0 mol 10 unq 0 iso 0 dist 6.50444 5.68247 7.82875 9.36515 6.02543 7.76433 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 4.47883 4.77562 5.95472 9.55066 7.56029 11.4033 numMergedOcc 0
2 mol 41 unq 1 iso 0 dist 6.07514 9.06291 5.95472 4.15148 7.56029 11.4033 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.42184 6.63464 7.47162 5.6721 5.17145 4.66422 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 7.58743 4.20398 7.318 6.32618 5.70907 6.15669 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 6.52441 7.99002 6.84679 9.07895 8.31881 5.74351 numMergedOcc 0
6 mol 225 unq 0 iso 0 dist 7.25438 10.6299 8.69052 4.61903 8.69811 9.86822 numMergedOcc 0
7 mol 225 unq 1 iso 0 dist 7.25438 10.6299 8.69052 9.67929 4.98402 10.175 numMergedOcc 0
8 mol 227 unq 0 iso 0 dist 8.79884 4.66497 8.76745 7.06191 5.28771 4.81714 numMergedOcc 0
9 mol 227 unq 1 iso 0 dist 8.79884 4.85822 5.77762 7.06191 5.28771 5.86596 numMergedOcc 0
10 mol 238 unq 0 iso 0 dist 7.13727 5.64173 5.52788 12.1653 6.53286 10.1787 numMergedOcc 0
11 mol 238 unq 1 iso 0 dist 8.56975 4.11566 5.52788 12.2456 6.53286 10.1787 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 7.63381 17.1937 9.993 9.43815 8.88763 12.7949 numMergedOcc 0
13 mol 239 unq 1 iso 0 dist 7.63381 17.1937 9.993 9.79222 6.43209 10.4475 numMergedOcc 0
14 mol 239 unq 2 iso 0 dist 7.63381 17.1937 9.993 15.2256 8.48769 5.68875 numMergedOcc 0
15 mol 247 unq 0 iso 0 dist 9.01651 4.36793 9.07781 12.9282 9.92277 11.2411 numMergedOcc 0
16 mol 247 unq 1 iso 0 dist 9.01651 4.80559 6.84199 12.9282 9.92277 8.28729 numMergedOcc 0
17 mol 247 unq 2 iso 0 dist 8.83903 5.76234 9.07781 5.74872 9.92277 11.2411 numMergedOcc 0
18 mol 247 unq 3 iso 0 dist 8.83903 4.99579 6.84199 5.74872 9.92277 8.28729 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 7.59142 15.1753 8.34313 6.06247 5.81528 10.4013 numMergedOcc 0
