0 mol 8 unq 0 iso 0 dist 6.82379 6.94408 6.24978 13.7792 8.94096 10.6893 5.7531 7.12263 4.88215 14.5611 numMergedOcc 0
1 mol 8 unq 0 iso 1 dist 6.24978 6.94408 6.82379 10.6893 8.94096 13.7792 4.88215 7.12263 5.7531 14.5611 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 6.82379 6.94408 6.24978 13.7792 8.94096 10.6893 11.0223 5.00267 6.80407 6.69972 numMergedOcc 0
3 mol 8 unq 1 iso 1 dist 6.24978 6.94408 6.82379 10.6893 8.94096 13.7792 6.80407 5.00267 11.0223 6.69972 numMergedOcc 0
4 mol 8 unq 2 iso 0 dist 6.82379 6.94408 6.24978 15.4959 9.07858 12.0818 5.7531 7.12263 4.88215 12.9762 numMergedOcc 0
5 mol 8 unq 2 iso 1 dist 6.24978 6.94408 6.82379 12.0818 9.07858 15.4959 4.88215 7.12263 5.7531 12.9762 numMergedOcc 0
6 mol 8 unq 3 iso 0 dist 6.82379 6.94408 6.24978 15.4959 9.07858 12.0818 11.0223 5.00267 6.80407 6.3125 numMergedOcc 0
7 mol 8 unq 3 iso 1 dist 6.24978 6.94408 6.82379 12.0818 9.07858 15.4959 6.80407 5.00267 11.0223 6.3125 numMergedOcc 0
8 mol 8 unq 4 iso 0 dist 6.82379 11.2508 9.66439 13.7792 8.94096 13.8882 5.7531 7.12263 6.36434 14.5611 numMergedOcc 0
9 mol 8 unq 4 iso 1 dist 9.66439 11.2508 6.82379 13.8882 8.94096 13.7792 6.36434 7.12263 5.7531 14.5611 numMergedOcc 0
10 mol 8 unq 5 iso 0 dist 6.82379 11.2508 9.66439 13.7792 8.94096 13.8882 11.0223 5.00267 8.44094 6.69972 numMergedOcc 0
11 mol 8 unq 5 iso 1 dist 9.66439 11.2508 6.82379 13.8882 8.94096 13.7792 8.44094 5.00267 11.0223 6.69972 numMergedOcc 0
12 mol 8 unq 6 iso 0 dist 6.82379 11.2508 9.66439 15.4959 9.07858 11.4738 5.7531 7.12263 6.36434 12.9762 numMergedOcc 0
13 mol 8 unq 6 iso 1 dist 9.66439 11.2508 6.82379 11.4738 9.07858 15.4959 6.36434 7.12263 5.7531 12.9762 numMergedOcc 0
14 mol 8 unq 7 iso 0 dist 6.82379 11.2508 9.66439 15.4959 9.07858 11.4738 11.0223 5.00267 8.44094 6.3125 numMergedOcc 0
15 mol 8 unq 7 iso 1 dist 9.66439 11.2508 6.82379 11.4738 9.07858 15.4959 8.44094 5.00267 11.0223 6.3125 numMergedOcc 0
16 mol 8 unq 8 iso 0 dist 6.82379 12.4076 7.3915 13.7792 8.94096 12.8924 5.7531 7.12263 8.79272 14.5611 numMergedOcc 0
17 mol 8 unq 8 iso 1 dist 7.3915 12.4076 6.82379 12.8924 8.94096 13.7792 8.79272 7.12263 5.7531 14.5611 numMergedOcc 0
18 mol 8 unq 9 iso 0 dist 6.82379 12.4076 7.3915 13.7792 8.94096 12.8924 11.0223 5.00267 6.32152 6.69972 numMergedOcc 0
19 mol 8 unq 9 iso 1 dist 7.3915 12.4076 6.82379 12.8924 8.94096 13.7792 6.32152 5.00267 11.0223 6.69972 numMergedOcc 0
20 mol 8 unq 10 iso 0 dist 6.82379 12.4076 7.3915 15.4959 9.07858 4.85329 5.7531 7.12263 8.79272 12.9762 numMergedOcc 0
21 mol 8 unq 10 iso 1 dist 7.3915 12.4076 6.82379 4.85329 9.07858 15.4959 8.79272 7.12263 5.7531 12.9762 numMergedOcc 0
22 mol 8 unq 11 iso 0 dist 6.82379 12.4076 7.3915 15.4959 9.07858 4.85329 11.0223 5.00267 6.32152 6.3125 numMergedOcc 0
23 mol 8 unq 11 iso 1 dist 7.3915 12.4076 6.82379 4.85329 9.07858 15.4959 6.32152 5.00267 11.0223 6.3125 numMergedOcc 0
24 mol 8 unq 4 iso 0 dist 6.24978 5.3787 9.66439 10.6893 8.94096 13.8882 4.88215 7.12263 6.36434 14.5611 numMergedOcc 0
25 mol 8 unq 4 iso 1 dist 9.66439 5.3787 6.24978 13.8882 8.94096 10.6893 6.36434 7.12263 4.88215 14.5611 numMergedOcc 0
26 mol 8 unq 5 iso 0 dist 6.24978 5.3787 9.66439 10.6893 8.94096 13.8882 6.80407 5.00267 8.44094 6.69972 numMergedOcc 0
27 mol 8 unq 5 iso 1 dist 9.66439 5.3787 6.24978 13.8882 8.94096 10.6893 8.44094 5.00267 6.80407 6.69972 numMergedOcc 0
28 mol 8 unq 6 iso 0 dist 6.24978 5.3787 9.66439 12.0818 9.07858 11.4738 4.88215 7.12263 6.36434 12.9762 numMergedOcc 0
29 mol 8 unq 6 iso 1 dist 9.66439 5.3787 6.24978 11.4738 9.07858 12.0818 6.36434 7.12263 4.88215 12.9762 numMergedOcc 0
30 mol 8 unq 7 iso 0 dist 6.24978 5.3787 9.66439 12.0818 9.07858 11.4738 6.80407 5.00267 8.44094 6.3125 numMergedOcc 0
31 mol 8 unq 7 iso 1 dist 9.66439 5.3787 6.24978 11.4738 9.07858 12.0818 8.44094 5.00267 6.80407 6.3125 numMergedOcc 0
32 mol 8 unq 8 iso 0 dist 6.24978 9.22548 7.3915 10.6893 8.94096 12.8924 4.88215 7.12263 8.79272 14.5611 numMergedOcc 0
33 mol 8 unq 8 iso 1 dist 7.3915 9.22548 6.24978 12.8924 8.94096 10.6893 8.79272 7.12263 4.88215 14.5611 numMergedOcc 0
34 mol 8 unq 9 iso 0 dist 6.24978 9.22548 7.3915 10.6893 8.94096 12.8924 6.80407 5.00267 6.32152 6.69972 numMergedOcc 0
35 mol 8 unq 9 iso 1 dist 7.3915 9.22548 6.24978 12.8924 8.94096 10.6893 6.32152 5.00267 6.80407 6.69972 numMergedOcc 0
36 mol 8 unq 10 iso 0 dist 6.24978 9.22548 7.3915 12.0818 9.07858 4.85329 4.88215 7.12263 8.79272 12.9762 numMergedOcc 0
37 mol 8 unq 10 iso 1 dist 7.3915 9.22548 6.24978 4.85329 9.07858 12.0818 8.79272 7.12263 4.88215 12.9762 numMergedOcc 0
38 mol 8 unq 11 iso 0 dist 6.24978 9.22548 7.3915 12.0818 9.07858 4.85329 6.80407 5.00267 6.32152 6.3125 numMergedOcc 0
39 mol 8 unq 11 iso 1 dist 7.3915 9.22548 6.24978 4.85329 9.07858 12.0818 6.32152 5.00267 6.80407 6.3125 numMergedOcc 0
40 mol 8 unq 8 iso 0 dist 9.66439 7.96511 7.3915 13.8882 8.94096 12.8924 6.36434 7.12263 8.79272 14.5611 numMergedOcc 0
41 mol 8 unq 8 iso 1 dist 7.3915 7.96511 9.66439 12.8924 8.94096 13.8882 8.79272 7.12263 6.36434 14.5611 numMergedOcc 0
42 mol 8 unq 9 iso 0 dist 9.66439 7.96511 7.3915 13.8882 8.94096 12.8924 8.44094 5.00267 6.32152 6.69972 numMergedOcc 0
43 mol 8 unq 9 iso 1 dist 7.3915 7.96511 9.66439 12.8924 8.94096 13.8882 6.32152 5.00267 8.44094 6.69972 numMergedOcc 0
44 mol 8 unq 10 iso 0 dist 9.66439 7.96511 7.3915 11.4738 9.07858 4.85329 6.36434 7.12263 8.79272 12.9762 numMergedOcc 0
45 mol 8 unq 10 iso 1 dist 7.3915 7.96511 9.66439 4.85329 9.07858 11.4738 8.79272 7.12263 6.36434 12.9762 numMergedOcc 0
46 mol 8 unq 11 iso 0 dist 9.66439 7.96511 7.3915 11.4738 9.07858 4.85329 8.44094 5.00267 6.32152 6.3125 numMergedOcc 0
47 mol 8 unq 11 iso 1 dist 7.3915 7.96511 9.66439 4.85329 9.07858 11.4738 6.32152 5.00267 8.44094 6.3125 numMergedOcc 0
48 mol 13 unq 0 iso 0 dist 5.78148 5.94592 6.26071 13.1699 8.00865 10.5634 10.9884 9.10587 7.39275 7.65383 numMergedOcc 0
49 mol 13 unq 0 iso 1 dist 6.26071 5.94592 5.78148 10.5634 8.00865 13.1699 7.39275 9.10587 10.9884 7.65383 numMergedOcc 0
50 mol 13 unq 1 iso 0 dist 5.78148 5.94592 6.26071 11.1987 9.11447 12.0488 10.9884 9.10587 7.39275 8.58799 numMergedOcc 0
51 mol 13 unq 1 iso 1 dist 6.26071 5.94592 5.78148 12.0488 9.11447 11.1987 7.39275 9.10587 10.9884 8.58799 numMergedOcc 0
52 mol 13 unq 2 iso 0 dist 5.78148 10.8906 8.43325 13.1699 8.00865 8.66829 10.9884 9.10587 7.82977 7.65383 numMergedOcc 0
53 mol 13 unq 2 iso 1 dist 8.43325 10.8906 5.78148 8.66829 8.00865 13.1699 7.82977 9.10587 10.9884 7.65383 numMergedOcc 0
54 mol 13 unq 3 iso 0 dist 5.78148 10.8906 8.43325 11.1987 9.11447 14.2112 10.9884 9.10587 7.82977 8.58799 numMergedOcc 0
55 mol 13 unq 3 iso 1 dist 8.43325 10.8906 5.78148 14.2112 9.11447 11.1987 7.82977 9.10587 10.9884 8.58799 numMergedOcc 0
56 mol 13 unq 2 iso 0 dist 6.26071 5.43688 8.43325 10.5634 8.00865 8.66829 7.39275 9.10587 7.82977 7.65383 numMergedOcc 0
57 mol 13 unq 2 iso 1 dist 8.43325 5.43688 6.26071 8.66829 8.00865 10.5634 7.82977 9.10587 7.39275 7.65383 numMergedOcc 0
58 mol 13 unq 3 iso 0 dist 6.26071 5.43688 8.43325 12.0488 9.11447 14.2112 7.39275 9.10587 7.82977 8.58799 numMergedOcc 0
59 mol 13 unq 3 iso 1 dist 8.43325 5.43688 6.26071 14.2112 9.11447 12.0488 7.82977 9.10587 7.39275 8.58799 numMergedOcc 0
60 mol 24 unq 0 iso 0 dist 6.60423 7.05502 7.83786 5.39241 8.62284 4.51549 6.58998 9.38831 11.0493 11.3767 numMergedOcc 0
61 mol 24 unq 0 iso 1 dist 7.83786 7.05502 6.60423 4.51549 8.62284 5.39241 11.0493 9.38831 6.58998 11.3767 numMergedOcc 0
62 mol 93 unq 0 iso 0 dist 9.81831 6.30447 9.12858 8.58164 7.85041 9.67788 11.6865 5.51624 7.64463 9.97157 numMergedOcc 0
63 mol 93 unq 0 iso 1 dist 9.12858 6.30447 9.81831 9.67788 7.85041 8.58164 7.64463 5.51624 11.6865 9.97157 numMergedOcc 0
64 mol 93 unq 1 iso 0 dist 9.81831 6.30447 9.12858 8.58164 7.85041 9.67788 12.2598 7.8674 14.8533 8.01991 numMergedOcc 0
65 mol 93 unq 1 iso 1 dist 9.12858 6.30447 9.81831 9.67788 7.85041 8.58164 14.8533 7.8674 12.2598 8.01991 numMergedOcc 0
66 mol 93 unq 2 iso 0 dist 9.81831 9.91939 9.4523 8.58164 7.85041 5.33106 11.6865 5.51624 8.29171 9.97157 numMergedOcc 0
67 mol 93 unq 2 iso 1 dist 9.4523 9.91939 9.81831 5.33106 7.85041 8.58164 8.29171 5.51624 11.6865 9.97157 numMergedOcc 0
68 mol 93 unq 3 iso 0 dist 9.81831 9.91939 9.4523 8.58164 7.85041 5.33106 12.2598 7.8674 12.7936 8.01991 numMergedOcc 0
69 mol 93 unq 3 iso 1 dist 9.4523 9.91939 9.81831 5.33106 7.85041 8.58164 12.7936 7.8674 12.2598 8.01991 numMergedOcc 0
70 mol 93 unq 2 iso 0 dist 9.12858 7.66728 9.4523 9.67788 7.85041 5.33106 7.64463 5.51624 8.29171 9.97157 numMergedOcc 0
71 mol 93 unq 2 iso 1 dist 9.4523 7.66728 9.12858 5.33106 7.85041 9.67788 8.29171 5.51624 7.64463 9.97157 numMergedOcc 0
72 mol 93 unq 3 iso 0 dist 9.12858 7.66728 9.4523 9.67788 7.85041 5.33106 14.8533 7.8674 12.7936 8.01991 numMergedOcc 0
73 mol 93 unq 3 iso 1 dist 9.4523 7.66728 9.12858 5.33106 7.85041 9.67788 12.7936 7.8674 14.8533 8.01991 numMergedOcc 0
74 mol 119 unq 0 iso 0 dist 7.99857 4.85907 8.56342 6.35763 9.87025 10.0197 4.99056 8.03035 3.78311 11.1324 numMergedOcc 0
75 mol 119 unq 0 iso 1 dist 8.56342 4.85907 7.99857 10.0197 9.87025 6.35763 3.78311 8.03035 4.99056 11.1324 numMergedOcc 0
76 mol 119 unq 1 iso 0 dist 7.99857 4.85907 8.56342 7.36192 5.85818 10.6679 4.99056 8.03035 3.78311 8.96522 numMergedOcc 0
77 mol 119 unq 1 iso 1 dist 8.56342 4.85907 7.99857 10.6679 5.85818 7.36192 3.78311 8.03035 4.99056 8.96522 numMergedOcc 0
78 mol 131 unq 0 iso 0 dist 9.15431 7.58238 6.92648 7.71288 9.39683 4.89973 7.21005 7.76594 11.5688 12.4067 numMergedOcc 0
79 mol 131 unq 0 iso 1 dist 6.92648 7.58238 9.15431 4.89973 9.39683 7.71288 11.5688 7.76594 7.21005 12.4067 numMergedOcc 0
80 mol 131 unq 1 iso 0 dist 9.15431 13.2572 9.29384 7.71288 9.39683 7.00551 7.21005 7.76594 15.7796 12.4067 numMergedOcc 0
81 mol 131 unq 1 iso 1 dist 9.29384 13.2572 9.15431 7.00551 9.39683 7.71288 15.7796 7.76594 7.21005 12.4067 numMergedOcc 0
82 mol 131 unq 1 iso 0 dist 6.92648 6.63273 9.29384 4.89973 9.39683 7.00551 11.5688 7.76594 15.7796 12.4067 numMergedOcc 0
83 mol 131 unq 1 iso 1 dist 9.29384 6.63273 6.92648 7.00551 9.39683 4.89973 15.7796 7.76594 11.5688 12.4067 numMergedOcc 0
84 mol 147 unq 0 iso 0 dist 5.49226 7.15222 6.28351 5.08802 5.1101 8.59354 9.02993 9.23528 14.4247 6.29593 numMergedOcc 0
85 mol 147 unq 0 iso 1 dist 6.28351 7.15222 5.49226 8.59354 5.1101 5.08802 14.4247 9.23528 9.02993 6.29593 numMergedOcc 0
86 mol 147 unq 1 iso 0 dist 5.49226 7.15222 6.28351 10.1972 7.01133 8.54341 9.02993 9.23528 14.4247 11.2831 numMergedOcc 0
87 mol 147 unq 1 iso 1 dist 6.28351 7.15222 5.49226 8.54341 7.01133 10.1972 14.4247 9.23528 9.02993 11.2831 numMergedOcc 0
88 mol 156 unq 0 iso 0 dist 9.31851 7.14831 6.2319 10.5873 9.54367 13.2847 10.7975 4.9941 5.71107 14.2138 numMergedOcc 0
89 mol 156 unq 0 iso 1 dist 6.2319 7.14831 9.31851 13.2847 9.54367 10.5873 5.71107 4.9941 10.7975 14.2138 numMergedOcc 0
90 mol 156 unq 1 iso 0 dist 9.31851 7.14831 6.2319 10.5873 9.54367 13.2847 13.6634 8.06913 10.7023 10.5496 numMergedOcc 0
91 mol 156 unq 1 iso 1 dist 6.2319 7.14831 9.31851 13.2847 9.54367 10.5873 10.7023 8.06913 13.6634 10.5496 numMergedOcc 0
92 mol 156 unq 2 iso 0 dist 9.31851 7.14831 6.2319 4.73711 7.26859 5.97294 10.7975 4.9941 5.71107 10.1294 numMergedOcc 0
93 mol 156 unq 2 iso 1 dist 6.2319 7.14831 9.31851 5.97294 7.26859 4.73711 5.71107 4.9941 10.7975 10.1294 numMergedOcc 0
94 mol 156 unq 3 iso 0 dist 9.31851 7.14831 6.2319 4.73711 7.26859 5.97294 13.6634 8.06913 10.7023 9.19336 numMergedOcc 0
95 mol 156 unq 3 iso 1 dist 6.2319 7.14831 9.31851 5.97294 7.26859 4.73711 10.7023 8.06913 13.6634 9.19336 numMergedOcc 0
96 mol 156 unq 4 iso 0 dist 9.31851 9.98789 9.97732 10.5873 9.54367 14.42 10.7975 4.9941 11.2067 14.2138 numMergedOcc 0
97 mol 156 unq 4 iso 1 dist 9.97732 9.98789 9.31851 14.42 9.54367 10.5873 11.2067 4.9941 10.7975 14.2138 numMergedOcc 0
98 mol 156 unq 5 iso 0 dist 9.31851 9.98789 9.97732 10.5873 9.54367 14.42 13.6634 8.06913 9.00862 10.5496 numMergedOcc 0
99 mol 156 unq 5 iso 1 dist 9.97732 9.98789 9.31851 14.42 9.54367 10.5873 9.00862 8.06913 13.6634 10.5496 numMergedOcc 0
100 mol 156 unq 6 iso 0 dist 9.31851 9.98789 9.97732 4.73711 7.26859 6.53729 10.7975 4.9941 11.2067 10.1294 numMergedOcc 0
101 mol 156 unq 6 iso 1 dist 9.97732 9.98789 9.31851 6.53729 7.26859 4.73711 11.2067 4.9941 10.7975 10.1294 numMergedOcc 0
102 mol 156 unq 7 iso 0 dist 9.31851 9.98789 9.97732 4.73711 7.26859 6.53729 13.6634 8.06913 9.00862 9.19336 numMergedOcc 0
103 mol 156 unq 7 iso 1 dist 9.97732 9.98789 9.31851 6.53729 7.26859 4.73711 9.00862 8.06913 13.6634 9.19336 numMergedOcc 0
104 mol 156 unq 4 iso 0 dist 6.2319 6.31306 9.97732 13.2847 9.54367 14.42 5.71107 4.9941 11.2067 14.2138 numMergedOcc 0
105 mol 156 unq 4 iso 1 dist 9.97732 6.31306 6.2319 14.42 9.54367 13.2847 11.2067 4.9941 5.71107 14.2138 numMergedOcc 0
106 mol 156 unq 5 iso 0 dist 6.2319 6.31306 9.97732 13.2847 9.54367 14.42 10.7023 8.06913 9.00862 10.5496 numMergedOcc 0
107 mol 156 unq 5 iso 1 dist 9.97732 6.31306 6.2319 14.42 9.54367 13.2847 9.00862 8.06913 10.7023 10.5496 numMergedOcc 0
108 mol 156 unq 6 iso 0 dist 6.2319 6.31306 9.97732 5.97294 7.26859 6.53729 5.71107 4.9941 11.2067 10.1294 numMergedOcc 0
109 mol 156 unq 6 iso 1 dist 9.97732 6.31306 6.2319 6.53729 7.26859 5.97294 11.2067 4.9941 5.71107 10.1294 numMergedOcc 0
110 mol 156 unq 7 iso 0 dist 6.2319 6.31306 9.97732 5.97294 7.26859 6.53729 10.7023 8.06913 9.00862 9.19336 numMergedOcc 0
111 mol 156 unq 7 iso 1 dist 9.97732 6.31306 6.2319 6.53729 7.26859 5.97294 9.00862 8.06913 10.7023 9.19336 numMergedOcc 0
112 mol 171 unq 0 iso 0 dist 7.71426 7.31409 5.10618 8.08908 5.73148 6.05805 4.44751 7.82546 9.61561 7.48646 numMergedOcc 0
113 mol 171 unq 0 iso 1 dist 5.10618 7.31409 7.71426 6.05805 5.73148 8.08908 9.61561 7.82546 4.44751 7.48646 numMergedOcc 0
114 mol 171 unq 1 iso 0 dist 7.71426 13.6814 9.86681 8.08908 5.73148 8.83561 4.44751 7.82546 10.2067 7.48646 numMergedOcc 0
115 mol 171 unq 1 iso 1 dist 9.86681 13.6814 7.71426 8.83561 5.73148 8.08908 10.2067 7.82546 4.44751 7.48646 numMergedOcc 0
116 mol 171 unq 1 iso 0 dist 5.10618 13.7214 9.86681 6.05805 5.73148 8.83561 9.61561 7.82546 10.2067 7.48646 numMergedOcc 0
117 mol 171 unq 1 iso 1 dist 9.86681 13.7214 5.10618 8.83561 5.73148 6.05805 10.2067 7.82546 9.61561 7.48646 numMergedOcc 0
118 mol 194 unq 0 iso 0 dist 6.26839 8.0179 8.12346 15.9311 9.77862 13.7758 6.66155 5.52678 6.12973 12.0339 numMergedOcc 0
119 mol 194 unq 0 iso 1 dist 8.12346 8.0179 6.26839 13.7758 9.77862 15.9311 6.12973 5.52678 6.66155 12.0339 numMergedOcc 0
120 mol 194 unq 1 iso 0 dist 6.26839 8.0179 8.12346 15.9311 9.77862 13.7758 5.4499 9.81666 11.0239 18.7006 numMergedOcc 0
121 mol 194 unq 1 iso 1 dist 8.12346 8.0179 6.26839 13.7758 9.77862 15.9311 11.0239 9.81666 5.4499 18.7006 numMergedOcc 0
122 mol 194 unq 2 iso 0 dist 6.26839 14.6506 8.83356 15.9311 9.77862 5.38925 6.66155 5.52678 13.0333 12.0339 numMergedOcc 0
123 mol 194 unq 2 iso 1 dist 8.83356 14.6506 6.26839 5.38925 9.77862 15.9311 13.0333 5.52678 6.66155 12.0339 numMergedOcc 0
124 mol 194 unq 3 iso 0 dist 6.26839 14.6506 8.83356 15.9311 9.77862 5.38925 5.4499 9.81666 18.6469 18.7006 numMergedOcc 0
125 mol 194 unq 3 iso 1 dist 8.83356 14.6506 6.26839 5.38925 9.77862 15.9311 18.6469 9.81666 5.4499 18.7006 numMergedOcc 0
126 mol 194 unq 4 iso 0 dist 6.26839 8.48054 8.2654 15.9311 9.77862 14.2415 6.66155 5.52678 10.1796 12.0339 numMergedOcc 0
127 mol 194 unq 4 iso 1 dist 8.2654 8.48054 6.26839 14.2415 9.77862 15.9311 10.1796 5.52678 6.66155 12.0339 numMergedOcc 0
128 mol 194 unq 5 iso 0 dist 6.26839 8.48054 8.2654 15.9311 9.77862 14.2415 5.4499 9.81666 13.5457 18.7006 numMergedOcc 0
129 mol 194 unq 5 iso 1 dist 8.2654 8.48054 6.26839 14.2415 9.77862 15.9311 13.5457 9.81666 5.4499 18.7006 numMergedOcc 0
130 mol 194 unq 2 iso 0 dist 8.12346 13.5632 8.83356 13.7758 9.77862 5.38925 6.12973 5.52678 13.0333 12.0339 numMergedOcc 0
131 mol 194 unq 2 iso 1 dist 8.83356 13.5632 8.12346 5.38925 9.77862 13.7758 13.0333 5.52678 6.12973 12.0339 numMergedOcc 0
132 mol 194 unq 3 iso 0 dist 8.12346 13.5632 8.83356 13.7758 9.77862 5.38925 11.0239 9.81666 18.6469 18.7006 numMergedOcc 0
133 mol 194 unq 3 iso 1 dist 8.83356 13.5632 8.12346 5.38925 9.77862 13.7758 18.6469 9.81666 11.0239 18.7006 numMergedOcc 0
134 mol 194 unq 4 iso 0 dist 8.12346 6.26298 8.2654 13.7758 9.77862 14.2415 6.12973 5.52678 10.1796 12.0339 numMergedOcc 0
135 mol 194 unq 4 iso 1 dist 8.2654 6.26298 8.12346 14.2415 9.77862 13.7758 10.1796 5.52678 6.12973 12.0339 numMergedOcc 0
136 mol 194 unq 5 iso 0 dist 8.12346 6.26298 8.2654 13.7758 9.77862 14.2415 11.0239 9.81666 13.5457 18.7006 numMergedOcc 0
137 mol 194 unq 5 iso 1 dist 8.2654 6.26298 8.12346 14.2415 9.77862 13.7758 13.5457 9.81666 11.0239 18.7006 numMergedOcc 0
138 mol 194 unq 4 iso 0 dist 8.83356 11.6097 8.2654 5.38925 9.77862 14.2415 13.0333 5.52678 10.1796 12.0339 numMergedOcc 0
139 mol 194 unq 4 iso 1 dist 8.2654 11.6097 8.83356 14.2415 9.77862 5.38925 10.1796 5.52678 13.0333 12.0339 numMergedOcc 0
140 mol 194 unq 5 iso 0 dist 8.83356 11.6097 8.2654 5.38925 9.77862 14.2415 18.6469 9.81666 13.5457 18.7006 numMergedOcc 0
141 mol 194 unq 5 iso 1 dist 8.2654 11.6097 8.83356 14.2415 9.77862 5.38925 13.5457 9.81666 18.6469 18.7006 numMergedOcc 0
142 mol 218 unq 0 iso 0 dist 6.29367 4.72474 5.76954 6.05563 6.86795 9.68444 6.90702 8.93185 10.4526 6.08698 numMergedOcc 0
143 mol 218 unq 0 iso 1 dist 5.76954 4.72474 6.29367 9.68444 6.86795 6.05563 10.4526 8.93185 6.90702 6.08698 numMergedOcc 0
144 mol 218 unq 1 iso 0 dist 6.29367 4.72474 5.76954 8.36122 6.61099 7.47048 6.90702 8.93185 10.4526 13.6339 numMergedOcc 0
145 mol 218 unq 1 iso 1 dist 5.76954 4.72474 6.29367 7.47048 6.61099 8.36122 10.4526 8.93185 6.90702 13.6339 numMergedOcc 0
146 mol 218 unq 2 iso 0 dist 6.29367 6.17651 9.20961 6.05563 6.86795 11.4148 6.90702 8.93185 8.94041 6.08698 numMergedOcc 0
147 mol 218 unq 2 iso 1 dist 9.20961 6.17651 6.29367 11.4148 6.86795 6.05563 8.94041 8.93185 6.90702 6.08698 numMergedOcc 0
148 mol 218 unq 3 iso 0 dist 6.29367 6.17651 9.20961 8.36122 6.61099 12.7963 6.90702 8.93185 8.94041 13.6339 numMergedOcc 0
149 mol 218 unq 3 iso 1 dist 9.20961 6.17651 6.29367 12.7963 6.61099 8.36122 8.94041 8.93185 6.90702 13.6339 numMergedOcc 0
150 mol 218 unq 2 iso 0 dist 5.76954 5.61978 9.20961 9.68444 6.86795 11.4148 10.4526 8.93185 8.94041 6.08698 numMergedOcc 0
151 mol 218 unq 2 iso 1 dist 9.20961 5.61978 5.76954 11.4148 6.86795 9.68444 8.94041 8.93185 10.4526 6.08698 numMergedOcc 0
152 mol 218 unq 3 iso 0 dist 5.76954 5.61978 9.20961 7.47048 6.61099 12.7963 10.4526 8.93185 8.94041 13.6339 numMergedOcc 0
153 mol 218 unq 3 iso 1 dist 9.20961 5.61978 5.76954 12.7963 6.61099 7.47048 8.94041 8.93185 10.4526 13.6339 numMergedOcc 0
154 mol 227 unq 0 iso 0 dist 8.38865 5.22356 5.4694 9.60993 9.20589 5.34702 10.5813 9.56257 7.22396 8.84427 numMergedOcc 0
155 mol 227 unq 0 iso 1 dist 5.4694 5.22356 8.38865 5.34702 9.20589 9.60993 7.22396 9.56257 10.5813 8.84427 numMergedOcc 0
156 mol 227 unq 1 iso 0 dist 8.38865 5.22356 5.4694 13.3557 7.89801 8.8709 10.5813 9.56257 7.22396 5.95112 numMergedOcc 0
157 mol 227 unq 1 iso 1 dist 5.4694 5.22356 8.38865 8.8709 7.89801 13.3557 7.22396 9.56257 10.5813 5.95112 numMergedOcc 0
158 mol 238 unq 0 iso 0 dist 6.66971 5.40359 6.4398 13.0842 9.42618 15.3074 10.7508 9.89583 5.87253 18.0054 numMergedOcc 0
159 mol 238 unq 0 iso 1 dist 6.4398 5.40359 6.66971 15.3074 9.42618 13.0842 5.87253 9.89583 10.7508 18.0054 numMergedOcc 0
160 mol 238 unq 1 iso 0 dist 6.66971 10.0191 7.32982 13.0842 9.42618 8.85181 10.7508 9.89583 10.7551 18.0054 numMergedOcc 0
161 mol 238 unq 1 iso 1 dist 7.32982 10.0191 6.66971 8.85181 9.42618 13.0842 10.7551 9.89583 10.7508 18.0054 numMergedOcc 0
162 mol 238 unq 1 iso 0 dist 6.4398 10.1648 7.32982 15.3074 9.42618 8.85181 5.87253 9.89583 10.7551 18.0054 numMergedOcc 0
163 mol 238 unq 1 iso 1 dist 7.32982 10.1648 6.4398 8.85181 9.42618 15.3074 10.7551 9.89583 5.87253 18.0054 numMergedOcc 0
164 mol 240 unq 0 iso 0 dist 9.47583 4.28414 8.44909 10.7371 8.33853 7.75407 10.6074 9.53915 9.23135 4.4268 numMergedOcc 0
165 mol 240 unq 0 iso 1 dist 8.44909 4.28414 9.47583 7.75407 8.33853 10.7371 9.23135 9.53915 10.6074 4.4268 numMergedOcc 0
166 mol 240 unq 1 iso 0 dist 9.47583 4.28414 8.44909 13.9225 5.66537 12.076 10.6074 9.53915 9.23135 8.76585 numMergedOcc 0
167 mol 240 unq 1 iso 1 dist 8.44909 4.28414 9.47583 12.076 5.66537 13.9225 9.23135 9.53915 10.6074 8.76585 numMergedOcc 0
168 mol 264 unq 0 iso 0 dist 6.04162 4.92077 6.14323 8.16326 9.42738 12.3807 6.84156 5.74568 9.37297 8.79843 numMergedOcc 0
169 mol 264 unq 0 iso 1 dist 6.14323 4.92077 6.04162 12.3807 9.42738 8.16326 9.37297 5.74568 6.84156 8.79843 numMergedOcc 0
