0 mol 8 unq 0 iso 0 dist 6.82379 6.94408 6.24978 11.2508 9.66439 5.3787 5.7531 7.12263 4.88215 6.36434 numMergedOcc 0
1 mol 8 unq 0 iso 1 dist 6.82379 11.2508 9.66439 6.94408 6.24978 5.3787 5.7531 7.12263 6.36434 4.88215 numMergedOcc 0
2 mol 8 unq 0 iso 2 dist 6.24978 6.94408 6.82379 5.3787 9.66439 11.2508 4.88215 7.12263 5.7531 6.36434 numMergedOcc 0
3 mol 8 unq 0 iso 3 dist 6.24978 5.3787 9.66439 6.94408 6.82379 11.2508 4.88215 7.12263 6.36434 5.7531 numMergedOcc 0
4 mol 8 unq 0 iso 4 dist 9.66439 11.2508 6.82379 5.3787 6.24978 6.94408 6.36434 7.12263 5.7531 4.88215 numMergedOcc 0
5 mol 8 unq 0 iso 5 dist 9.66439 5.3787 6.24978 11.2508 6.82379 6.94408 6.36434 7.12263 4.88215 5.7531 numMergedOcc 0
6 mol 8 unq 1 iso 0 dist 6.82379 6.94408 6.24978 11.2508 9.66439 5.3787 11.0223 5.00267 6.80407 8.44094 numMergedOcc 0
7 mol 8 unq 1 iso 1 dist 6.82379 11.2508 9.66439 6.94408 6.24978 5.3787 11.0223 5.00267 8.44094 6.80407 numMergedOcc 0
8 mol 8 unq 1 iso 2 dist 6.24978 6.94408 6.82379 5.3787 9.66439 11.2508 6.80407 5.00267 11.0223 8.44094 numMergedOcc 0
9 mol 8 unq 1 iso 3 dist 6.24978 5.3787 9.66439 6.94408 6.82379 11.2508 6.80407 5.00267 8.44094 11.0223 numMergedOcc 0
10 mol 8 unq 1 iso 4 dist 9.66439 11.2508 6.82379 5.3787 6.24978 6.94408 8.44094 5.00267 11.0223 6.80407 numMergedOcc 0
11 mol 8 unq 1 iso 5 dist 9.66439 5.3787 6.24978 11.2508 6.82379 6.94408 8.44094 5.00267 6.80407 11.0223 numMergedOcc 0
12 mol 8 unq 2 iso 0 dist 6.82379 6.94408 6.24978 12.4076 7.3915 9.22548 5.7531 7.12263 4.88215 8.79272 numMergedOcc 0
13 mol 8 unq 2 iso 1 dist 6.82379 12.4076 7.3915 6.94408 6.24978 9.22548 5.7531 7.12263 8.79272 4.88215 numMergedOcc 0
14 mol 8 unq 2 iso 2 dist 6.24978 6.94408 6.82379 9.22548 7.3915 12.4076 4.88215 7.12263 5.7531 8.79272 numMergedOcc 0
15 mol 8 unq 2 iso 3 dist 6.24978 9.22548 7.3915 6.94408 6.82379 12.4076 4.88215 7.12263 8.79272 5.7531 numMergedOcc 0
16 mol 8 unq 2 iso 4 dist 7.3915 12.4076 6.82379 9.22548 6.24978 6.94408 8.79272 7.12263 5.7531 4.88215 numMergedOcc 0
17 mol 8 unq 2 iso 5 dist 7.3915 9.22548 6.24978 12.4076 6.82379 6.94408 8.79272 7.12263 4.88215 5.7531 numMergedOcc 0
18 mol 8 unq 3 iso 0 dist 6.82379 6.94408 6.24978 12.4076 7.3915 9.22548 11.0223 5.00267 6.80407 6.32152 numMergedOcc 0
19 mol 8 unq 3 iso 1 dist 6.82379 12.4076 7.3915 6.94408 6.24978 9.22548 11.0223 5.00267 6.32152 6.80407 numMergedOcc 0
20 mol 8 unq 3 iso 2 dist 6.24978 6.94408 6.82379 9.22548 7.3915 12.4076 6.80407 5.00267 11.0223 6.32152 numMergedOcc 0
21 mol 8 unq 3 iso 3 dist 6.24978 9.22548 7.3915 6.94408 6.82379 12.4076 6.80407 5.00267 6.32152 11.0223 numMergedOcc 0
22 mol 8 unq 3 iso 4 dist 7.3915 12.4076 6.82379 9.22548 6.24978 6.94408 6.32152 5.00267 11.0223 6.80407 numMergedOcc 0
23 mol 8 unq 3 iso 5 dist 7.3915 9.22548 6.24978 12.4076 6.82379 6.94408 6.32152 5.00267 6.80407 11.0223 numMergedOcc 0
24 mol 8 unq 2 iso 0 dist 6.82379 11.2508 9.66439 12.4076 7.3915 7.96511 5.7531 7.12263 6.36434 8.79272 numMergedOcc 0
25 mol 8 unq 2 iso 1 dist 6.82379 12.4076 7.3915 11.2508 9.66439 7.96511 5.7531 7.12263 8.79272 6.36434 numMergedOcc 0
26 mol 8 unq 2 iso 2 dist 9.66439 11.2508 6.82379 7.96511 7.3915 12.4076 6.36434 7.12263 5.7531 8.79272 numMergedOcc 0
27 mol 8 unq 2 iso 3 dist 9.66439 7.96511 7.3915 11.2508 6.82379 12.4076 6.36434 7.12263 8.79272 5.7531 numMergedOcc 0
28 mol 8 unq 2 iso 4 dist 7.3915 12.4076 6.82379 7.96511 9.66439 11.2508 8.79272 7.12263 5.7531 6.36434 numMergedOcc 0
29 mol 8 unq 2 iso 5 dist 7.3915 7.96511 9.66439 12.4076 6.82379 11.2508 8.79272 7.12263 6.36434 5.7531 numMergedOcc 0
30 mol 8 unq 3 iso 0 dist 6.82379 11.2508 9.66439 12.4076 7.3915 7.96511 11.0223 5.00267 8.44094 6.32152 numMergedOcc 0
31 mol 8 unq 3 iso 1 dist 6.82379 12.4076 7.3915 11.2508 9.66439 7.96511 11.0223 5.00267 6.32152 8.44094 numMergedOcc 0
32 mol 8 unq 3 iso 2 dist 9.66439 11.2508 6.82379 7.96511 7.3915 12.4076 8.44094 5.00267 11.0223 6.32152 numMergedOcc 0
33 mol 8 unq 3 iso 3 dist 9.66439 7.96511 7.3915 11.2508 6.82379 12.4076 8.44094 5.00267 6.32152 11.0223 numMergedOcc 0
34 mol 8 unq 3 iso 4 dist 7.3915 12.4076 6.82379 7.96511 9.66439 11.2508 6.32152 5.00267 11.0223 8.44094 numMergedOcc 0
35 mol 8 unq 3 iso 5 dist 7.3915 7.96511 9.66439 12.4076 6.82379 11.2508 6.32152 5.00267 8.44094 11.0223 numMergedOcc 0
36 mol 8 unq 2 iso 0 dist 6.24978 5.3787 9.66439 9.22548 7.3915 7.96511 4.88215 7.12263 6.36434 8.79272 numMergedOcc 0
37 mol 8 unq 2 iso 1 dist 6.24978 9.22548 7.3915 5.3787 9.66439 7.96511 4.88215 7.12263 8.79272 6.36434 numMergedOcc 0
38 mol 8 unq 2 iso 2 dist 9.66439 5.3787 6.24978 7.96511 7.3915 9.22548 6.36434 7.12263 4.88215 8.79272 numMergedOcc 0
39 mol 8 unq 2 iso 3 dist 9.66439 7.96511 7.3915 5.3787 6.24978 9.22548 6.36434 7.12263 8.79272 4.88215 numMergedOcc 0
40 mol 8 unq 2 iso 4 dist 7.3915 9.22548 6.24978 7.96511 9.66439 5.3787 8.79272 7.12263 4.88215 6.36434 numMergedOcc 0
41 mol 8 unq 2 iso 5 dist 7.3915 7.96511 9.66439 9.22548 6.24978 5.3787 8.79272 7.12263 6.36434 4.88215 numMergedOcc 0
42 mol 8 unq 3 iso 0 dist 6.24978 5.3787 9.66439 9.22548 7.3915 7.96511 6.80407 5.00267 8.44094 6.32152 numMergedOcc 0
43 mol 8 unq 3 iso 1 dist 6.24978 9.22548 7.3915 5.3787 9.66439 7.96511 6.80407 5.00267 6.32152 8.44094 numMergedOcc 0
44 mol 8 unq 3 iso 2 dist 9.66439 5.3787 6.24978 7.96511 7.3915 9.22548 8.44094 5.00267 6.80407 6.32152 numMergedOcc 0
45 mol 8 unq 3 iso 3 dist 9.66439 7.96511 7.3915 5.3787 6.24978 9.22548 8.44094 5.00267 6.32152 6.80407 numMergedOcc 0
46 mol 8 unq 3 iso 4 dist 7.3915 9.22548 6.24978 7.96511 9.66439 5.3787 6.32152 5.00267 6.80407 8.44094 numMergedOcc 0
47 mol 8 unq 3 iso 5 dist 7.3915 7.96511 9.66439 9.22548 6.24978 5.3787 6.32152 5.00267 8.44094 6.80407 numMergedOcc 0
48 mol 13 unq 0 iso 0 dist 5.78148 5.94592 6.26071 10.8906 8.43325 5.43688 10.9884 9.10587 7.39275 7.82977 numMergedOcc 0
49 mol 13 unq 0 iso 1 dist 5.78148 10.8906 8.43325 5.94592 6.26071 5.43688 10.9884 9.10587 7.82977 7.39275 numMergedOcc 0
50 mol 13 unq 0 iso 2 dist 6.26071 5.94592 5.78148 5.43688 8.43325 10.8906 7.39275 9.10587 10.9884 7.82977 numMergedOcc 0
51 mol 13 unq 0 iso 3 dist 6.26071 5.43688 8.43325 5.94592 5.78148 10.8906 7.39275 9.10587 7.82977 10.9884 numMergedOcc 0
52 mol 13 unq 0 iso 4 dist 8.43325 10.8906 5.78148 5.43688 6.26071 5.94592 7.82977 9.10587 10.9884 7.39275 numMergedOcc 0
53 mol 13 unq 0 iso 5 dist 8.43325 5.43688 6.26071 10.8906 5.78148 5.94592 7.82977 9.10587 7.39275 10.9884 numMergedOcc 0
54 mol 19 unq 0 iso 0 dist 7.48847 10.8007 6.92532 10.6598 6.36455 5.03957 8.19436 7.69625 10.3648 6.49317 numMergedOcc 0
55 mol 19 unq 0 iso 1 dist 7.48847 10.6598 6.36455 10.8007 6.92532 5.03957 8.19436 7.69625 6.49317 10.3648 numMergedOcc 0
56 mol 19 unq 0 iso 2 dist 6.92532 10.8007 7.48847 5.03957 6.36455 10.6598 10.3648 7.69625 8.19436 6.49317 numMergedOcc 0
57 mol 19 unq 0 iso 3 dist 6.92532 5.03957 6.36455 10.8007 7.48847 10.6598 10.3648 7.69625 6.49317 8.19436 numMergedOcc 0
58 mol 19 unq 0 iso 4 dist 6.36455 10.6598 7.48847 5.03957 6.92532 10.8007 6.49317 7.69625 8.19436 10.3648 numMergedOcc 0
59 mol 19 unq 0 iso 5 dist 6.36455 5.03957 6.92532 10.6598 7.48847 10.8007 6.49317 7.69625 10.3648 8.19436 numMergedOcc 0
60 mol 93 unq 0 iso 0 dist 9.81831 6.30447 9.12858 9.91939 9.4523 7.66728 11.6865 5.51624 7.64463 8.29171 numMergedOcc 0
61 mol 93 unq 0 iso 1 dist 9.81831 9.91939 9.4523 6.30447 9.12858 7.66728 11.6865 5.51624 8.29171 7.64463 numMergedOcc 0
62 mol 93 unq 0 iso 2 dist 9.12858 6.30447 9.81831 7.66728 9.4523 9.91939 7.64463 5.51624 11.6865 8.29171 numMergedOcc 0
63 mol 93 unq 0 iso 3 dist 9.12858 7.66728 9.4523 6.30447 9.81831 9.91939 7.64463 5.51624 8.29171 11.6865 numMergedOcc 0
64 mol 93 unq 0 iso 4 dist 9.4523 9.91939 9.81831 7.66728 9.12858 6.30447 8.29171 5.51624 11.6865 7.64463 numMergedOcc 0
65 mol 93 unq 0 iso 5 dist 9.4523 7.66728 9.12858 9.91939 9.81831 6.30447 8.29171 5.51624 7.64463 11.6865 numMergedOcc 0
66 mol 93 unq 1 iso 0 dist 9.81831 6.30447 9.12858 9.91939 9.4523 7.66728 12.2598 7.8674 14.8533 12.7936 numMergedOcc 0
67 mol 93 unq 1 iso 1 dist 9.81831 9.91939 9.4523 6.30447 9.12858 7.66728 12.2598 7.8674 12.7936 14.8533 numMergedOcc 0
68 mol 93 unq 1 iso 2 dist 9.12858 6.30447 9.81831 7.66728 9.4523 9.91939 14.8533 7.8674 12.2598 12.7936 numMergedOcc 0
69 mol 93 unq 1 iso 3 dist 9.12858 7.66728 9.4523 6.30447 9.81831 9.91939 14.8533 7.8674 12.7936 12.2598 numMergedOcc 0
70 mol 93 unq 1 iso 4 dist 9.4523 9.91939 9.81831 7.66728 9.12858 6.30447 12.7936 7.8674 12.2598 14.8533 numMergedOcc 0
71 mol 93 unq 1 iso 5 dist 9.4523 7.66728 9.12858 9.91939 9.81831 6.30447 12.7936 7.8674 14.8533 12.2598 numMergedOcc 0
72 mol 98 unq 0 iso 0 dist 5.88354 4.50554 7.89665 7.40461 5.39354 8.49023 10.7735 7.63183 9.38161 10.5878 numMergedOcc 0
73 mol 98 unq 0 iso 1 dist 5.88354 7.40461 5.39354 4.50554 7.89665 8.49023 10.7735 7.63183 10.5878 9.38161 numMergedOcc 0
74 mol 98 unq 0 iso 2 dist 7.89665 4.50554 5.88354 8.49023 5.39354 7.40461 9.38161 7.63183 10.7735 10.5878 numMergedOcc 0
75 mol 98 unq 0 iso 3 dist 7.89665 8.49023 5.39354 4.50554 5.88354 7.40461 9.38161 7.63183 10.5878 10.7735 numMergedOcc 0
76 mol 98 unq 0 iso 4 dist 5.39354 7.40461 5.88354 8.49023 7.89665 4.50554 10.5878 7.63183 10.7735 9.38161 numMergedOcc 0
77 mol 98 unq 0 iso 5 dist 5.39354 8.49023 7.89665 7.40461 5.88354 4.50554 10.5878 7.63183 9.38161 10.7735 numMergedOcc 0
78 mol 98 unq 1 iso 0 dist 5.88354 4.50554 7.89665 7.72877 5.74854 11.0242 10.7735 7.63183 9.38161 13.1711 numMergedOcc 0
79 mol 98 unq 1 iso 1 dist 5.88354 7.72877 5.74854 4.50554 7.89665 11.0242 10.7735 7.63183 13.1711 9.38161 numMergedOcc 0
80 mol 98 unq 1 iso 2 dist 7.89665 4.50554 5.88354 11.0242 5.74854 7.72877 9.38161 7.63183 10.7735 13.1711 numMergedOcc 0
81 mol 98 unq 1 iso 3 dist 7.89665 11.0242 5.74854 4.50554 5.88354 7.72877 9.38161 7.63183 13.1711 10.7735 numMergedOcc 0
82 mol 98 unq 1 iso 4 dist 5.74854 7.72877 5.88354 11.0242 7.89665 4.50554 13.1711 7.63183 10.7735 9.38161 numMergedOcc 0
83 mol 98 unq 1 iso 5 dist 5.74854 11.0242 7.89665 7.72877 5.88354 4.50554 13.1711 7.63183 9.38161 10.7735 numMergedOcc 0
84 mol 98 unq 2 iso 0 dist 5.88354 4.50554 7.89665 10.51 8.76566 8.16331 10.7735 7.63183 9.38161 7.42291 numMergedOcc 0
85 mol 98 unq 2 iso 1 dist 5.88354 10.51 8.76566 4.50554 7.89665 8.16331 10.7735 7.63183 7.42291 9.38161 numMergedOcc 0
86 mol 98 unq 2 iso 2 dist 7.89665 4.50554 5.88354 8.16331 8.76566 10.51 9.38161 7.63183 10.7735 7.42291 numMergedOcc 0
87 mol 98 unq 2 iso 3 dist 7.89665 8.16331 8.76566 4.50554 5.88354 10.51 9.38161 7.63183 7.42291 10.7735 numMergedOcc 0
88 mol 98 unq 2 iso 4 dist 8.76566 10.51 5.88354 8.16331 7.89665 4.50554 7.42291 7.63183 10.7735 9.38161 numMergedOcc 0
89 mol 98 unq 2 iso 5 dist 8.76566 8.16331 7.89665 10.51 5.88354 4.50554 7.42291 7.63183 9.38161 10.7735 numMergedOcc 0
90 mol 98 unq 3 iso 0 dist 5.88354 4.50554 7.89665 13.5683 8.8368 13.0697 10.7735 7.63183 9.38161 8.01486 numMergedOcc 0
91 mol 98 unq 3 iso 1 dist 5.88354 13.5683 8.8368 4.50554 7.89665 13.0697 10.7735 7.63183 8.01486 9.38161 numMergedOcc 0
92 mol 98 unq 3 iso 2 dist 7.89665 4.50554 5.88354 13.0697 8.8368 13.5683 9.38161 7.63183 10.7735 8.01486 numMergedOcc 0
93 mol 98 unq 3 iso 3 dist 7.89665 13.0697 8.8368 4.50554 5.88354 13.5683 9.38161 7.63183 8.01486 10.7735 numMergedOcc 0
94 mol 98 unq 3 iso 4 dist 8.8368 13.5683 5.88354 13.0697 7.89665 4.50554 8.01486 7.63183 10.7735 9.38161 numMergedOcc 0
95 mol 98 unq 3 iso 5 dist 8.8368 13.0697 7.89665 13.5683 5.88354 4.50554 8.01486 7.63183 9.38161 10.7735 numMergedOcc 0
96 mol 98 unq 1 iso 0 dist 5.88354 7.40461 5.39354 7.72877 5.74854 5.09649 10.7735 7.63183 10.5878 13.1711 numMergedOcc 0
97 mol 98 unq 1 iso 1 dist 5.88354 7.72877 5.74854 7.40461 5.39354 5.09649 10.7735 7.63183 13.1711 10.5878 numMergedOcc 0
98 mol 98 unq 1 iso 2 dist 5.39354 7.40461 5.88354 5.09649 5.74854 7.72877 10.5878 7.63183 10.7735 13.1711 numMergedOcc 0
99 mol 98 unq 1 iso 3 dist 5.39354 5.09649 5.74854 7.40461 5.88354 7.72877 10.5878 7.63183 13.1711 10.7735 numMergedOcc 0
100 mol 98 unq 1 iso 4 dist 5.74854 7.72877 5.88354 5.09649 5.39354 7.40461 13.1711 7.63183 10.7735 10.5878 numMergedOcc 0
101 mol 98 unq 1 iso 5 dist 5.74854 5.09649 5.39354 7.72877 5.88354 7.40461 13.1711 7.63183 10.5878 10.7735 numMergedOcc 0
102 mol 98 unq 2 iso 0 dist 5.88354 7.40461 5.39354 10.51 8.76566 7.17023 10.7735 7.63183 10.5878 7.42291 numMergedOcc 0
103 mol 98 unq 2 iso 1 dist 5.88354 10.51 8.76566 7.40461 5.39354 7.17023 10.7735 7.63183 7.42291 10.5878 numMergedOcc 0
104 mol 98 unq 2 iso 2 dist 5.39354 7.40461 5.88354 7.17023 8.76566 10.51 10.5878 7.63183 10.7735 7.42291 numMergedOcc 0
105 mol 98 unq 2 iso 3 dist 5.39354 7.17023 8.76566 7.40461 5.88354 10.51 10.5878 7.63183 7.42291 10.7735 numMergedOcc 0
106 mol 98 unq 2 iso 4 dist 8.76566 10.51 5.88354 7.17023 5.39354 7.40461 7.42291 7.63183 10.7735 10.5878 numMergedOcc 0
107 mol 98 unq 2 iso 5 dist 8.76566 7.17023 5.39354 10.51 5.88354 7.40461 7.42291 7.63183 10.5878 10.7735 numMergedOcc 0
108 mol 98 unq 3 iso 0 dist 5.88354 7.40461 5.39354 13.5683 8.8368 8.31884 10.7735 7.63183 10.5878 8.01486 numMergedOcc 0
109 mol 98 unq 3 iso 1 dist 5.88354 13.5683 8.8368 7.40461 5.39354 8.31884 10.7735 7.63183 8.01486 10.5878 numMergedOcc 0
110 mol 98 unq 3 iso 2 dist 5.39354 7.40461 5.88354 8.31884 8.8368 13.5683 10.5878 7.63183 10.7735 8.01486 numMergedOcc 0
111 mol 98 unq 3 iso 3 dist 5.39354 8.31884 8.8368 7.40461 5.88354 13.5683 10.5878 7.63183 8.01486 10.7735 numMergedOcc 0
112 mol 98 unq 3 iso 4 dist 8.8368 13.5683 5.88354 8.31884 5.39354 7.40461 8.01486 7.63183 10.7735 10.5878 numMergedOcc 0
113 mol 98 unq 3 iso 5 dist 8.8368 8.31884 5.39354 13.5683 5.88354 7.40461 8.01486 7.63183 10.5878 10.7735 numMergedOcc 0
114 mol 98 unq 2 iso 0 dist 5.88354 7.72877 5.74854 10.51 8.76566 11.9511 10.7735 7.63183 13.1711 7.42291 numMergedOcc 0
115 mol 98 unq 2 iso 1 dist 5.88354 10.51 8.76566 7.72877 5.74854 11.9511 10.7735 7.63183 7.42291 13.1711 numMergedOcc 0
116 mol 98 unq 2 iso 2 dist 5.74854 7.72877 5.88354 11.9511 8.76566 10.51 13.1711 7.63183 10.7735 7.42291 numMergedOcc 0
117 mol 98 unq 2 iso 3 dist 5.74854 11.9511 8.76566 7.72877 5.88354 10.51 13.1711 7.63183 7.42291 10.7735 numMergedOcc 0
118 mol 98 unq 2 iso 4 dist 8.76566 10.51 5.88354 11.9511 5.74854 7.72877 7.42291 7.63183 10.7735 13.1711 numMergedOcc 0
119 mol 98 unq 2 iso 5 dist 8.76566 11.9511 5.74854 10.51 5.88354 7.72877 7.42291 7.63183 13.1711 10.7735 numMergedOcc 0
120 mol 98 unq 3 iso 0 dist 5.88354 7.72877 5.74854 13.5683 8.8368 11.569 10.7735 7.63183 13.1711 8.01486 numMergedOcc 0
121 mol 98 unq 3 iso 1 dist 5.88354 13.5683 8.8368 7.72877 5.74854 11.569 10.7735 7.63183 8.01486 13.1711 numMergedOcc 0
122 mol 98 unq 3 iso 2 dist 5.74854 7.72877 5.88354 11.569 8.8368 13.5683 13.1711 7.63183 10.7735 8.01486 numMergedOcc 0
123 mol 98 unq 3 iso 3 dist 5.74854 11.569 8.8368 7.72877 5.88354 13.5683 13.1711 7.63183 8.01486 10.7735 numMergedOcc 0
124 mol 98 unq 3 iso 4 dist 8.8368 13.5683 5.88354 11.569 5.74854 7.72877 8.01486 7.63183 10.7735 13.1711 numMergedOcc 0
125 mol 98 unq 3 iso 5 dist 8.8368 11.569 5.74854 13.5683 5.88354 7.72877 8.01486 7.63183 13.1711 10.7735 numMergedOcc 0
126 mol 98 unq 3 iso 0 dist 5.88354 10.51 8.76566 13.5683 8.8368 6.66172 10.7735 7.63183 7.42291 8.01486 numMergedOcc 0
127 mol 98 unq 3 iso 1 dist 5.88354 13.5683 8.8368 10.51 8.76566 6.66172 10.7735 7.63183 8.01486 7.42291 numMergedOcc 0
128 mol 98 unq 3 iso 2 dist 8.76566 10.51 5.88354 6.66172 8.8368 13.5683 7.42291 7.63183 10.7735 8.01486 numMergedOcc 0
129 mol 98 unq 3 iso 3 dist 8.76566 6.66172 8.8368 10.51 5.88354 13.5683 7.42291 7.63183 8.01486 10.7735 numMergedOcc 0
130 mol 98 unq 3 iso 4 dist 8.8368 13.5683 5.88354 6.66172 8.76566 10.51 8.01486 7.63183 10.7735 7.42291 numMergedOcc 0
131 mol 98 unq 3 iso 5 dist 8.8368 6.66172 8.76566 13.5683 5.88354 10.51 8.01486 7.63183 7.42291 10.7735 numMergedOcc 0
132 mol 98 unq 1 iso 0 dist 7.89665 8.49023 5.39354 11.0242 5.74854 5.09649 9.38161 7.63183 10.5878 13.1711 numMergedOcc 0
133 mol 98 unq 1 iso 1 dist 7.89665 11.0242 5.74854 8.49023 5.39354 5.09649 9.38161 7.63183 13.1711 10.5878 numMergedOcc 0
134 mol 98 unq 1 iso 2 dist 5.39354 8.49023 7.89665 5.09649 5.74854 11.0242 10.5878 7.63183 9.38161 13.1711 numMergedOcc 0
135 mol 98 unq 1 iso 3 dist 5.39354 5.09649 5.74854 8.49023 7.89665 11.0242 10.5878 7.63183 13.1711 9.38161 numMergedOcc 0
136 mol 98 unq 1 iso 4 dist 5.74854 11.0242 7.89665 5.09649 5.39354 8.49023 13.1711 7.63183 9.38161 10.5878 numMergedOcc 0
137 mol 98 unq 1 iso 5 dist 5.74854 5.09649 5.39354 11.0242 7.89665 8.49023 13.1711 7.63183 10.5878 9.38161 numMergedOcc 0
138 mol 98 unq 2 iso 0 dist 7.89665 8.49023 5.39354 8.16331 8.76566 7.17023 9.38161 7.63183 10.5878 7.42291 numMergedOcc 0
139 mol 98 unq 2 iso 1 dist 7.89665 8.16331 8.76566 8.49023 5.39354 7.17023 9.38161 7.63183 7.42291 10.5878 numMergedOcc 0
140 mol 98 unq 2 iso 2 dist 5.39354 8.49023 7.89665 7.17023 8.76566 8.16331 10.5878 7.63183 9.38161 7.42291 numMergedOcc 0
141 mol 98 unq 2 iso 3 dist 5.39354 7.17023 8.76566 8.49023 7.89665 8.16331 10.5878 7.63183 7.42291 9.38161 numMergedOcc 0
142 mol 98 unq 2 iso 4 dist 8.76566 8.16331 7.89665 7.17023 5.39354 8.49023 7.42291 7.63183 9.38161 10.5878 numMergedOcc 0
143 mol 98 unq 2 iso 5 dist 8.76566 7.17023 5.39354 8.16331 7.89665 8.49023 7.42291 7.63183 10.5878 9.38161 numMergedOcc 0
144 mol 98 unq 3 iso 0 dist 7.89665 8.49023 5.39354 13.0697 8.8368 8.31884 9.38161 7.63183 10.5878 8.01486 numMergedOcc 0
145 mol 98 unq 3 iso 1 dist 7.89665 13.0697 8.8368 8.49023 5.39354 8.31884 9.38161 7.63183 8.01486 10.5878 numMergedOcc 0
146 mol 98 unq 3 iso 2 dist 5.39354 8.49023 7.89665 8.31884 8.8368 13.0697 10.5878 7.63183 9.38161 8.01486 numMergedOcc 0
147 mol 98 unq 3 iso 3 dist 5.39354 8.31884 8.8368 8.49023 7.89665 13.0697 10.5878 7.63183 8.01486 9.38161 numMergedOcc 0
148 mol 98 unq 3 iso 4 dist 8.8368 13.0697 7.89665 8.31884 5.39354 8.49023 8.01486 7.63183 9.38161 10.5878 numMergedOcc 0
149 mol 98 unq 3 iso 5 dist 8.8368 8.31884 5.39354 13.0697 7.89665 8.49023 8.01486 7.63183 10.5878 9.38161 numMergedOcc 0
150 mol 98 unq 2 iso 0 dist 7.89665 11.0242 5.74854 8.16331 8.76566 11.9511 9.38161 7.63183 13.1711 7.42291 numMergedOcc 0
151 mol 98 unq 2 iso 1 dist 7.89665 8.16331 8.76566 11.0242 5.74854 11.9511 9.38161 7.63183 7.42291 13.1711 numMergedOcc 0
152 mol 98 unq 2 iso 2 dist 5.74854 11.0242 7.89665 11.9511 8.76566 8.16331 13.1711 7.63183 9.38161 7.42291 numMergedOcc 0
153 mol 98 unq 2 iso 3 dist 5.74854 11.9511 8.76566 11.0242 7.89665 8.16331 13.1711 7.63183 7.42291 9.38161 numMergedOcc 0
154 mol 98 unq 2 iso 4 dist 8.76566 8.16331 7.89665 11.9511 5.74854 11.0242 7.42291 7.63183 9.38161 13.1711 numMergedOcc 0
155 mol 98 unq 2 iso 5 dist 8.76566 11.9511 5.74854 8.16331 7.89665 11.0242 7.42291 7.63183 13.1711 9.38161 numMergedOcc 0
156 mol 98 unq 3 iso 0 dist 7.89665 11.0242 5.74854 13.0697 8.8368 11.569 9.38161 7.63183 13.1711 8.01486 numMergedOcc 0
157 mol 98 unq 3 iso 1 dist 7.89665 13.0697 8.8368 11.0242 5.74854 11.569 9.38161 7.63183 8.01486 13.1711 numMergedOcc 0
158 mol 98 unq 3 iso 2 dist 5.74854 11.0242 7.89665 11.569 8.8368 13.0697 13.1711 7.63183 9.38161 8.01486 numMergedOcc 0
159 mol 98 unq 3 iso 3 dist 5.74854 11.569 8.8368 11.0242 7.89665 13.0697 13.1711 7.63183 8.01486 9.38161 numMergedOcc 0
160 mol 98 unq 3 iso 4 dist 8.8368 13.0697 7.89665 11.569 5.74854 11.0242 8.01486 7.63183 9.38161 13.1711 numMergedOcc 0
161 mol 98 unq 3 iso 5 dist 8.8368 11.569 5.74854 13.0697 7.89665 11.0242 8.01486 7.63183 13.1711 9.38161 numMergedOcc 0
162 mol 98 unq 3 iso 0 dist 7.89665 8.16331 8.76566 13.0697 8.8368 6.66172 9.38161 7.63183 7.42291 8.01486 numMergedOcc 0
163 mol 98 unq 3 iso 1 dist 7.89665 13.0697 8.8368 8.16331 8.76566 6.66172 9.38161 7.63183 8.01486 7.42291 numMergedOcc 0
164 mol 98 unq 3 iso 2 dist 8.76566 8.16331 7.89665 6.66172 8.8368 13.0697 7.42291 7.63183 9.38161 8.01486 numMergedOcc 0
165 mol 98 unq 3 iso 3 dist 8.76566 6.66172 8.8368 8.16331 7.89665 13.0697 7.42291 7.63183 8.01486 9.38161 numMergedOcc 0
166 mol 98 unq 3 iso 4 dist 8.8368 13.0697 7.89665 6.66172 8.76566 8.16331 8.01486 7.63183 9.38161 7.42291 numMergedOcc 0
167 mol 98 unq 3 iso 5 dist 8.8368 6.66172 8.76566 13.0697 7.89665 8.16331 8.01486 7.63183 7.42291 9.38161 numMergedOcc 0
168 mol 98 unq 2 iso 0 dist 5.39354 5.09649 5.74854 7.17023 8.76566 11.9511 10.5878 7.63183 13.1711 7.42291 numMergedOcc 0
169 mol 98 unq 2 iso 1 dist 5.39354 7.17023 8.76566 5.09649 5.74854 11.9511 10.5878 7.63183 7.42291 13.1711 numMergedOcc 0
170 mol 98 unq 2 iso 2 dist 5.74854 5.09649 5.39354 11.9511 8.76566 7.17023 13.1711 7.63183 10.5878 7.42291 numMergedOcc 0
171 mol 98 unq 2 iso 3 dist 5.74854 11.9511 8.76566 5.09649 5.39354 7.17023 13.1711 7.63183 7.42291 10.5878 numMergedOcc 0
172 mol 98 unq 2 iso 4 dist 8.76566 7.17023 5.39354 11.9511 5.74854 5.09649 7.42291 7.63183 10.5878 13.1711 numMergedOcc 0
173 mol 98 unq 2 iso 5 dist 8.76566 11.9511 5.74854 7.17023 5.39354 5.09649 7.42291 7.63183 13.1711 10.5878 numMergedOcc 0
174 mol 98 unq 3 iso 0 dist 5.39354 5.09649 5.74854 8.31884 8.8368 11.569 10.5878 7.63183 13.1711 8.01486 numMergedOcc 0
175 mol 98 unq 3 iso 1 dist 5.39354 8.31884 8.8368 5.09649 5.74854 11.569 10.5878 7.63183 8.01486 13.1711 numMergedOcc 0
176 mol 98 unq 3 iso 2 dist 5.74854 5.09649 5.39354 11.569 8.8368 8.31884 13.1711 7.63183 10.5878 8.01486 numMergedOcc 0
177 mol 98 unq 3 iso 3 dist 5.74854 11.569 8.8368 5.09649 5.39354 8.31884 13.1711 7.63183 8.01486 10.5878 numMergedOcc 0
178 mol 98 unq 3 iso 4 dist 8.8368 8.31884 5.39354 11.569 5.74854 5.09649 8.01486 7.63183 10.5878 13.1711 numMergedOcc 0
179 mol 98 unq 3 iso 5 dist 8.8368 11.569 5.74854 8.31884 5.39354 5.09649 8.01486 7.63183 13.1711 10.5878 numMergedOcc 0
180 mol 98 unq 3 iso 0 dist 5.39354 7.17023 8.76566 8.31884 8.8368 6.66172 10.5878 7.63183 7.42291 8.01486 numMergedOcc 0
181 mol 98 unq 3 iso 1 dist 5.39354 8.31884 8.8368 7.17023 8.76566 6.66172 10.5878 7.63183 8.01486 7.42291 numMergedOcc 0
182 mol 98 unq 3 iso 2 dist 8.76566 7.17023 5.39354 6.66172 8.8368 8.31884 7.42291 7.63183 10.5878 8.01486 numMergedOcc 0
183 mol 98 unq 3 iso 3 dist 8.76566 6.66172 8.8368 7.17023 5.39354 8.31884 7.42291 7.63183 8.01486 10.5878 numMergedOcc 0
184 mol 98 unq 3 iso 4 dist 8.8368 8.31884 5.39354 6.66172 8.76566 7.17023 8.01486 7.63183 10.5878 7.42291 numMergedOcc 0
185 mol 98 unq 3 iso 5 dist 8.8368 6.66172 8.76566 8.31884 5.39354 7.17023 8.01486 7.63183 7.42291 10.5878 numMergedOcc 0
186 mol 98 unq 3 iso 0 dist 5.74854 11.9511 8.76566 11.569 8.8368 6.66172 13.1711 7.63183 7.42291 8.01486 numMergedOcc 0
187 mol 98 unq 3 iso 1 dist 5.74854 11.569 8.8368 11.9511 8.76566 6.66172 13.1711 7.63183 8.01486 7.42291 numMergedOcc 0
188 mol 98 unq 3 iso 2 dist 8.76566 11.9511 5.74854 6.66172 8.8368 11.569 7.42291 7.63183 13.1711 8.01486 numMergedOcc 0
189 mol 98 unq 3 iso 3 dist 8.76566 6.66172 8.8368 11.9511 5.74854 11.569 7.42291 7.63183 8.01486 13.1711 numMergedOcc 0
190 mol 98 unq 3 iso 4 dist 8.8368 11.569 5.74854 6.66172 8.76566 11.9511 8.01486 7.63183 13.1711 7.42291 numMergedOcc 0
191 mol 98 unq 3 iso 5 dist 8.8368 6.66172 8.76566 11.569 5.74854 11.9511 8.01486 7.63183 7.42291 13.1711 numMergedOcc 0
192 mol 112 unq 0 iso 0 dist 7.23962 7.03147 9.00067 11.4954 9.89499 5.54347 6.89221 9.74569 5.52645 9.88449 numMergedOcc 0
193 mol 112 unq 0 iso 1 dist 7.23962 11.4954 9.89499 7.03147 9.00067 5.54347 6.89221 9.74569 9.88449 5.52645 numMergedOcc 0
194 mol 112 unq 0 iso 2 dist 9.00067 7.03147 7.23962 5.54347 9.89499 11.4954 5.52645 9.74569 6.89221 9.88449 numMergedOcc 0
195 mol 112 unq 0 iso 3 dist 9.00067 5.54347 9.89499 7.03147 7.23962 11.4954 5.52645 9.74569 9.88449 6.89221 numMergedOcc 0
196 mol 112 unq 0 iso 4 dist 9.89499 11.4954 7.23962 5.54347 9.00067 7.03147 9.88449 9.74569 6.89221 5.52645 numMergedOcc 0
197 mol 112 unq 0 iso 5 dist 9.89499 5.54347 9.00067 11.4954 7.23962 7.03147 9.88449 9.74569 5.52645 6.89221 numMergedOcc 0
198 mol 112 unq 1 iso 0 dist 7.23962 7.03147 9.00067 7.05226 7.30204 5.56241 6.89221 9.74569 5.52645 9.96887 numMergedOcc 0
199 mol 112 unq 1 iso 1 dist 7.23962 7.05226 7.30204 7.03147 9.00067 5.56241 6.89221 9.74569 9.96887 5.52645 numMergedOcc 0
200 mol 112 unq 1 iso 2 dist 9.00067 7.03147 7.23962 5.56241 7.30204 7.05226 5.52645 9.74569 6.89221 9.96887 numMergedOcc 0
201 mol 112 unq 1 iso 3 dist 9.00067 5.56241 7.30204 7.03147 7.23962 7.05226 5.52645 9.74569 9.96887 6.89221 numMergedOcc 0
202 mol 112 unq 1 iso 4 dist 7.30204 7.05226 7.23962 5.56241 9.00067 7.03147 9.96887 9.74569 6.89221 5.52645 numMergedOcc 0
203 mol 112 unq 1 iso 5 dist 7.30204 5.56241 9.00067 7.05226 7.23962 7.03147 9.96887 9.74569 5.52645 6.89221 numMergedOcc 0
204 mol 112 unq 1 iso 0 dist 7.23962 11.4954 9.89499 7.05226 7.30204 6.77737 6.89221 9.74569 9.88449 9.96887 numMergedOcc 0
205 mol 112 unq 1 iso 1 dist 7.23962 7.05226 7.30204 11.4954 9.89499 6.77737 6.89221 9.74569 9.96887 9.88449 numMergedOcc 0
206 mol 112 unq 1 iso 2 dist 9.89499 11.4954 7.23962 6.77737 7.30204 7.05226 9.88449 9.74569 6.89221 9.96887 numMergedOcc 0
207 mol 112 unq 1 iso 3 dist 9.89499 6.77737 7.30204 11.4954 7.23962 7.05226 9.88449 9.74569 9.96887 6.89221 numMergedOcc 0
208 mol 112 unq 1 iso 4 dist 7.30204 7.05226 7.23962 6.77737 9.89499 11.4954 9.96887 9.74569 6.89221 9.88449 numMergedOcc 0
209 mol 112 unq 1 iso 5 dist 7.30204 6.77737 9.89499 7.05226 7.23962 11.4954 9.96887 9.74569 9.88449 6.89221 numMergedOcc 0
210 mol 112 unq 1 iso 0 dist 9.00067 5.54347 9.89499 5.56241 7.30204 6.77737 5.52645 9.74569 9.88449 9.96887 numMergedOcc 0
211 mol 112 unq 1 iso 1 dist 9.00067 5.56241 7.30204 5.54347 9.89499 6.77737 5.52645 9.74569 9.96887 9.88449 numMergedOcc 0
212 mol 112 unq 1 iso 2 dist 9.89499 5.54347 9.00067 6.77737 7.30204 5.56241 9.88449 9.74569 5.52645 9.96887 numMergedOcc 0
213 mol 112 unq 1 iso 3 dist 9.89499 6.77737 7.30204 5.54347 9.00067 5.56241 9.88449 9.74569 9.96887 5.52645 numMergedOcc 0
214 mol 112 unq 1 iso 4 dist 7.30204 5.56241 9.00067 6.77737 9.89499 5.54347 9.96887 9.74569 5.52645 9.88449 numMergedOcc 0
215 mol 112 unq 1 iso 5 dist 7.30204 6.77737 9.89499 5.56241 9.00067 5.54347 9.96887 9.74569 9.88449 5.52645 numMergedOcc 0
216 mol 131 unq 0 iso 0 dist 9.15431 7.58238 6.92648 13.2572 9.29384 6.63273 7.21005 7.76594 11.5688 15.7796 numMergedOcc 0
217 mol 131 unq 0 iso 1 dist 9.15431 13.2572 9.29384 7.58238 6.92648 6.63273 7.21005 7.76594 15.7796 11.5688 numMergedOcc 0
218 mol 131 unq 0 iso 2 dist 6.92648 7.58238 9.15431 6.63273 9.29384 13.2572 11.5688 7.76594 7.21005 15.7796 numMergedOcc 0
219 mol 131 unq 0 iso 3 dist 6.92648 6.63273 9.29384 7.58238 9.15431 13.2572 11.5688 7.76594 15.7796 7.21005 numMergedOcc 0
220 mol 131 unq 0 iso 4 dist 9.29384 13.2572 9.15431 6.63273 6.92648 7.58238 15.7796 7.76594 7.21005 11.5688 numMergedOcc 0
221 mol 131 unq 0 iso 5 dist 9.29384 6.63273 6.92648 13.2572 9.15431 7.58238 15.7796 7.76594 11.5688 7.21005 numMergedOcc 0
222 mol 156 unq 0 iso 0 dist 9.31851 7.14831 6.2319 9.98789 9.97732 6.31306 10.7975 4.9941 5.71107 11.2067 numMergedOcc 0
223 mol 156 unq 0 iso 1 dist 9.31851 9.98789 9.97732 7.14831 6.2319 6.31306 10.7975 4.9941 11.2067 5.71107 numMergedOcc 0
224 mol 156 unq 0 iso 2 dist 6.2319 7.14831 9.31851 6.31306 9.97732 9.98789 5.71107 4.9941 10.7975 11.2067 numMergedOcc 0
225 mol 156 unq 0 iso 3 dist 6.2319 6.31306 9.97732 7.14831 9.31851 9.98789 5.71107 4.9941 11.2067 10.7975 numMergedOcc 0
226 mol 156 unq 0 iso 4 dist 9.97732 9.98789 9.31851 6.31306 6.2319 7.14831 11.2067 4.9941 10.7975 5.71107 numMergedOcc 0
227 mol 156 unq 0 iso 5 dist 9.97732 6.31306 6.2319 9.98789 9.31851 7.14831 11.2067 4.9941 5.71107 10.7975 numMergedOcc 0
228 mol 156 unq 1 iso 0 dist 9.31851 7.14831 6.2319 9.98789 9.97732 6.31306 13.6634 8.06913 10.7023 9.00862 numMergedOcc 0
229 mol 156 unq 1 iso 1 dist 9.31851 9.98789 9.97732 7.14831 6.2319 6.31306 13.6634 8.06913 9.00862 10.7023 numMergedOcc 0
230 mol 156 unq 1 iso 2 dist 6.2319 7.14831 9.31851 6.31306 9.97732 9.98789 10.7023 8.06913 13.6634 9.00862 numMergedOcc 0
231 mol 156 unq 1 iso 3 dist 6.2319 6.31306 9.97732 7.14831 9.31851 9.98789 10.7023 8.06913 9.00862 13.6634 numMergedOcc 0
232 mol 156 unq 1 iso 4 dist 9.97732 9.98789 9.31851 6.31306 6.2319 7.14831 9.00862 8.06913 13.6634 10.7023 numMergedOcc 0
233 mol 156 unq 1 iso 5 dist 9.97732 6.31306 6.2319 9.98789 9.31851 7.14831 9.00862 8.06913 10.7023 13.6634 numMergedOcc 0
234 mol 171 unq 0 iso 0 dist 7.71426 7.31409 5.10618 13.6814 9.86681 13.7214 4.44751 7.82546 9.61561 10.2067 numMergedOcc 0
235 mol 171 unq 0 iso 1 dist 7.71426 13.6814 9.86681 7.31409 5.10618 13.7214 4.44751 7.82546 10.2067 9.61561 numMergedOcc 0
236 mol 171 unq 0 iso 2 dist 5.10618 7.31409 7.71426 13.7214 9.86681 13.6814 9.61561 7.82546 4.44751 10.2067 numMergedOcc 0
237 mol 171 unq 0 iso 3 dist 5.10618 13.7214 9.86681 7.31409 7.71426 13.6814 9.61561 7.82546 10.2067 4.44751 numMergedOcc 0
238 mol 171 unq 0 iso 4 dist 9.86681 13.6814 7.71426 13.7214 5.10618 7.31409 10.2067 7.82546 4.44751 9.61561 numMergedOcc 0
239 mol 171 unq 0 iso 5 dist 9.86681 13.7214 5.10618 13.6814 7.71426 7.31409 10.2067 7.82546 9.61561 4.44751 numMergedOcc 0
240 mol 186 unq 0 iso 0 dist 9.56197 9.41955 7.24795 8.04815 8.64409 13.684 9.27818 7.55358 13.0197 4.37002 numMergedOcc 0
241 mol 186 unq 0 iso 1 dist 9.56197 8.04815 8.64409 9.41955 7.24795 13.684 9.27818 7.55358 4.37002 13.0197 numMergedOcc 0
242 mol 186 unq 0 iso 2 dist 7.24795 9.41955 9.56197 13.684 8.64409 8.04815 13.0197 7.55358 9.27818 4.37002 numMergedOcc 0
243 mol 186 unq 0 iso 3 dist 7.24795 13.684 8.64409 9.41955 9.56197 8.04815 13.0197 7.55358 4.37002 9.27818 numMergedOcc 0
244 mol 186 unq 0 iso 4 dist 8.64409 8.04815 9.56197 13.684 7.24795 9.41955 4.37002 7.55358 9.27818 13.0197 numMergedOcc 0
245 mol 186 unq 0 iso 5 dist 8.64409 13.684 7.24795 8.04815 9.56197 9.41955 4.37002 7.55358 13.0197 9.27818 numMergedOcc 0
246 mol 186 unq 1 iso 0 dist 9.56197 9.41955 7.24795 8.04815 8.64409 13.684 9.55926 7.60991 12.9082 4.64235 numMergedOcc 0
247 mol 186 unq 1 iso 1 dist 9.56197 8.04815 8.64409 9.41955 7.24795 13.684 9.55926 7.60991 4.64235 12.9082 numMergedOcc 0
248 mol 186 unq 1 iso 2 dist 7.24795 9.41955 9.56197 13.684 8.64409 8.04815 12.9082 7.60991 9.55926 4.64235 numMergedOcc 0
249 mol 186 unq 1 iso 3 dist 7.24795 13.684 8.64409 9.41955 9.56197 8.04815 12.9082 7.60991 4.64235 9.55926 numMergedOcc 0
250 mol 186 unq 1 iso 4 dist 8.64409 8.04815 9.56197 13.684 7.24795 9.41955 4.64235 7.60991 9.55926 12.9082 numMergedOcc 0
251 mol 186 unq 1 iso 5 dist 8.64409 13.684 7.24795 8.04815 9.56197 9.41955 4.64235 7.60991 12.9082 9.55926 numMergedOcc 0
252 mol 186 unq 2 iso 0 dist 9.56197 9.41955 7.24795 5.92513 7.60202 9.45987 9.27818 7.55358 13.0197 9.72941 numMergedOcc 0
253 mol 186 unq 2 iso 1 dist 9.56197 5.92513 7.60202 9.41955 7.24795 9.45987 9.27818 7.55358 9.72941 13.0197 numMergedOcc 0
254 mol 186 unq 2 iso 2 dist 7.24795 9.41955 9.56197 9.45987 7.60202 5.92513 13.0197 7.55358 9.27818 9.72941 numMergedOcc 0
255 mol 186 unq 2 iso 3 dist 7.24795 9.45987 7.60202 9.41955 9.56197 5.92513 13.0197 7.55358 9.72941 9.27818 numMergedOcc 0
256 mol 186 unq 2 iso 4 dist 7.60202 5.92513 9.56197 9.45987 7.24795 9.41955 9.72941 7.55358 9.27818 13.0197 numMergedOcc 0
257 mol 186 unq 2 iso 5 dist 7.60202 9.45987 7.24795 5.92513 9.56197 9.41955 9.72941 7.55358 13.0197 9.27818 numMergedOcc 0
258 mol 186 unq 3 iso 0 dist 9.56197 9.41955 7.24795 5.92513 7.60202 9.45987 9.55926 7.60991 12.9082 5.39885 numMergedOcc 0
259 mol 186 unq 3 iso 1 dist 9.56197 5.92513 7.60202 9.41955 7.24795 9.45987 9.55926 7.60991 5.39885 12.9082 numMergedOcc 0
260 mol 186 unq 3 iso 2 dist 7.24795 9.41955 9.56197 9.45987 7.60202 5.92513 12.9082 7.60991 9.55926 5.39885 numMergedOcc 0
261 mol 186 unq 3 iso 3 dist 7.24795 9.45987 7.60202 9.41955 9.56197 5.92513 12.9082 7.60991 5.39885 9.55926 numMergedOcc 0
262 mol 186 unq 3 iso 4 dist 7.60202 5.92513 9.56197 9.45987 7.24795 9.41955 5.39885 7.60991 9.55926 12.9082 numMergedOcc 0
263 mol 186 unq 3 iso 5 dist 7.60202 9.45987 7.24795 5.92513 9.56197 9.41955 5.39885 7.60991 12.9082 9.55926 numMergedOcc 0
264 mol 186 unq 2 iso 0 dist 9.56197 8.04815 8.64409 5.92513 7.60202 7.18269 9.27818 7.55358 4.37002 9.72941 numMergedOcc 0
265 mol 186 unq 2 iso 1 dist 9.56197 5.92513 7.60202 8.04815 8.64409 7.18269 9.27818 7.55358 9.72941 4.37002 numMergedOcc 0
266 mol 186 unq 2 iso 2 dist 8.64409 8.04815 9.56197 7.18269 7.60202 5.92513 4.37002 7.55358 9.27818 9.72941 numMergedOcc 0
267 mol 186 unq 2 iso 3 dist 8.64409 7.18269 7.60202 8.04815 9.56197 5.92513 4.37002 7.55358 9.72941 9.27818 numMergedOcc 0
268 mol 186 unq 2 iso 4 dist 7.60202 5.92513 9.56197 7.18269 8.64409 8.04815 9.72941 7.55358 9.27818 4.37002 numMergedOcc 0
269 mol 186 unq 2 iso 5 dist 7.60202 7.18269 8.64409 5.92513 9.56197 8.04815 9.72941 7.55358 4.37002 9.27818 numMergedOcc 0
270 mol 186 unq 3 iso 0 dist 9.56197 8.04815 8.64409 5.92513 7.60202 7.18269 9.55926 7.60991 4.64235 5.39885 numMergedOcc 0
271 mol 186 unq 3 iso 1 dist 9.56197 5.92513 7.60202 8.04815 8.64409 7.18269 9.55926 7.60991 5.39885 4.64235 numMergedOcc 0
272 mol 186 unq 3 iso 2 dist 8.64409 8.04815 9.56197 7.18269 7.60202 5.92513 4.64235 7.60991 9.55926 5.39885 numMergedOcc 0
273 mol 186 unq 3 iso 3 dist 8.64409 7.18269 7.60202 8.04815 9.56197 5.92513 4.64235 7.60991 5.39885 9.55926 numMergedOcc 0
274 mol 186 unq 3 iso 4 dist 7.60202 5.92513 9.56197 7.18269 8.64409 8.04815 5.39885 7.60991 9.55926 4.64235 numMergedOcc 0
275 mol 186 unq 3 iso 5 dist 7.60202 7.18269 8.64409 5.92513 9.56197 8.04815 5.39885 7.60991 4.64235 9.55926 numMergedOcc 0
276 mol 186 unq 2 iso 0 dist 7.24795 13.684 8.64409 9.45987 7.60202 7.18269 13.0197 7.55358 4.37002 9.72941 numMergedOcc 0
277 mol 186 unq 2 iso 1 dist 7.24795 9.45987 7.60202 13.684 8.64409 7.18269 13.0197 7.55358 9.72941 4.37002 numMergedOcc 0
278 mol 186 unq 2 iso 2 dist 8.64409 13.684 7.24795 7.18269 7.60202 9.45987 4.37002 7.55358 13.0197 9.72941 numMergedOcc 0
279 mol 186 unq 2 iso 3 dist 8.64409 7.18269 7.60202 13.684 7.24795 9.45987 4.37002 7.55358 9.72941 13.0197 numMergedOcc 0
280 mol 186 unq 2 iso 4 dist 7.60202 9.45987 7.24795 7.18269 8.64409 13.684 9.72941 7.55358 13.0197 4.37002 numMergedOcc 0
281 mol 186 unq 2 iso 5 dist 7.60202 7.18269 8.64409 9.45987 7.24795 13.684 9.72941 7.55358 4.37002 13.0197 numMergedOcc 0
282 mol 186 unq 3 iso 0 dist 7.24795 13.684 8.64409 9.45987 7.60202 7.18269 12.9082 7.60991 4.64235 5.39885 numMergedOcc 0
283 mol 186 unq 3 iso 1 dist 7.24795 9.45987 7.60202 13.684 8.64409 7.18269 12.9082 7.60991 5.39885 4.64235 numMergedOcc 0
284 mol 186 unq 3 iso 2 dist 8.64409 13.684 7.24795 7.18269 7.60202 9.45987 4.64235 7.60991 12.9082 5.39885 numMergedOcc 0
285 mol 186 unq 3 iso 3 dist 8.64409 7.18269 7.60202 13.684 7.24795 9.45987 4.64235 7.60991 5.39885 12.9082 numMergedOcc 0
286 mol 186 unq 3 iso 4 dist 7.60202 9.45987 7.24795 7.18269 8.64409 13.684 5.39885 7.60991 12.9082 4.64235 numMergedOcc 0
287 mol 186 unq 3 iso 5 dist 7.60202 7.18269 8.64409 9.45987 7.24795 13.684 5.39885 7.60991 4.64235 12.9082 numMergedOcc 0
288 mol 194 unq 0 iso 0 dist 6.26839 8.0179 8.12346 14.6506 8.83356 13.5632 6.66155 5.52678 6.12973 13.0333 numMergedOcc 0
289 mol 194 unq 0 iso 1 dist 6.26839 14.6506 8.83356 8.0179 8.12346 13.5632 6.66155 5.52678 13.0333 6.12973 numMergedOcc 0
290 mol 194 unq 0 iso 2 dist 8.12346 8.0179 6.26839 13.5632 8.83356 14.6506 6.12973 5.52678 6.66155 13.0333 numMergedOcc 0
291 mol 194 unq 0 iso 3 dist 8.12346 13.5632 8.83356 8.0179 6.26839 14.6506 6.12973 5.52678 13.0333 6.66155 numMergedOcc 0
292 mol 194 unq 0 iso 4 dist 8.83356 14.6506 6.26839 13.5632 8.12346 8.0179 13.0333 5.52678 6.66155 6.12973 numMergedOcc 0
293 mol 194 unq 0 iso 5 dist 8.83356 13.5632 8.12346 14.6506 6.26839 8.0179 13.0333 5.52678 6.12973 6.66155 numMergedOcc 0
294 mol 194 unq 1 iso 0 dist 6.26839 8.0179 8.12346 14.6506 8.83356 13.5632 5.4499 9.81666 11.0239 18.6469 numMergedOcc 0
295 mol 194 unq 1 iso 1 dist 6.26839 14.6506 8.83356 8.0179 8.12346 13.5632 5.4499 9.81666 18.6469 11.0239 numMergedOcc 0
296 mol 194 unq 1 iso 2 dist 8.12346 8.0179 6.26839 13.5632 8.83356 14.6506 11.0239 9.81666 5.4499 18.6469 numMergedOcc 0
297 mol 194 unq 1 iso 3 dist 8.12346 13.5632 8.83356 8.0179 6.26839 14.6506 11.0239 9.81666 18.6469 5.4499 numMergedOcc 0
298 mol 194 unq 1 iso 4 dist 8.83356 14.6506 6.26839 13.5632 8.12346 8.0179 18.6469 9.81666 5.4499 11.0239 numMergedOcc 0
299 mol 194 unq 1 iso 5 dist 8.83356 13.5632 8.12346 14.6506 6.26839 8.0179 18.6469 9.81666 11.0239 5.4499 numMergedOcc 0
300 mol 194 unq 2 iso 0 dist 6.26839 8.0179 8.12346 8.48054 8.2654 6.26298 6.66155 5.52678 6.12973 10.1796 numMergedOcc 0
301 mol 194 unq 2 iso 1 dist 6.26839 8.48054 8.2654 8.0179 8.12346 6.26298 6.66155 5.52678 10.1796 6.12973 numMergedOcc 0
302 mol 194 unq 2 iso 2 dist 8.12346 8.0179 6.26839 6.26298 8.2654 8.48054 6.12973 5.52678 6.66155 10.1796 numMergedOcc 0
303 mol 194 unq 2 iso 3 dist 8.12346 6.26298 8.2654 8.0179 6.26839 8.48054 6.12973 5.52678 10.1796 6.66155 numMergedOcc 0
304 mol 194 unq 2 iso 4 dist 8.2654 8.48054 6.26839 6.26298 8.12346 8.0179 10.1796 5.52678 6.66155 6.12973 numMergedOcc 0
305 mol 194 unq 2 iso 5 dist 8.2654 6.26298 8.12346 8.48054 6.26839 8.0179 10.1796 5.52678 6.12973 6.66155 numMergedOcc 0
306 mol 194 unq 3 iso 0 dist 6.26839 8.0179 8.12346 8.48054 8.2654 6.26298 5.4499 9.81666 11.0239 13.5457 numMergedOcc 0
307 mol 194 unq 3 iso 1 dist 6.26839 8.48054 8.2654 8.0179 8.12346 6.26298 5.4499 9.81666 13.5457 11.0239 numMergedOcc 0
308 mol 194 unq 3 iso 2 dist 8.12346 8.0179 6.26839 6.26298 8.2654 8.48054 11.0239 9.81666 5.4499 13.5457 numMergedOcc 0
309 mol 194 unq 3 iso 3 dist 8.12346 6.26298 8.2654 8.0179 6.26839 8.48054 11.0239 9.81666 13.5457 5.4499 numMergedOcc 0
310 mol 194 unq 3 iso 4 dist 8.2654 8.48054 6.26839 6.26298 8.12346 8.0179 13.5457 9.81666 5.4499 11.0239 numMergedOcc 0
311 mol 194 unq 3 iso 5 dist 8.2654 6.26298 8.12346 8.48054 6.26839 8.0179 13.5457 9.81666 11.0239 5.4499 numMergedOcc 0
312 mol 194 unq 2 iso 0 dist 6.26839 14.6506 8.83356 8.48054 8.2654 11.6097 6.66155 5.52678 13.0333 10.1796 numMergedOcc 0
313 mol 194 unq 2 iso 1 dist 6.26839 8.48054 8.2654 14.6506 8.83356 11.6097 6.66155 5.52678 10.1796 13.0333 numMergedOcc 0
314 mol 194 unq 2 iso 2 dist 8.83356 14.6506 6.26839 11.6097 8.2654 8.48054 13.0333 5.52678 6.66155 10.1796 numMergedOcc 0
315 mol 194 unq 2 iso 3 dist 8.83356 11.6097 8.2654 14.6506 6.26839 8.48054 13.0333 5.52678 10.1796 6.66155 numMergedOcc 0
316 mol 194 unq 2 iso 4 dist 8.2654 8.48054 6.26839 11.6097 8.83356 14.6506 10.1796 5.52678 6.66155 13.0333 numMergedOcc 0
317 mol 194 unq 2 iso 5 dist 8.2654 11.6097 8.83356 8.48054 6.26839 14.6506 10.1796 5.52678 13.0333 6.66155 numMergedOcc 0
318 mol 194 unq 3 iso 0 dist 6.26839 14.6506 8.83356 8.48054 8.2654 11.6097 5.4499 9.81666 18.6469 13.5457 numMergedOcc 0
319 mol 194 unq 3 iso 1 dist 6.26839 8.48054 8.2654 14.6506 8.83356 11.6097 5.4499 9.81666 13.5457 18.6469 numMergedOcc 0
320 mol 194 unq 3 iso 2 dist 8.83356 14.6506 6.26839 11.6097 8.2654 8.48054 18.6469 9.81666 5.4499 13.5457 numMergedOcc 0
321 mol 194 unq 3 iso 3 dist 8.83356 11.6097 8.2654 14.6506 6.26839 8.48054 18.6469 9.81666 13.5457 5.4499 numMergedOcc 0
322 mol 194 unq 3 iso 4 dist 8.2654 8.48054 6.26839 11.6097 8.83356 14.6506 13.5457 9.81666 5.4499 18.6469 numMergedOcc 0
323 mol 194 unq 3 iso 5 dist 8.2654 11.6097 8.83356 8.48054 6.26839 14.6506 13.5457 9.81666 18.6469 5.4499 numMergedOcc 0
324 mol 194 unq 2 iso 0 dist 8.12346 13.5632 8.83356 6.26298 8.2654 11.6097 6.12973 5.52678 13.0333 10.1796 numMergedOcc 0
325 mol 194 unq 2 iso 1 dist 8.12346 6.26298 8.2654 13.5632 8.83356 11.6097 6.12973 5.52678 10.1796 13.0333 numMergedOcc 0
326 mol 194 unq 2 iso 2 dist 8.83356 13.5632 8.12346 11.6097 8.2654 6.26298 13.0333 5.52678 6.12973 10.1796 numMergedOcc 0
327 mol 194 unq 2 iso 3 dist 8.83356 11.6097 8.2654 13.5632 8.12346 6.26298 13.0333 5.52678 10.1796 6.12973 numMergedOcc 0
328 mol 194 unq 2 iso 4 dist 8.2654 6.26298 8.12346 11.6097 8.83356 13.5632 10.1796 5.52678 6.12973 13.0333 numMergedOcc 0
329 mol 194 unq 2 iso 5 dist 8.2654 11.6097 8.83356 6.26298 8.12346 13.5632 10.1796 5.52678 13.0333 6.12973 numMergedOcc 0
330 mol 194 unq 3 iso 0 dist 8.12346 13.5632 8.83356 6.26298 8.2654 11.6097 11.0239 9.81666 18.6469 13.5457 numMergedOcc 0
331 mol 194 unq 3 iso 1 dist 8.12346 6.26298 8.2654 13.5632 8.83356 11.6097 11.0239 9.81666 13.5457 18.6469 numMergedOcc 0
332 mol 194 unq 3 iso 2 dist 8.83356 13.5632 8.12346 11.6097 8.2654 6.26298 18.6469 9.81666 11.0239 13.5457 numMergedOcc 0
333 mol 194 unq 3 iso 3 dist 8.83356 11.6097 8.2654 13.5632 8.12346 6.26298 18.6469 9.81666 13.5457 11.0239 numMergedOcc 0
334 mol 194 unq 3 iso 4 dist 8.2654 6.26298 8.12346 11.6097 8.83356 13.5632 13.5457 9.81666 11.0239 18.6469 numMergedOcc 0
335 mol 194 unq 3 iso 5 dist 8.2654 11.6097 8.83356 6.26298 8.12346 13.5632 13.5457 9.81666 18.6469 11.0239 numMergedOcc 0
336 mol 218 unq 0 iso 0 dist 6.29367 4.72474 5.76954 6.17651 9.20961 5.61978 6.90702 8.93185 10.4526 8.94041 numMergedOcc 0
337 mol 218 unq 0 iso 1 dist 6.29367 6.17651 9.20961 4.72474 5.76954 5.61978 6.90702 8.93185 8.94041 10.4526 numMergedOcc 0
338 mol 218 unq 0 iso 2 dist 5.76954 4.72474 6.29367 5.61978 9.20961 6.17651 10.4526 8.93185 6.90702 8.94041 numMergedOcc 0
339 mol 218 unq 0 iso 3 dist 5.76954 5.61978 9.20961 4.72474 6.29367 6.17651 10.4526 8.93185 8.94041 6.90702 numMergedOcc 0
340 mol 218 unq 0 iso 4 dist 9.20961 6.17651 6.29367 5.61978 5.76954 4.72474 8.94041 8.93185 6.90702 10.4526 numMergedOcc 0
341 mol 218 unq 0 iso 5 dist 9.20961 5.61978 5.76954 6.17651 6.29367 4.72474 8.94041 8.93185 10.4526 6.90702 numMergedOcc 0
342 mol 238 unq 0 iso 0 dist 6.66971 5.40359 6.4398 10.0191 7.32982 10.1648 10.7508 9.89583 5.87253 10.7551 numMergedOcc 0
343 mol 238 unq 0 iso 1 dist 6.66971 10.0191 7.32982 5.40359 6.4398 10.1648 10.7508 9.89583 10.7551 5.87253 numMergedOcc 0
344 mol 238 unq 0 iso 2 dist 6.4398 5.40359 6.66971 10.1648 7.32982 10.0191 5.87253 9.89583 10.7508 10.7551 numMergedOcc 0
345 mol 238 unq 0 iso 3 dist 6.4398 10.1648 7.32982 5.40359 6.66971 10.0191 5.87253 9.89583 10.7551 10.7508 numMergedOcc 0
346 mol 238 unq 0 iso 4 dist 7.32982 10.0191 6.66971 10.1648 6.4398 5.40359 10.7551 9.89583 10.7508 5.87253 numMergedOcc 0
347 mol 238 unq 0 iso 5 dist 7.32982 10.1648 6.4398 10.0191 6.66971 5.40359 10.7551 9.89583 5.87253 10.7508 numMergedOcc 0
