0 mol 0 unq 0 iso 0 dist 6.31889 5.57641 5.98788 14.7165 13.0422 9.16606 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 6.94677 5.78327 5.67362 9.2228 5.04866 7.77128 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.75211 13.4991 9.61367 17.909 10.7367 9.225 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 6.16862 11.9102 9.93309 18.5863 15.0618 9.02712 numMergedOcc 0
4 mol 133 unq 1 iso 0 dist 9.70325 13.067 9.93309 20.3751 15.0618 9.02712 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 5.60184 5.55349 5.76862 9.84158 4.97346 6.86189 numMergedOcc 0
6 mol 154 unq 1 iso 0 dist 7.08477 5.55349 5.92763 9.84158 8.02758 6.86189 numMergedOcc 0
7 mol 184 unq 0 iso 0 dist 8.95598 11.2463 6.65725 15.5561 8.87236 8.49577 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 7.58256 9.4381 8.09667 11.8242 4.93748 7.6409 numMergedOcc 0
9 mol 226 unq 0 iso 0 dist 7.04477 12.8829 6.82883 10.7844 4.66376 8.24741 numMergedOcc 0
10 mol 226 unq 1 iso 0 dist 7.04477 14.6433 8.22518 10.7844 4.66376 5.07958 numMergedOcc 0
11 mol 226 unq 2 iso 0 dist 7.04477 7.06868 6.02803 10.7844 4.66376 6.19519 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 9.41148 5.18593 6.71099 11.4007 5.0625 6.72105 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 9.41148 5.18593 6.71099 11.9289 4.86592 7.96569 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 9.73592 9.31629 8.76329 14.7486 6.33637 9.53639 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 7.26887 11.7437 8.52162 9.91128 4.04422 5.77828 numMergedOcc 0
16 mol 241 unq 0 iso 0 dist 9.28598 6.26153 9.14228 9.55645 9.30696 8.00841 numMergedOcc 0
17 mol 241 unq 1 iso 0 dist 9.28598 9.69805 9.04127 13.8538 9.39021 7.91178 numMergedOcc 0
18 mol 244 unq 0 iso 0 dist 8.08939 8.71894 5.60146 11.1378 4.89551 6.2667 numMergedOcc 0
19 mol 244 unq 1 iso 0 dist 7.33574 8.52699 5.60146 11.909 4.89551 6.2667 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 8.42076 9.43796 8.53802 9.38187 5.1517 7.58907 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 8.42076 9.43796 8.53802 9.38187 5.1517 7.58907 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 8.42076 9.43796 8.53802 9.38187 5.1517 7.58907 numMergedOcc 0
