0 mol 1 unq 0 iso 0 dist 8.93702 7.48521 5.96833 14.8155 7.90358 9.40771 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.93702 7.48521 5.96833 6.04659 6.03793 8.7275 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.16769 6.9246 6.016 11.8061 4.6013 6.887 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 8.50453 6.9246 8.38156 11.8061 9.12499 6.887 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 8.50453 12.5287 7.79336 19.5602 14.28 7.93454 numMergedOcc 0
5 mol 34 unq 3 iso 0 dist 8.50453 13.6582 7.08559 19.5602 14.28 9.06898 numMergedOcc 0
6 mol 34 unq 4 iso 0 dist 6.74716 8.09738 8.38156 13.0437 9.12499 6.887 numMergedOcc 0
7 mol 34 unq 5 iso 0 dist 6.74716 7.48264 7.79336 14.7542 14.28 7.93454 numMergedOcc 0
8 mol 34 unq 6 iso 0 dist 6.74716 9.18464 7.08559 14.7542 14.28 9.06898 numMergedOcc 0
9 mol 34 unq 7 iso 0 dist 5.73257 6.65242 8.63635 13.3728 10.7254 9.06898 numMergedOcc 0
10 mol 68 unq 0 iso 0 dist 9.46609 3.62638 7.95451 6.43426 9.66967 8.8014 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 5.43229 9.02908 8.0168 5.96762 5.39389 9.21978 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 4.95674 7.44092 8.55349 9.94882 12.7763 7.33743 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 7.17226 11.0449 8.55349 17.6665 12.7763 7.33743 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 5.98435 7.97297 7.43401 12.3639 8.67365 9.8564 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 9.55297 11.0797 7.54341 16.1358 10.8638 5.24228 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 6.58245 9.66766 9.27218 14.708 10.4381 9.67667 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 7.89694 6.27279 9.59426 6.25383 6.81684 5.4767 numMergedOcc 0
18 mol 218 unq 1 iso 0 dist 5.66171 6.27279 8.61306 6.25383 4.40481 5.4767 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 9.93542 4.3735 9.06937 10.5404 9.47751 7.05843 numMergedOcc 0
