0 mol 0 unq 0 iso 0 dist 9.6994 9.23213 5.08793 6.26831 6.34883 4.04089 5.24778 11.2072 8.34244 6.64713 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.15528 9.23213 10.4498 6.26831 9.19662 4.04089 5.24778 11.2263 8.34244 6.64713 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 7.20519 7.82528 10.4988 6.92532 12.3486 6.34272 4.97119 10.741 5.82366 6.39966 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 4.54938 7.82528 5.14627 6.92532 5.18512 6.34272 4.97119 6.41575 5.82366 6.39966 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 6.864 7.82528 4.69858 6.92532 9.47529 6.34272 4.97119 6.41423 5.82366 6.39966 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 6.64012 6.46761 5.24906 7.27383 6.37648 9.17656 5.85698 9.86039 9.11258 6.62229 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 9.38498 8.70133 13.4082 7.04044 15.7304 11.2505 5.11416 13.8696 7.10439 6.48232 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 9.96396 8.70133 7.41074 7.04044 8.26458 11.2505 5.11416 9.24757 7.10439 6.48232 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 6.19304 4.65521 7.41074 8.73253 8.26458 11.2505 6.56633 9.24757 7.10439 6.48232 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 9.75218 8.70133 15.9882 7.04044 8.35241 11.2505 5.11416 13.0145 7.10439 6.48232 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 6.11741 6.99777 10.8292 5.74857 6.08806 6.03931 5.22052 11.0224 5.60389 8.85881 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 7.88312 6.99777 11.7126 5.74857 7.21418 6.03931 5.22052 12.13 5.60389 8.85881 numMergedOcc 0
12 mol 126 unq 0 iso 0 dist 6.06638 7.75534 7.01257 9.46588 5.5703 5.83002 6.0268 6.30546 7.36017 5.94233 numMergedOcc 0
13 mol 126 unq 1 iso 0 dist 6.06638 7.75534 7.01257 9.46588 5.5703 5.83002 8.01268 10.0699 5.14819 8.56219 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 8.94367 8.79571 5.41704 8.20836 9.4027 9.65798 4.57832 6.23142 8.73604 9.30061 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 9.86662 8.79571 6.17103 8.20836 5.12325 9.65798 4.57832 9.94764 8.73604 9.30061 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 8.34702 7.36119 11.787 5.38091 10.7023 5.33988 5.81563 13.0658 6.05323 7.46845 numMergedOcc 0
17 mol 156 unq 1 iso 0 dist 9.06726 7.36119 7.71144 5.38091 9.00862 5.33988 5.81563 11.5017 6.05323 7.46845 numMergedOcc 0
18 mol 156 unq 2 iso 0 dist 8.33171 7.36119 9.22231 5.38091 11.1271 5.33988 5.81563 10.0063 6.05323 7.46845 numMergedOcc 0
19 mol 175 unq 0 iso 0 dist 9.29945 9.52634 9.11521 7.35824 12.5754 6.05776 6.77832 12.6314 8.99988 5.60528 numMergedOcc 0
20 mol 175 unq 1 iso 0 dist 9.29945 9.52634 9.11521 9.17364 10.0424 5.85047 6.77832 12.6314 8.99988 5.5995 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 7.55216 8.83563 11.662 5.87815 10.6244 4.3387 6.67321 13.0798 9.28891 7.95359 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 9.02271 7.19465 7.92528 7.77998 13.6942 14.5407 5.78064 13.07 9.58354 8.15091 numMergedOcc 0
