0 mol 25 unq 0 iso 0 dist 9.36326 8.26412 7.1845 8.64255 7.685 7.6114 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.8197 7.93454 4.53851 10.6266 11.098 7.18022 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 8.8197 9.06898 5.31195 10.6266 11.098 6.24711 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 7.13638 9.76234 10.7557 12.5529 16.3613 9.22598 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 7.13638 9.76234 10.7557 8.47822 12.7237 8.96727 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 5.77804 5.46186 9.18194 10.2851 16.0334 9.22631 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 9.36283 6.17349 9.00091 6.86762 11.8557 7.69765 numMergedOcc 0
7 mol 115 unq 1 iso 0 dist 9.36283 9.21978 6.04071 10.3475 12.0409 6.39384 numMergedOcc 0
8 mol 115 unq 2 iso 0 dist 9.36283 9.21978 6.04071 6.86762 11.8557 9.42082 numMergedOcc 0
9 mol 117 unq 0 iso 0 dist 9.77482 5.20001 6.95589 5.17524 6.62561 6.10127 numMergedOcc 0
10 mol 117 unq 1 iso 0 dist 9.0428 5.20001 13.3894 5.17524 13.4462 6.10127 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 9.71611 4.54218 6.8823 10.5394 13.8038 8.07097 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 7.1093 4.54218 4.22522 10.5394 6.93652 8.07097 numMergedOcc 0
13 mol 141 unq 2 iso 0 dist 7.36421 8.36316 4.22522 11.2797 6.93652 8.07097 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 8.71031 5.4647 5.88866 6.96904 10.5498 7.06025 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 6.62037 7.83476 4.48306 5.49497 7.98142 6.64173 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 6.21461 7.83476 4.88823 5.49497 7.37327 6.64173 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 8.6925 5.81317 5.9858 5.69131 8.45368 7.94911 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 5.02756 8.15661 4.03073 5.74363 7.82944 9.35274 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 8.94219 7.9002 3.92979 10.0712 5.50387 8.1945 numMergedOcc 0
20 mol 225 unq 1 iso 0 dist 8.94219 7.9002 3.92979 6.7444 9.88956 6.50998 numMergedOcc 0
21 mol 243 unq 0 iso 0 dist 9.85284 9.49016 10.9216 6.50608 14.7694 8.69318 numMergedOcc 0
