0 mol 8 unq 0 iso 0 dist 6.82379 7.03958 5.65816 11.0223 5.00267 9.94625 9.88063 5.02333 7.43522 7.8922 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.3915 8.53529 5.65816 6.32152 5.00267 9.94625 10.5239 5.02333 7.43522 7.8922 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 7.05346 7.32257 8.88528 6.119 5.55437 10.7921 15.1483 11.0722 16.147 9.78006 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 9.78006 9.62394 7.28672 11.0722 5.55437 8.076 15.1483 6.119 8.50424 7.05346 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 6.60423 9.41441 11.9395 6.58998 9.38831 11.5841 8.86116 5.97304 14.012 6.72502 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 6.72502 8.60554 6.99746 11.2106 9.40479 4.90592 13.2433 9.48345 5.11617 4.93188 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 6.72502 8.60554 6.99746 11.2106 9.40479 4.90592 15.5296 13.1456 13.2229 9.24958 numMergedOcc 0
7 mol 24 unq 3 iso 0 dist 6.72502 8.60554 6.99746 5.97304 9.38831 9.36461 8.86116 6.58998 8.52463 6.60423 numMergedOcc 0
8 mol 24 unq 4 iso 0 dist 6.72502 8.60554 6.99746 5.97304 9.38831 9.36461 10.5273 11.0493 14.6654 7.83786 numMergedOcc 0
9 mol 24 unq 5 iso 0 dist 6.72502 8.44664 7.6844 11.2106 9.40479 16.1638 13.2433 9.48345 17.1059 4.93188 numMergedOcc 0
10 mol 24 unq 6 iso 0 dist 6.72502 8.44664 7.6844 11.2106 9.40479 16.1638 15.5296 13.1456 17.0288 9.24958 numMergedOcc 0
11 mol 24 unq 7 iso 0 dist 6.72502 8.44664 7.6844 5.97304 9.38831 11.9865 8.86116 6.58998 10.971 6.60423 numMergedOcc 0
12 mol 24 unq 8 iso 0 dist 6.72502 8.44664 7.6844 5.97304 9.38831 11.9865 10.5273 11.0493 10.2281 7.83786 numMergedOcc 0
13 mol 24 unq 9 iso 0 dist 6.72502 9.44691 7.05541 11.2106 9.40479 8.16324 13.2433 9.48345 10.8238 4.93188 numMergedOcc 0
14 mol 24 unq 10 iso 0 dist 6.72502 9.44691 7.05541 11.2106 9.40479 8.16324 15.5296 13.1456 6.7828 9.24958 numMergedOcc 0
15 mol 24 unq 11 iso 0 dist 6.72502 9.44691 7.05541 5.97304 9.38831 14.4545 8.86116 6.58998 13.4893 6.60423 numMergedOcc 0
16 mol 24 unq 12 iso 0 dist 6.72502 9.44691 7.05541 5.97304 9.38831 14.4545 10.5273 11.0493 17.3976 7.83786 numMergedOcc 0
17 mol 24 unq 13 iso 0 dist 4.93188 8.70827 9.75636 9.48345 9.40479 13.9848 13.2433 11.2106 18.8774 6.72502 numMergedOcc 0
18 mol 24 unq 14 iso 0 dist 4.93188 6.73939 10.0715 9.48345 9.40479 11.5841 13.2433 11.2106 14.012 6.72502 numMergedOcc 0
19 mol 24 unq 15 iso 0 dist 9.24958 9.12854 9.75636 13.1456 9.40479 13.9848 15.5296 11.2106 18.8774 6.72502 numMergedOcc 0
20 mol 119 unq 0 iso 0 dist 7.99857 9.11344 6.96805 4.99056 8.03035 8.8562 10.3704 4.91132 7.20179 7.77116 numMergedOcc 0
21 mol 119 unq 1 iso 0 dist 8.56342 6.52773 6.96805 3.78311 8.03035 8.8562 8.73993 4.91132 7.20179 7.77116 numMergedOcc 0
22 mol 119 unq 2 iso 0 dist 8.56342 9.23858 13.3975 3.78311 8.03035 7.91683 8.73993 4.91132 9.89358 7.77116 numMergedOcc 0
23 mol 119 unq 3 iso 0 dist 6.37542 6.52773 4.86811 3.78311 7.6968 8.8562 8.73993 6.08167 7.20179 7.77116 numMergedOcc 0
24 mol 119 unq 4 iso 0 dist 6.37542 9.23858 8.00229 3.78311 7.6968 7.91683 8.73993 6.08167 9.89358 7.77116 numMergedOcc 0
25 mol 156 unq 0 iso 0 dist 7.73169 7.30357 8.40261 5.82636 4.9941 10.6589 13.584 10.7975 17.442 9.31851 numMergedOcc 0
26 mol 156 unq 1 iso 0 dist 7.73169 7.30357 8.40261 5.82636 4.9941 10.6589 8.34702 5.71107 10.4977 6.2319 numMergedOcc 0
27 mol 156 unq 2 iso 0 dist 7.73169 7.30357 8.40261 5.82636 4.9941 10.6589 9.06726 11.2067 12.3086 9.97732 numMergedOcc 0
28 mol 156 unq 3 iso 0 dist 7.73169 8.61587 12.8796 5.82636 4.9941 13.5954 13.584 10.7975 19.1085 9.31851 numMergedOcc 0
29 mol 156 unq 4 iso 0 dist 7.73169 8.61587 12.8796 5.82636 4.9941 13.5954 8.34702 5.71107 12.4274 6.2319 numMergedOcc 0
30 mol 156 unq 5 iso 0 dist 7.73169 8.61587 12.8796 5.82636 4.9941 13.5954 9.06726 11.2067 10.9151 9.97732 numMergedOcc 0
31 mol 156 unq 6 iso 0 dist 5.38091 7.30357 12.4049 6.44255 5.90883 13.0899 8.34702 10.7023 10.4977 9.43259 numMergedOcc 0
32 mol 156 unq 7 iso 0 dist 5.38091 7.30357 12.4049 5.82636 8.06913 10.6589 13.584 13.6634 17.442 9.31851 numMergedOcc 0
33 mol 156 unq 8 iso 0 dist 5.38091 7.30357 12.4049 5.82636 8.06913 10.6589 8.34702 10.7023 10.4977 6.2319 numMergedOcc 0
34 mol 156 unq 9 iso 0 dist 5.38091 7.30357 12.4049 5.82636 8.06913 10.6589 9.06726 9.00862 12.3086 9.97732 numMergedOcc 0
35 mol 156 unq 10 iso 0 dist 5.38091 8.61587 11.7015 6.44255 5.90883 14.9434 8.34702 10.7023 12.4274 9.43259 numMergedOcc 0
36 mol 156 unq 11 iso 0 dist 5.38091 8.61587 11.7015 5.82636 8.06913 13.5954 13.584 13.6634 19.1085 9.31851 numMergedOcc 0
37 mol 156 unq 12 iso 0 dist 5.38091 8.61587 11.7015 5.82636 8.06913 13.5954 8.34702 10.7023 12.4274 6.2319 numMergedOcc 0
38 mol 156 unq 13 iso 0 dist 5.38091 8.61587 11.7015 5.82636 8.06913 13.5954 9.06726 9.00862 10.9151 9.97732 numMergedOcc 0
39 mol 175 unq 0 iso 0 dist 5.4969 9.39352 8.94702 4.24624 7.32419 9.71028 9.29945 12.3408 7.27408 8.0154 numMergedOcc 0
40 mol 175 unq 1 iso 0 dist 6.4318 9.39352 4.06277 4.24624 8.31961 9.71028 9.29945 8.68081 7.27408 8.0154 numMergedOcc 0
41 mol 186 unq 0 iso 0 dist 7.20574 8.73217 11.8992 12.7155 7.55358 17.9524 16.1971 9.27818 17.668 9.56197 numMergedOcc 0
42 mol 186 unq 1 iso 0 dist 7.20574 8.73217 11.8992 12.7155 7.55358 17.9524 18.5854 13.0197 21.4681 7.24795 numMergedOcc 0
43 mol 186 unq 2 iso 0 dist 7.20574 8.73217 11.8992 12.7155 7.55358 17.9524 10.7914 4.37002 15.2571 8.64409 numMergedOcc 0
44 mol 186 unq 3 iso 0 dist 7.20574 8.73217 11.8992 12.7155 7.55358 17.9524 16.7729 9.72941 20.8356 7.60202 numMergedOcc 0
45 mol 227 unq 0 iso 0 dist 8.03442 7.43071 12.8075 11.0628 9.56257 14.3567 7.22101 10.5813 6.35849 8.38865 numMergedOcc 0
46 mol 227 unq 1 iso 0 dist 8.03442 7.43071 12.8075 11.0628 9.56257 14.3567 8.65997 7.22396 10.204 5.4694 numMergedOcc 0
47 mol 227 unq 2 iso 0 dist 8.03442 5.41321 4.59123 11.0628 9.56257 12.135 7.22101 10.5813 10.9607 8.38865 numMergedOcc 0
48 mol 227 unq 3 iso 0 dist 8.03442 5.41321 4.59123 11.0628 9.56257 12.135 8.65997 7.22396 9.72615 5.4694 numMergedOcc 0
49 mol 238 unq 0 iso 0 dist 6.66971 7.57812 4.77308 10.7508 9.89583 14.4327 13.6591 14.1055 18.1855 5.52379 numMergedOcc 0
50 mol 238 unq 1 iso 0 dist 6.66971 8.69104 10.2777 10.7508 9.89583 18.559 13.6591 14.1055 21.4366 5.52379 numMergedOcc 0
51 mol 238 unq 2 iso 0 dist 7.32982 9.24557 4.77308 10.7551 9.89583 14.4327 12.2442 14.1055 18.1855 5.52379 numMergedOcc 0
52 mol 238 unq 3 iso 0 dist 5.52379 7.10685 5.83386 14.1055 9.89583 12.8056 13.6591 10.7508 10.3871 6.66971 numMergedOcc 0
53 mol 238 unq 4 iso 0 dist 5.52379 7.10685 5.83386 14.1055 9.89583 12.8056 10.0419 5.87253 6.54814 6.4398 numMergedOcc 0
54 mol 238 unq 5 iso 0 dist 5.52379 7.10685 5.83386 14.1055 9.89583 12.8056 12.2442 10.7551 14.388 7.32982 numMergedOcc 0
55 mol 258 unq 0 iso 0 dist 6.70815 7.21311 8.10604 6.6525 6.47194 12.3072 6.60405 7.42673 5.63675 9.53063 numMergedOcc 0
