0 mol 0 unq 0 iso 0 dist 9.6994 6.26831 6.34883 5.24778 11.2072 6.64713 9.23213 5.08793 4.04089 8.34244 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.15528 6.26831 9.19662 5.24778 11.2263 6.64713 9.23213 10.4498 4.04089 8.34244 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 7.20519 6.92532 12.3486 4.97119 10.741 6.39966 7.82528 10.4988 6.34272 5.82366 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 4.54938 6.92532 5.18512 4.97119 6.41575 6.39966 7.82528 5.14627 6.34272 5.82366 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 7.82074 6.36455 5.18512 6.01808 6.41575 6.39966 10.2708 5.14627 6.34272 5.82366 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 6.864 6.92532 9.47529 4.97119 6.41423 6.39966 7.82528 4.69858 6.34272 5.82366 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 8.34347 8.44506 13.2876 10.9837 18.1487 9.5053 13.2086 19.8313 14.3325 5.497 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 6.64012 7.27383 6.37648 5.85698 9.86039 6.62229 10.5905 11.6697 5.36808 7.6481 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 6.64012 7.27383 6.37648 5.85698 9.86039 6.62229 6.46761 5.24906 9.17656 9.11258 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 9.38498 7.04044 15.7304 5.11416 13.8696 6.48232 8.70133 13.4082 11.2505 7.10439 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 9.96396 7.04044 8.26458 5.11416 9.24757 6.48232 8.70133 7.41074 11.2505 7.10439 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 6.19304 8.73253 8.26458 6.56633 9.24757 6.48232 4.65521 7.41074 11.2505 7.10439 numMergedOcc 0
12 mol 73 unq 3 iso 0 dist 9.75218 7.04044 8.35241 5.11416 13.0145 6.48232 8.70133 15.9882 11.2505 7.10439 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 7.97049 7.1589 6.37974 9.29301 9.82915 8.70863 13.9302 15.8792 13.7907 6.05495 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 7.95579 8.00777 5.08358 11.165 12.0078 8.70863 14.6253 17.5435 13.7907 6.05495 numMergedOcc 0
15 mol 85 unq 2 iso 0 dist 6.19965 7.1589 5.08358 9.29301 12.0078 8.70863 13.9302 17.5435 13.7907 6.05495 numMergedOcc 0
16 mol 98 unq 0 iso 0 dist 5.08437 7.26086 7.32662 7.06961 6.7117 8.43352 10.417 8.70415 13.6622 6.0129 numMergedOcc 0
17 mol 98 unq 1 iso 0 dist 6.48948 7.26086 13.4985 7.06961 9.42961 8.43352 10.417 9.74284 13.6622 6.0129 numMergedOcc 0
18 mol 98 unq 2 iso 0 dist 6.10456 7.26086 6.934 7.06961 4.47349 8.43352 10.417 10.0962 13.6622 6.0129 numMergedOcc 0
19 mol 100 unq 0 iso 0 dist 6.45675 7.12017 9.52882 9.75737 15.8683 9.5669 14.448 19.2384 10.2428 7.09065 numMergedOcc 0
20 mol 100 unq 1 iso 0 dist 7.47343 7.12017 12.6602 9.75737 16.5404 9.5669 14.448 20.9812 10.2428 7.09065 numMergedOcc 0
21 mol 100 unq 2 iso 0 dist 8.86688 7.12017 14.8674 9.75737 16.3323 9.5669 14.448 21.946 10.2428 7.09065 numMergedOcc 0
22 mol 114 unq 0 iso 0 dist 7.5732 6.34525 11.128 12.7083 19.2926 9.35942 10.6048 13.7307 8.36453 9.83981 numMergedOcc 0
23 mol 114 unq 1 iso 0 dist 7.5732 6.34525 11.128 12.7083 19.2926 9.35942 11.237 15.9264 6.22315 6.13559 numMergedOcc 0
24 mol 114 unq 2 iso 0 dist 7.5732 6.34525 11.128 12.7083 19.2926 9.35942 10.3172 16.696 6.18257 6.51395 numMergedOcc 0
25 mol 115 unq 0 iso 0 dist 6.11741 5.74857 6.08806 5.22052 11.0224 8.85881 6.99777 10.8292 6.03931 5.60389 numMergedOcc 0
26 mol 115 unq 1 iso 0 dist 7.88312 5.74857 7.21418 5.22052 12.13 8.85881 6.99777 11.7126 6.03931 5.60389 numMergedOcc 0
27 mol 126 unq 0 iso 0 dist 6.06638 9.46588 5.5703 6.0268 6.30546 5.94233 7.75534 7.01257 5.83002 7.36017 numMergedOcc 0
28 mol 126 unq 1 iso 0 dist 6.06638 9.46588 5.5703 8.01268 10.0699 8.56219 7.75534 7.01257 5.83002 5.14819 numMergedOcc 0
29 mol 134 unq 0 iso 0 dist 8.94367 8.20836 9.4027 4.57832 6.23142 9.30061 11.2292 5.3585 8.05714 8.55616 numMergedOcc 0
30 mol 134 unq 1 iso 0 dist 8.94367 8.20836 9.4027 4.57832 6.23142 9.30061 8.79571 5.41704 9.65798 8.73604 numMergedOcc 0
31 mol 134 unq 2 iso 0 dist 9.86662 8.20836 5.12325 4.57832 9.94764 9.30061 11.2292 6.74887 8.05714 8.55616 numMergedOcc 0
32 mol 134 unq 3 iso 0 dist 9.86662 8.20836 5.12325 4.57832 9.94764 9.30061 8.79571 6.17103 9.65798 8.73604 numMergedOcc 0
33 mol 156 unq 0 iso 0 dist 8.34702 5.38091 10.7023 5.81563 13.0658 7.46845 7.36119 11.787 5.33988 6.05323 numMergedOcc 0
34 mol 156 unq 1 iso 0 dist 9.06726 5.38091 9.00862 5.81563 11.5017 7.46845 7.36119 7.71144 5.33988 6.05323 numMergedOcc 0
35 mol 156 unq 2 iso 0 dist 8.33171 5.38091 11.1271 5.81563 10.0063 7.46845 7.36119 9.22231 5.33988 6.05323 numMergedOcc 0
36 mol 175 unq 0 iso 0 dist 9.29945 7.35824 12.5754 11.8693 17.6416 5.89564 11.8821 14.52 5.95187 5.4997 numMergedOcc 0
37 mol 175 unq 1 iso 0 dist 9.29945 7.35824 12.5754 6.77832 12.6314 5.60528 9.52634 9.11521 6.05776 8.99988 numMergedOcc 0
38 mol 175 unq 2 iso 0 dist 9.29945 7.35824 12.5754 6.77832 12.6314 5.60528 11.8821 14.52 5.95187 6.99693 numMergedOcc 0
39 mol 175 unq 3 iso 0 dist 9.29945 9.17364 10.0424 6.77832 12.6314 5.5995 9.52634 9.11521 5.85047 8.99988 numMergedOcc 0
40 mol 175 unq 4 iso 0 dist 9.29945 9.17364 10.0424 6.77832 12.6314 5.5995 11.8821 14.52 5.46129 6.99693 numMergedOcc 0
41 mol 227 unq 0 iso 0 dist 7.55216 5.87815 10.6244 6.67321 13.0798 7.95359 8.83563 11.662 4.3387 9.28891 numMergedOcc 0
42 mol 232 unq 0 iso 0 dist 8.27212 7.83711 8.25884 4.9377 9.40808 6.57921 11.4727 13.5597 7.0877 7.17337 numMergedOcc 0
43 mol 253 unq 0 iso 0 dist 9.02271 7.77998 13.6942 5.78064 13.07 8.15091 7.19465 7.92528 14.5407 9.58354 numMergedOcc 0
