11.1162 9.05929 numMergedOcc 0
18 mol 236 unq 4 iso 0 dist 8.95071 9.48296 5.66569 18.4732 9.99038 11.2013 19.6342 13.8124 14.4736 8.90987 numMergedOcc 0
19 mol 236 unq 5 iso 0 dist 8.95071 5.05085 6.11137 18.4732 9.99038 15.1664 19.6342 13.8124 18.1269 8.90987 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 9.39537 6.43015 6.24928 9.53107 6.57393 5.33567 16.4805 10.3859 13.7774 9.13537 numMergedOcc 0
21 mol 241 unq 0 iso 0 dist 8.23536 9.23513 9.10633 5.50714 7.4631 7.20238 12.5052 6.72492 9.40808 8.40773 numMergedOcc 0
22 mol 241 unq 1 iso 0 dist 8.23536 9.23513 9.10633 5.50714 7.4631 7.20238 11.2123 9.87799 15.6286 9.18476 numMergedOcc 0
23 mol 241 unq 2 iso 0 dist 6.90245 3.92006 9.10633 5.3674 7.4631 7.20238 5.66945 6.72492 9.40808 8.40773 numMergedOcc 0
24 mol 241 unq 3 iso 0 dist 6.90245 3.92006 9.10633 5.3674 7.4631 7.20238 12.4569 9.87799 15.6286 9.18476 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 7.37999 9.36659 8.43858 11.0659 6.24356 8.55312 10.875 3.93713 11.229 8.19504 numMergedOcc 0
26 mol 264 unq 1 iso 0 dist 7.36703 6.52963 8.43858 5.91731 6.24356 8.55312 11.0689 3.93713 11.229 8.19504 numMergedOcc 0
