0 mol 12 unq 0 iso 0 dist 8.8993 9.41745 6.7002 5.70264 5.25583 9.75368 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 6.47185 8.2513 5.80658 10.0967 12.4609 9.86627 numMergedOcc 0
2 mol 89 unq 0 iso 0 dist 9.48877 9.51842 13.3199 9.072 14.5616 9.6629 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 8.56547 7.47827 7.45926 8.92868 8.18876 7.03536 numMergedOcc 0
4 mol 91 unq 1 iso 0 dist 5.23177 7.47827 5.55005 8.92868 5.51155 7.03536 numMergedOcc 0
5 mol 91 unq 2 iso 0 dist 6.77052 7.47827 9.57561 8.92868 8.29601 7.03536 numMergedOcc 0
6 mol 176 unq 0 iso 0 dist 9.67515 4.96326 9.5735 5.80843 11.0789 8.02366 numMergedOcc 0
7 mol 182 unq 0 iso 0 dist 8.86262 6.31492 4.61382 13.278 12.2509 9.06702 numMergedOcc 0
8 mol 182 unq 1 iso 0 dist 7.23874 6.31492 8.09718 13.278 17.1324 9.06702 numMergedOcc 0
9 mol 182 unq 2 iso 0 dist 6.06892 7.8621 11.8631 10.2184 12.8836 9.06702 numMergedOcc 0
10 mol 196 unq 0 iso 0 dist 9.66622 6.64506 9.06228 5.45869 15.0979 9.84466 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 7.24101 7.2527 10.2134 14.3699 12.6304 8.6771 numMergedOcc 0
12 mol 249 unq 0 iso 0 dist 8.84212 6.42827 12.6924 10.249 17.846 6.26142 numMergedOcc 0
13 mol 249 unq 1 iso 0 dist 7.10933 6.42827 8.71871 10.249 14.6696 6.26142 numMergedOcc 0
14 mol 279 unq 0 iso 0 dist 7.07268 8.27977 4.51764 6.86808 10.7912 9.24472 numMergedOcc 0
