0 mol 73 unq 0 iso 0 dist 8.50028 5.19187 7.45777 12.1332 6.85356 10.345 8.91858 4.63063 10.0291 7.02351 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 8.50028 5.19187 7.45777 14.2641 7.32265 14.1204 11.6899 8.30433 14.0106 7.53504 numMergedOcc 0
2 mol 73 unq 2 iso 0 dist 8.50028 5.19187 7.45777 14.2641 7.32265 14.1204 8.91858 4.63063 10.0291 8.66342 numMergedOcc 0
3 mol 73 unq 3 iso 0 dist 8.50028 5.19187 7.45777 14.2641 7.32265 14.1204 7.5442 4.68175 9.27331 7.21285 numMergedOcc 0
4 mol 73 unq 4 iso 0 dist 8.50028 5.19187 7.45777 14.2641 7.32265 14.1204 12.9171 10.0459 13.8777 6.95094 numMergedOcc 0
5 mol 99 unq 0 iso 0 dist 5.57391 4.73115 8.68674 5.77364 4.82346 8.61334 6.24473 4.74328 6.81741 8.23566 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 8.98949 12.1136 6.08846 5.7687 6.45169 9.13134 6.30762 10.1774 15.3607 7.8034 numMergedOcc 0
7 mol 131 unq 1 iso 0 dist 8.98949 15.0398 9.19171 5.7687 6.45169 9.57821 6.30762 10.1774 16.1827 7.8034 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 9.67331 4.92832 9.88178 12.8386 8.15734 15.6097 15.2378 6.69705 16.4276 6.4922 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 9.67331 4.92832 9.88178 3.94348 6.00896 5.57607 10.3975 6.01484 7.85526 7.94564 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 9.67331 4.92832 9.88178 3.94348 6.00896 5.57607 9.91507 10.6104 5.33543 9.21999 numMergedOcc 0
11 mol 203 unq 0 iso 0 dist 9.52542 10.3525 6.84619 6.98545 5.46529 4.51654 14.2624 4.9404 7.9591 8.8589 numMergedOcc 0
12 mol 203 unq 1 iso 0 dist 9.80432 12.8357 6.84619 10.347 5.46529 4.51654 14.3655 4.9404 7.9591 8.8589 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 8.96503 4.79799 5.86839 7.51653 6.02053 6.38518 15.4079 8.82544 12.9088 8.21112 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 8.96503 4.79799 5.86839 10.6644 7.41663 7.86936 15.4079 8.82544 12.9088 7.06533 numMergedOcc 0
15 mol 210 unq 0 iso 0 dist 6.61789 5.87078 8.05949 11.257 8.94889 15.7959 15.0955 12.3142 18.427 7.68078 numMergedOcc 0
16 mol 210 unq 1 iso 0 dist 6.61789 5.87078 8.05949 11.257 8.94889 15.7959 17.9766 13.7365 21.3893 9.26518 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 9.92349 11.12 5.25149 5.4891 9.57625 8.17619 8.77267 13.0906 12.22 9.56271 numMergedOcc 0
18 mol 220 unq 1 iso 0 dist 9.70779 11.12 8.6368 15.2237 9.984 7.36665 15.6024 8.70221 7.20255 9.74776 numMergedOcc 0
19 mol 220 unq 2 iso 0 dist 9.70779 11.12 8.6368 5.4891 8.08702 8.17619 8.77267 4.56028 12.22 9.56271 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 6.55222 13.0572 8.86185 14.1404 7.80073 10.1043 13.5145 8.20191 6.00654 8.78008 numMergedOcc 0
21 mol 255 unq 0 iso 0 dist 8.01663 9.80877 7.57779 5.28877 7.16286 12.1115 5.17191 6.41518 10.6136 6.61193 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 9.32251 14.2481 9.86267 15.8365 9.78704 8.46595 13.1939 7.53628 12.1069 5.96276 numMergedOcc 0
