0 mol 11 unq 0 iso 0 dist 9.76233 7.86632 9.89425 11.9603 6.76736 6.859 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 6.19695 7.16107 5.7147 14.2628 10.086 8.60614 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 8.00338 9.70457 5.99655 16.5906 9.01071 9.41017 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 7.12713 6.51519 5.4713 6.35731 3.57198 5.43693 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 8.26805 4.05111 5.45099 10.9321 3.94039 8.77077 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 9.68577 4.05111 8.44765 10.9321 5.61505 8.77077 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 7.61514 10.6609 4.29937 10.5372 5.22259 5.05893 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 7.61514 11.2518 3.65628 10.5372 5.22259 5.71866 numMergedOcc 0
8 mol 85 unq 2 iso 0 dist 8.21116 10.6609 5.37869 10.5372 7.66499 5.05893 numMergedOcc 0
9 mol 85 unq 3 iso 0 dist 8.21116 11.2518 4.05415 10.5372 7.66499 5.71866 numMergedOcc 0
10 mol 107 unq 0 iso 0 dist 4.99934 4.11617 6.49371 8.92347 8.49625 5.33764 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 6.38269 7.6316 8.67025 5.7085 6.29259 9.30645 numMergedOcc 0
12 mol 171 unq 0 iso 0 dist 6.80203 4.91613 9.68512 8.53734 8.77204 7.47964 numMergedOcc 0
13 mol 171 unq 1 iso 0 dist 8.00826 4.61696 9.68512 6.08141 8.77204 7.47964 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.89804 14.2573 9.34653 19.8457 13.2309 6.88127 numMergedOcc 0
15 mol 194 unq 0 iso 0 dist 9.3032 10.739 4.45769 7.27978 3.7326 4.19371 numMergedOcc 0
16 mol 194 unq 1 iso 0 dist 9.3032 16.8793 8.99961 7.27978 3.7326 9.71015 numMergedOcc 0
17 mol 194 unq 2 iso 0 dist 8.10451 5.22745 4.45769 9.33397 3.7326 4.19371 numMergedOcc 0
18 mol 194 unq 3 iso 0 dist 8.10451 4.77336 8.99961 9.33397 3.7326 9.71015 numMergedOcc 0
19 mol 194 unq 4 iso 0 dist 6.6747 5.22745 5.89939 9.33397 7.29209 4.19371 numMergedOcc 0
20 mol 194 unq 5 iso 0 dist 6.6747 4.77336 8.18853 9.33397 7.29209 9.71015 numMergedOcc 0
21 mol 194 unq 6 iso 0 dist 6.28412 12.1687 5.89939 12.7833 7.29209 4.19371 numMergedOcc 0
22 mol 194 unq 7 iso 0 dist 6.28412 13.0722 8.18853 12.7833 7.29209 9.71015 numMergedOcc 0
23 mol 252 unq 0 iso 0 dist 4.15692 8.3996 9.81261 6.7021 3.99887 8.09509 numMergedOcc 0
