0 mol 33 unq 0 iso 0 dist 8.41842 5.73206 4.77227 7.1347 14.2319 9.85464 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 7.5203 6.44158 5.80848 12.3113 14.8032 9.53262 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 7.38663 6.72594 8.39751 12.1858 16.5894 9.47087 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 8.45063 6.91278 14.4796 5.14132 6.59367 9.22814 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 5.01633 9.01568 5.19081 8.91765 8.26819 9.24433 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 5.74637 8.87089 6.09578 8.29378 10.1013 7.11852 numMergedOcc 0
6 mol 116 unq 0 iso 0 dist 7.67429 9.62357 6.42183 9.98507 13.348 9.49798 numMergedOcc 0
7 mol 116 unq 1 iso 0 dist 7.67429 9.62357 6.42183 4.6158 9.66069 8.31955 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.61448 5.84909 8.13581 6.2062 6.61636 7.46812 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 9.3586 9.73865 12.4791 4.06022 12.3957 8.37295 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 9.21476 5.47265 9.82809 5.81847 9.6818 9.80032 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 5.31333 6.36789 3.82682 9.58526 5.80433 7.46024 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 8.72285 4.40476 4.79564 4.23514 10.6552 7.48151 numMergedOcc 0
13 mol 213 unq 1 iso 0 dist 8.72285 4.40476 4.79564 6.58235 10.1199 8.58039 numMergedOcc 0
14 mol 217 unq 0 iso 0 dist 8.72578 7.81825 13.7573 9.52898 18.1959 8.94871 numMergedOcc 0
15 mol 217 unq 1 iso 0 dist 8.80103 7.81825 3.6199 9.52898 7.89936 8.94871 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 6.87565 8.39315 4.40152 5.19341 5.64376 7.6416 numMergedOcc 0
