0 mol 73 unq 0 iso 0 dist 8.91858 8.50028 4.63063 5.19187 10.0291 7.45777 12.1332 7.02351 6.85356 10.345 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 8.91858 8.50028 4.63063 5.19187 10.0291 7.45777 14.2641 8.66342 7.32265 14.1204 numMergedOcc 0
2 mol 73 unq 2 iso 0 dist 7.5442 8.50028 4.68175 5.19187 9.27331 7.45777 12.1332 10.4593 6.85356 10.345 numMergedOcc 0
3 mol 73 unq 3 iso 0 dist 7.5442 8.50028 4.68175 5.19187 9.27331 7.45777 14.2641 7.21285 7.32265 14.1204 numMergedOcc 0
4 mol 83 unq 0 iso 0 dist 6.21251 7.6104 12.8269 13.468 18.7924 7.2118 14.0631 19.4502 7.9309 9.9201 numMergedOcc 0
5 mol 87 unq 0 iso 0 dist 9.28786 4.58684 6.19637 5.79354 12.1719 6.22441 7.32447 11.702 7.35921 4.54351 numMergedOcc 0
6 mol 87 unq 1 iso 0 dist 9.28786 6.90348 11.3571 5.79354 12.1719 5.91543 5.83034 14.8374 9.78949 6.17843 numMergedOcc 0
7 mol 99 unq 0 iso 0 dist 6.24473 5.57391 4.74328 4.73115 6.81741 8.68674 5.77364 8.23566 4.82346 8.61334 numMergedOcc 0
8 mol 99 unq 1 iso 0 dist 6.24473 5.57391 4.74328 4.73115 6.81741 8.68674 10.4509 11.1962 8.07233 12.2155 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 6.30762 8.98949 10.1774 12.1136 15.3607 6.08846 5.7687 7.8034 6.45169 9.13134 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 6.30762 8.98949 10.1774 15.0398 16.1827 9.19171 5.7687 7.8034 6.45169 9.57821 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 9.91507 9.67331 10.6104 4.92832 5.33543 9.88178 12.8386 18.1155 8.15734 15.6097 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 9.91507 9.67331 10.6104 4.92832 5.33543 9.88178 3.94348 9.21999 6.00896 5.57607 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 9.10711 8.96503 14.538 4.79799 11.5922 5.86839 7.51653 15.8861 6.02053 6.38518 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 9.10711 8.96503 14.538 4.79799 11.5922 5.86839 10.6644 19.0465 7.41663 7.86936 numMergedOcc 0
15 mol 205 unq 2 iso 0 dist 8.94211 8.96503 12.6987 4.79799 12.2445 5.86839 7.51653 12.7166 6.02053 6.38518 numMergedOcc 0
16 mol 205 unq 3 iso 0 dist 8.94211 8.96503 12.6987 4.79799 12.2445 5.86839 10.6644 16.9905 7.41663 7.86936 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 9.54076 6.61789 7.48216 5.87078 6.41444 8.05949 6.0491 12.9027 8.50367 11.5037 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 9.54076 6.61789 7.48216 5.87078 6.41444 8.05949 11.257 16.0853 8.94889 15.7959 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 8.77267 9.92349 13.0906 11.12 12.22 5.25149 5.4891 9.56271 9.57625 8.17619 numMergedOcc 0
20 mol 220 unq 1 iso 0 dist 8.77267 9.70779 4.56028 11.12 12.22 8.6368 15.2237 14.3572 9.984 7.36665 numMergedOcc 0
21 mol 220 unq 2 iso 0 dist 8.77267 9.70779 4.56028 11.12 12.22 8.6368 5.4891 9.56271 8.08702 8.17619 numMergedOcc 0
22 mol 255 unq 0 iso 0 dist 5.17191 8.01663 6.41518 9.80877 10.6136 7.57779 5.28877 6.61193 7.16286 12.1115 numMergedOcc 0
