0 mol 6 unq 0 iso 0 dist 9.90644 8.41625 11.3767 6.01633 7.76205 4.82562 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 9.90644 9.26453 7.55017 6.01633 7.76205 8.85796 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 8.79578 7.32436 5.64505 5.15508 6.6367 6.81735 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 9.74497 9.1916 8.36942 9.66459 10.6794 7.17133 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 9.30739 8.32033 11.8367 12.3183 18.7726 9.38568 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 5.35254 8.98532 11.8426 12.2432 16.6083 6.61645 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 7.45209 5.84349 7.82029 6.56529 10.575 9.02905 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 9.51502 9.35708 9.33176 4.92125 13.2135 8.99777 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 9.51502 8.40313 11.4788 4.92125 13.2135 7.32974 numMergedOcc 0
9 mol 195 unq 0 iso 0 dist 8.28543 8.3941 4.71117 5.77195 9.48763 9.16422 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 9.56851 6.58174 8.26563 10.816 16.8688 8.77524 numMergedOcc 0
11 mol 207 unq 0 iso 0 dist 7.71388 5.65418 5.47226 3.6796 10.2388 8.29754 numMergedOcc 0
12 mol 207 unq 1 iso 0 dist 7.71388 5.65418 5.47226 7.34337 10.1871 8.85994 numMergedOcc 0
13 mol 207 unq 2 iso 0 dist 7.71388 4.70143 10.8177 3.6796 10.2388 5.77532 numMergedOcc 0
14 mol 207 unq 3 iso 0 dist 7.71388 4.70143 10.8177 7.34337 10.1871 8.75785 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 9.67898 7.24175 8.09631 7.25055 6.26596 9.46274 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 9.32657 8.33143 16.8211 16.0567 24.4926 7.78392 numMergedOcc 0
17 mol 252 unq 0 iso 0 dist 9.86148 5.41885 5.93751 5.45887 10.7335 9.09279 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 5.2691 7.76337 5.45863 4.6733 7.79803 6.74521 numMergedOcc 0
19 mol 257 unq 0 iso 0 dist 9.80634 9.94785 3.66549 5.83544 6.73777 8.23073 numMergedOcc 0
