0 mol 87 unq 0 iso 0 dist 6.62798 6.02518 9.4868 10.7803 9.90256 15.7737 17.7316 12.809 21.4249 9.99609 numMergedOcc 0
1 mol 87 unq 1 iso 0 dist 9.94718 8.93266 9.4868 13.2349 9.90256 15.7737 16.8765 12.809 21.4249 9.99609 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 7.40582 3.97579 5.37819 15.2733 8.15664 12.1737 17.4377 10.7488 15.224 7.75977 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 5.8915 5.18043 7.52954 5.29804 8.078 6.38538 9.17671 5.56761 9.77978 7.68908 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 7.47105 7.0088 7.17051 11.193 9.2759 5.9683 12.3974 6.53637 8.75007 6.29879 numMergedOcc 0
5 mol 187 unq 0 iso 0 dist 9.55621 10.2744 5.82577 12.9459 8.0501 4.75665 13.5768 9.38569 5.95841 9.90752 numMergedOcc 0
6 mol 188 unq 0 iso 0 dist 6.07498 6.34135 8.94864 6.28041 8.1907 9.77899 8.5397 4.07548 9.99509 7.82113 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 6.58174 10.0944 8.40718 10.9794 6.20044 12.4189 11.6957 5.5367 7.95977 7.52692 numMergedOcc 0
8 mol 204 unq 1 iso 0 dist 6.58174 10.0944 8.40718 10.9794 6.20044 12.4189 12.8432 9.42629 17.6153 9.7707 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 9.54443 8.10536 7.55333 12.5471 5.86839 6.67537 9.6897 4.79799 8.00688 8.96503 numMergedOcc 0
10 mol 226 unq 0 iso 0 dist 8.64849 8.63134 9.5942 9.4366 8.52996 4.31761 8.99521 9.17371 6.54042 9.82101 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 5.46484 5.05085 5.6568 5.81446 7.74348 4.24722 7.89041 6.63806 9.56736 8.24184 numMergedOcc 0
12 mol 236 unq 1 iso 0 dist 8.80671 10.8749 5.6568 14.8289 7.74348 4.24722 15.2353 6.63806 9.56736 8.24184 numMergedOcc 0
