0 mol 1 unq 0 iso 0 dist 8.26708 5.92202 6.09918 10.5521 7.73435 7.4817 14.3332 7.94662 9.00903 9.12196 numMergedOcc 0
1 mol 1 unq 0 iso 1 dist 6.09918 5.92202 8.26708 7.4817 7.73435 10.5521 9.00903 7.94662 14.3332 9.12196 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 6.82379 6.94408 6.24978 11.0223 5.00267 6.80407 9.88063 5.02333 11.0287 7.8922 numMergedOcc 0
3 mol 8 unq 0 iso 1 dist 6.24978 6.94408 6.82379 6.80407 5.00267 11.0223 11.0287 5.02333 9.88063 7.8922 numMergedOcc 0
4 mol 8 unq 1 iso 0 dist 6.82379 11.2508 9.66439 11.0223 5.00267 8.44094 9.88063 5.02333 14.5532 7.8922 numMergedOcc 0
5 mol 8 unq 1 iso 1 dist 9.66439 11.2508 6.82379 8.44094 5.00267 11.0223 14.5532 5.02333 9.88063 7.8922 numMergedOcc 0
6 mol 8 unq 2 iso 0 dist 6.82379 12.4076 7.3915 11.0223 5.00267 6.32152 9.88063 5.02333 10.5239 7.8922 numMergedOcc 0
7 mol 8 unq 2 iso 1 dist 7.3915 12.4076 6.82379 6.32152 5.00267 11.0223 10.5239 5.02333 9.88063 7.8922 numMergedOcc 0
8 mol 8 unq 1 iso 0 dist 6.24978 5.3787 9.66439 6.80407 5.00267 8.44094 11.0287 5.02333 14.5532 7.8922 numMergedOcc 0
9 mol 8 unq 1 iso 1 dist 9.66439 5.3787 6.24978 8.44094 5.00267 6.80407 14.5532 5.02333 11.0287 7.8922 numMergedOcc 0
10 mol 8 unq 2 iso 0 dist 6.24978 9.22548 7.3915 6.80407 5.00267 6.32152 11.0287 5.02333 10.5239 7.8922 numMergedOcc 0
11 mol 8 unq 2 iso 1 dist 7.3915 9.22548 6.24978 6.32152 5.00267 6.80407 10.5239 5.02333 11.0287 7.8922 numMergedOcc 0
12 mol 8 unq 2 iso 0 dist 9.66439 7.96511 7.3915 8.44094 5.00267 6.32152 14.5532 5.02333 10.5239 7.8922 numMergedOcc 0
13 mol 8 unq 2 iso 1 dist 7.3915 7.96511 9.66439 6.32152 5.00267 8.44094 10.5239 5.02333 14.5532 7.8922 numMergedOcc 0
14 mol 24 unq 0 iso 0 dist 6.60423 7.05502 7.83786 6.58998 9.38831 11.0493 8.86116 5.97304 10.5273 6.72502 numMergedOcc 0
15 mol 24 unq 0 iso 1 dist 7.83786 7.05502 6.60423 11.0493 9.38831 6.58998 10.5273 5.97304 8.86116 6.72502 numMergedOcc 0
16 mol 24 unq 1 iso 0 dist 4.93188 12.3067 9.24958 9.48345 9.40479 13.1456 13.2433 11.2106 15.5296 6.72502 numMergedOcc 0
17 mol 24 unq 1 iso 1 dist 9.24958 12.3067 4.93188 13.1456 9.40479 9.48345 15.5296 11.2106 13.2433 6.72502 numMergedOcc 0
18 mol 43 unq 0 iso 0 dist 9.93832 8.13395 8.60739 7.05402 7.31982 5.48048 10.5523 5.64171 5.73819 8.44903 numMergedOcc 0
19 mol 43 unq 0 iso 1 dist 8.60739 8.13395 9.93832 5.48048 7.31982 7.05402 5.73819 5.64171 10.5523 8.44903 numMergedOcc 0
20 mol 119 unq 0 iso 0 dist 7.99857 4.85907 8.56342 4.99056 8.03035 3.78311 10.3704 4.91132 8.73993 7.77116 numMergedOcc 0
21 mol 119 unq 0 iso 1 dist 8.56342 4.85907 7.99857 3.78311 8.03035 4.99056 8.73993 4.91132 10.3704 7.77116 numMergedOcc 0
22 mol 152 unq 0 iso 0 dist 9.77552 7.65448 8.28642 7.2238 6.39031 5.59336 10.399 5.70788 5.87555 8.35555 numMergedOcc 0
23 mol 152 unq 0 iso 1 dist 8.28642 7.65448 9.77552 5.59336 6.39031 7.2238 5.87555 5.70788 10.399 8.35555 numMergedOcc 0
24 mol 156 unq 0 iso 0 dist 9.31851 7.14831 6.2319 10.7975 4.9941 5.71107 13.584 5.82636 8.34702 7.73169 numMergedOcc 0
25 mol 156 unq 0 iso 1 dist 6.2319 7.14831 9.31851 5.71107 4.9941 10.7975 8.34702 5.82636 13.584 7.73169 numMergedOcc 0
26 mol 156 unq 1 iso 0 dist 9.31851 7.14831 6.2319 13.6634 8.06913 10.7023 13.584 5.82636 8.34702 5.38091 numMergedOcc 0
27 mol 156 unq 1 iso 1 dist 6.2319 7.14831 9.31851 10.7023 8.06913 13.6634 8.34702 5.82636 13.584 5.38091 numMergedOcc 0
28 mol 156 unq 2 iso 0 dist 9.31851 9.98789 9.97732 10.7975 4.9941 11.2067 13.584 5.82636 9.06726 7.73169 numMergedOcc 0
29 mol 156 unq 2 iso 1 dist 9.97732 9.98789 9.31851 11.2067 4.9941 10.7975 9.06726 5.82636 13.584 7.73169 numMergedOcc 0
30 mol 156 unq 3 iso 0 dist 9.31851 9.98789 9.97732 13.6634 8.06913 9.00862 13.584 5.82636 9.06726 5.38091 numMergedOcc 0
31 mol 156 unq 3 iso 1 dist 9.97732 9.98789 9.31851 9.00862 8.06913 13.6634 9.06726 5.82636 13.584 5.38091 numMergedOcc 0
32 mol 156 unq 2 iso 0 dist 6.2319 6.31306 9.97732 5.71107 4.9941 11.2067 8.34702 5.82636 9.06726 7.73169 numMergedOcc 0
33 mol 156 unq 2 iso 1 dist 9.97732 6.31306 6.2319 11.2067 4.9941 5.71107 9.06726 5.82636 8.34702 7.73169 numMergedOcc 0
34 mol 156 unq 3 iso 0 dist 6.2319 6.31306 9.97732 10.7023 8.06913 9.00862 8.34702 5.82636 9.06726 5.38091 numMergedOcc 0
35 mol 156 unq 3 iso 1 dist 9.97732 6.31306 6.2319 9.00862 8.06913 10.7023 9.06726 5.82636 8.34702 5.38091 numMergedOcc 0
36 mol 186 unq 0 iso 0 dist 7.20574 5.74635 6.85302 12.7155 7.55358 9.97575 16.1971 9.27818 15.6447 9.56197 numMergedOcc 0
37 mol 186 unq 0 iso 1 dist 6.85302 5.74635 7.20574 9.97575 7.55358 12.7155 15.6447 9.27818 16.1971 9.56197 numMergedOcc 0
38 mol 186 unq 1 iso 0 dist 7.20574 5.74635 6.85302 12.7155 7.55358 9.97575 18.5854 13.0197 16.9992 7.24795 numMergedOcc 0
39 mol 186 unq 1 iso 1 dist 6.85302 5.74635 7.20574 9.97575 7.55358 12.7155 16.9992 13.0197 18.5854 7.24795 numMergedOcc 0
40 mol 186 unq 2 iso 0 dist 7.20574 5.74635 6.85302 12.7155 7.55358 9.97575 10.7914 4.37002 9.09754 8.64409 numMergedOcc 0
41 mol 186 unq 2 iso 1 dist 6.85302 5.74635 7.20574 9.97575 7.55358 12.7155 9.09754 4.37002 10.7914 8.64409 numMergedOcc 0
42 mol 186 unq 3 iso 0 dist 7.20574 5.74635 6.85302 12.7155 7.55358 9.97575 16.7729 9.72941 14.1487 7.60202 numMergedOcc 0
43 mol 186 unq 3 iso 1 dist 6.85302 5.74635 7.20574 9.97575 7.55358 12.7155 14.1487 9.72941 16.7729 7.60202 numMergedOcc 0
44 mol 186 unq 4 iso 0 dist 9.56197 9.41955 7.24795 9.27818 7.55358 13.0197 16.1971 12.7155 18.5854 7.20574 numMergedOcc 0
45 mol 186 unq 4 iso 1 dist 7.24795 9.41955 9.56197 13.0197 7.55358 9.27818 18.5854 12.7155 16.1971 7.20574 numMergedOcc 0
46 mol 186 unq 5 iso 0 dist 9.56197 9.41955 7.24795 9.27818 7.55358 13.0197 15.6447 9.97575 16.9992 6.85302 numMergedOcc 0
47 mol 186 unq 5 iso 1 dist 7.24795 9.41955 9.56197 13.0197 7.55358 9.27818 16.9992 9.97575 15.6447 6.85302 numMergedOcc 0
48 mol 186 unq 6 iso 0 dist 9.56197 9.41955 7.24795 9.55926 7.60991 12.9082 15.6447 9.97575 16.9992 9.98215 numMergedOcc 0
49 mol 186 unq 6 iso 1 dist 7.24795 9.41955 9.56197 12.9082 7.60991 9.55926 16.9992 9.97575 15.6447 9.98215 numMergedOcc 0
50 mol 186 unq 7 iso 0 dist 9.56197 8.04815 8.64409 9.27818 7.55358 4.37002 16.1971 12.7155 10.7914 7.20574 numMergedOcc 0
51 mol 186 unq 7 iso 1 dist 8.64409 8.04815 9.56197 4.37002 7.55358 9.27818 10.7914 12.7155 16.1971 7.20574 numMergedOcc 0
52 mol 186 unq 8 iso 0 dist 9.56197 8.04815 8.64409 9.27818 7.55358 4.37002 15.6447 9.97575 9.09754 6.85302 numMergedOcc 0
53 mol 186 unq 8 iso 1 dist 8.64409 8.04815 9.56197 4.37002 7.55358 9.27818 9.09754 9.97575 15.6447 6.85302 numMergedOcc 0
54 mol 186 unq 9 iso 0 dist 9.56197 8.04815 8.64409 9.55926 7.60991 4.64235 15.6447 9.97575 9.09754 9.98215 numMergedOcc 0
55 mol 186 unq 9 iso 1 dist 8.64409 8.04815 9.56197 4.64235 7.60991 9.55926 9.09754 9.97575 15.6447 9.98215 numMergedOcc 0
56 mol 186 unq 10 iso 0 dist 9.56197 5.92513 7.60202 9.27818 7.55358 9.72941 16.1971 12.7155 16.7729 7.20574 numMergedOcc 0
57 mol 186 unq 10 iso 1 dist 7.60202 5.92513 9.56197 9.72941 7.55358 9.27818 16.7729 12.7155 16.1971 7.20574 numMergedOcc 0
58 mol 186 unq 11 iso 0 dist 9.56197 5.92513 7.60202 9.27818 7.55358 9.72941 15.6447 9.97575 14.1487 6.85302 numMergedOcc 0
59 mol 186 unq 11 iso 1 dist 7.60202 5.92513 9.56197 9.72941 7.55358 9.27818 14.1487 9.97575 15.6447 6.85302 numMergedOcc 0
60 mol 186 unq 12 iso 0 dist 9.56197 5.92513 7.60202 9.55926 7.60991 5.39885 15.6447 9.97575 14.1487 9.98215 numMergedOcc 0
61 mol 186 unq 12 iso 1 dist 7.60202 5.92513 9.56197 5.39885 7.60991 9.55926 14.1487 9.97575 15.6447 9.98215 numMergedOcc 0
62 mol 186 unq 7 iso 0 dist 7.24795 13.684 8.64409 13.0197 7.55358 4.37002 18.5854 12.7155 10.7914 7.20574 numMergedOcc 0
63 mol 186 unq 7 iso 1 dist 8.64409 13.684 7.24795 4.37002 7.55358 13.0197 10.7914 12.7155 18.5854 7.20574 numMergedOcc 0
64 mol 186 unq 8 iso 0 dist 7.24795 13.684 8.64409 13.0197 7.55358 4.37002 16.9992 9.97575 9.09754 6.85302 numMergedOcc 0
65 mol 186 unq 8 iso 1 dist 8.64409 13.684 7.24795 4.37002 7.55358 13.0197 9.09754 9.97575 16.9992 6.85302 numMergedOcc 0
66 mol 186 unq 9 iso 0 dist 7.24795 13.684 8.64409 12.9082 7.60991 4.64235 16.9992 9.97575 9.09754 9.98215 numMergedOcc 0
67 mol 186 unq 9 iso 1 dist 8.64409 13.684 7.24795 4.64235 7.60991 12.9082 9.09754 9.97575 16.9992 9.98215 numMergedOcc 0
68 mol 186 unq 10 iso 0 dist 7.24795 9.45987 7.60202 13.0197 7.55358 9.72941 18.5854 12.7155 16.7729 7.20574 numMergedOcc 0
69 mol 186 unq 10 iso 1 dist 7.60202 9.45987 7.24795 9.72941 7.55358 13.0197 16.7729 12.7155 18.5854 7.20574 numMergedOcc 0
70 mol 186 unq 11 iso 0 dist 7.24795 9.45987 7.60202 13.0197 7.55358 9.72941 16.9992 9.97575 14.1487 6.85302 numMergedOcc 0
71 mol 186 unq 11 iso 1 dist 7.60202 9.45987 7.24795 9.72941 7.55358 13.0197 14.1487 9.97575 16.9992 6.85302 numMergedOcc 0
72 mol 186 unq 12 iso 0 dist 7.24795 9.45987 7.60202 12.9082 7.60991 5.39885 16.9992 9.97575 14.1487 9.98215 numMergedOcc 0
73 mol 186 unq 12 iso 1 dist 7.60202 9.45987 7.24795 5.39885 7.60991 12.9082 14.1487 9.97575 16.9992 9.98215 numMergedOcc 0
74 mol 186 unq 10 iso 0 dist 8.64409 7.18269 7.60202 4.37002 7.55358 9.72941 10.7914 12.7155 16.7729 7.20574 numMergedOcc 0
75 mol 186 unq 10 iso 1 dist 7.60202 7.18269 8.64409 9.72941 7.55358 4.37002 16.7729 12.7155 10.7914 7.20574 numMergedOcc 0
76 mol 186 unq 11 iso 0 dist 8.64409 7.18269 7.60202 4.37002 7.55358 9.72941 9.09754 9.97575 14.1487 6.85302 numMergedOcc 0
77 mol 186 unq 11 iso 1 dist 7.60202 7.18269 8.64409 9.72941 7.55358 4.37002 14.1487 9.97575 9.09754 6.85302 numMergedOcc 0
78 mol 186 unq 12 iso 0 dist 8.64409 7.18269 7.60202 4.64235 7.60991 5.39885 9.09754 9.97575 14.1487 9.98215 numMergedOcc 0
79 mol 186 unq 12 iso 1 dist 7.60202 7.18269 8.64409 5.39885 7.60991 4.64235 14.1487 9.97575 9.09754 9.98215 numMergedOcc 0
80 mol 227 unq 0 iso 0 dist 8.38865 5.22356 5.4694 10.5813 9.56257 7.22396 7.22101 11.0628 8.65997 8.03442 numMergedOcc 0
81 mol 227 unq 0 iso 1 dist 5.4694 5.22356 8.38865 7.22396 9.56257 10.5813 8.65997 11.0628 7.22101 8.03442 numMergedOcc 0
82 mol 238 unq 0 iso 0 dist 6.66971 5.40359 6.4398 10.7508 9.89583 5.87253 13.6591 14.1055 10.0419 5.52379 numMergedOcc 0
83 mol 238 unq 0 iso 1 dist 6.4398 5.40359 6.66971 5.87253 9.89583 10.7508 10.0419 14.1055 13.6591 5.52379 numMergedOcc 0
84 mol 238 unq 1 iso 0 dist 6.66971 10.0191 7.32982 10.7508 9.89583 10.7551 13.6591 14.1055 12.2442 5.52379 numMergedOcc 0
85 mol 238 unq 1 iso 1 dist 7.32982 10.0191 6.66971 10.7551 9.89583 10.7508 12.2442 14.1055 13.6591 5.52379 numMergedOcc 0
86 mol 238 unq 1 iso 0 dist 6.4398 10.1648 7.32982 5.87253 9.89583 10.7551 10.0419 14.1055 12.2442 5.52379 numMergedOcc 0
87 mol 238 unq 1 iso 1 dist 7.32982 10.1648 6.4398 10.7551 9.89583 5.87253 12.2442 14.1055 10.0419 5.52379 numMergedOcc 0
88 mol 252 unq 0 iso 0 dist 6.53679 6.0987 7.50201 6.28227 8.55481 5.25252 10.5136 7.63376 7.19638 6.86945 numMergedOcc 0
89 mol 252 unq 0 iso 1 dist 7.50201 6.0987 6.53679 5.25252 8.55481 6.28227 7.19638 7.63376 10.5136 6.86945 numMergedOcc 0
90 mol 258 unq 0 iso 0 dist 6.70815 7.26417 7.99477 6.6525 6.47194 5.27959 6.60405 7.42673 6.42289 9.53063 numMergedOcc 0
91 mol 258 unq 0 iso 1 dist 7.99477 7.26417 6.70815 5.27959 6.47194 6.6525 6.42289 7.42673 6.60405 9.53063 numMergedOcc 0
92 mol 264 unq 0 iso 0 dist 7.52281 8.96144 6.42588 4.48907 5.74568 10.1591 10.4298 6.84156 12.864 6.04162 numMergedOcc 0
93 mol 264 unq 0 iso 1 dist 6.42588 8.96144 7.52281 10.1591 5.74568 4.48907 12.864 6.84156 10.4298 6.04162 numMergedOcc 0
94 mol 264 unq 1 iso 0 dist 7.52281 8.96144 6.42588 4.48907 5.74568 10.1591 9.90113 9.37297 13.9815 6.14323 numMergedOcc 0
95 mol 264 unq 1 iso 1 dist 6.42588 8.96144 7.52281 10.1591 5.74568 4.48907 13.9815 9.37297 9.90113 6.14323 numMergedOcc 0
96 mol 264 unq 2 iso 0 dist 6.04162 4.92077 6.14323 6.84156 5.74568 9.37297 10.4298 4.48907 9.90113 7.52281 numMergedOcc 0
97 mol 264 unq 2 iso 1 dist 6.14323 4.92077 6.04162 9.37297 5.74568 6.84156 9.90113 4.48907 10.4298 7.52281 numMergedOcc 0
98 mol 264 unq 3 iso 0 dist 6.04162 4.92077 6.14323 6.84156 5.74568 9.37297 12.864 10.1591 13.9815 6.42588 numMergedOcc 0
99 mol 264 unq 3 iso 1 dist 6.14323 4.92077 6.04162 9.37297 5.74568 6.84156 13.9815 10.1591 12.864 6.42588 numMergedOcc 0
