0 mol 7 unq 0 iso 0 dist 8.81871 14.5403 6.0323 9.82794 5.96526 8.05125 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 7.62977 6.48194 5.62629 7.6314 5.55161 7.87739 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 9.37527 6.9157 9.35329 13.8772 8.49884 9.92079 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.91858 12.1332 7.02351 12.722 5.4653 6.7939 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.91858 12.1332 7.02351 8.50028 4.63063 6.85356 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 8.91858 14.2641 8.66342 12.722 5.4653 5.68894 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 8.91858 14.2641 8.66342 8.50028 4.63063 7.32265 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 7.5442 14.2641 7.21285 12.722 7.09483 5.68894 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 7.5442 14.2641 7.21285 8.50028 4.68175 7.32265 numMergedOcc 0
9 mol 87 unq 0 iso 0 dist 6.73874 3.74583 8.33989 7.08616 5.80857 7.10886 numMergedOcc 0
10 mol 87 unq 1 iso 0 dist 6.73874 3.74583 8.33989 7.83182 10.5488 7.83828 numMergedOcc 0
11 mol 99 unq 0 iso 0 dist 6.24473 5.77364 8.23566 14.2679 12.5118 9.39801 numMergedOcc 0
12 mol 99 unq 1 iso 0 dist 6.24473 5.77364 8.23566 5.57391 4.74328 4.82346 numMergedOcc 0
13 mol 99 unq 2 iso 0 dist 6.24473 5.77364 8.23566 9.23475 6.55763 8.89165 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 6.30762 5.7687 7.8034 13.036 9.45822 9.14809 numMergedOcc 0
15 mol 131 unq 1 iso 0 dist 6.30762 5.7687 7.8034 8.98949 10.1774 6.45169 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 6.90904 7.587 6.89564 6.53862 5.32245 9.82274 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 9.91507 3.94348 9.21999 9.67331 10.6104 6.00896 numMergedOcc 0
18 mol 156 unq 0 iso 0 dist 8.22366 13.9009 6.47989 10.9908 4.68339 5.50879 numMergedOcc 0
19 mol 174 unq 0 iso 0 dist 7.66734 7.91244 8.67807 10.5719 5.46023 8.15275 numMergedOcc 0
20 mol 211 unq 0 iso 0 dist 8.47937 14.8063 9.45365 18.1529 13.6185 8.66183 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 8.77267 5.4891 9.56271 9.92349 13.0906 9.57625 numMergedOcc 0
22 mol 220 unq 1 iso 0 dist 8.77267 5.4891 9.56271 9.70779 4.56028 8.08702 numMergedOcc 0
23 mol 226 unq 0 iso 0 dist 9.29519 15.0399 9.05082 15.2674 12.3913 8.24741 numMergedOcc 0
24 mol 255 unq 0 iso 0 dist 5.17191 5.28877 6.61193 8.01663 6.41518 7.16286 numMergedOcc 0
