0 mol 25 unq 0 iso 0 dist 9.48085 4.79873 12.7147 10.9391 9.49421 12.3944 11.037 12.1732 9.7883 6.55597 numMergedOcc 0
1 mol 25 unq 0 iso 1 dist 9.49421 6.55597 12.1732 10.9391 9.48085 11.037 12.3944 12.7147 9.7883 4.79873 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 9.48085 4.79873 12.7147 10.9391 9.49421 12.3944 14.581 8.99147 15.122 9.71956 numMergedOcc 0
3 mol 25 unq 1 iso 1 dist 9.49421 9.71956 8.99147 10.9391 9.48085 14.581 12.3944 12.7147 15.122 4.79873 numMergedOcc 0
4 mol 25 unq 2 iso 0 dist 9.48085 4.79873 12.7147 10.9391 9.49421 12.3944 13.0315 9.54872 13.1326 7.07751 numMergedOcc 0
5 mol 25 unq 2 iso 1 dist 9.49421 7.07751 9.54872 10.9391 9.48085 13.0315 12.3944 12.7147 13.1326 4.79873 numMergedOcc 0
6 mol 25 unq 3 iso 0 dist 9.48085 4.79873 12.7147 10.9391 9.49421 12.3944 17.2964 14.6175 16.9783 8.23761 numMergedOcc 0
7 mol 25 unq 3 iso 1 dist 9.49421 8.23761 14.6175 10.9391 9.48085 17.2964 12.3944 12.7147 16.9783 4.79873 numMergedOcc 0
8 mol 25 unq 4 iso 0 dist 9.48085 4.79873 12.7147 10.9391 9.49421 12.3944 16.4232 16.0628 15.7823 7.52933 numMergedOcc 0
9 mol 25 unq 4 iso 1 dist 9.49421 7.52933 16.0628 10.9391 9.48085 16.4232 12.3944 12.7147 15.7823 4.79873 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 5.5087 6.08682 5.30471 8.07446 5.61588 7.83244 10.2939 9.76138 5.81659 8.72682 numMergedOcc 0
11 mol 73 unq 0 iso 1 dist 5.61588 8.72682 9.76138 8.07446 5.5087 10.2939 7.83244 5.30471 5.81659 6.08682 numMergedOcc 0
12 mol 73 unq 1 iso 0 dist 5.5087 6.08682 5.30471 8.07446 5.61588 7.83244 8.62198 3.32668 8.07648 6.45841 numMergedOcc 0
13 mol 73 unq 1 iso 1 dist 5.61588 6.45841 3.32668 8.07446 5.5087 8.62198 7.83244 5.30471 8.07648 6.08682 numMergedOcc 0
14 mol 73 unq 2 iso 0 dist 6.08682 5.5087 5.30471 8.07446 7.83244 5.61588 10.2939 5.81659 9.76138 8.72682 numMergedOcc 0
15 mol 73 unq 2 iso 1 dist 7.83244 8.72682 5.81659 8.07446 6.08682 10.2939 5.61588 5.30471 9.76138 5.5087 numMergedOcc 0
16 mol 73 unq 3 iso 0 dist 6.08682 5.5087 5.30471 8.07446 7.83244 5.61588 8.62198 8.07648 3.32668 6.45841 numMergedOcc 0
17 mol 73 unq 3 iso 1 dist 7.83244 6.45841 8.07648 8.07446 6.08682 8.62198 5.61588 5.30471 3.32668 5.5087 numMergedOcc 0
18 mol 78 unq 0 iso 0 dist 6.85523 5.77326 8.2592 7.19663 8.65848 12.35 11.5776 7.95975 15.4762 7.25801 numMergedOcc 0
19 mol 78 unq 0 iso 1 dist 8.65848 7.25801 7.95975 7.19663 6.85523 11.5776 12.35 8.2592 15.4762 5.77326 numMergedOcc 0
20 mol 98 unq 0 iso 0 dist 5.92242 7.02507 9.6331 9.42358 5.2571 12.7417 10.8223 6.70343 16.1571 7.54889 numMergedOcc 0
21 mol 98 unq 0 iso 1 dist 5.2571 7.54889 6.70343 9.42358 5.92242 10.8223 12.7417 9.6331 16.1571 7.02507 numMergedOcc 0
22 mol 98 unq 1 iso 0 dist 5.92242 7.02507 9.6331 13.9786 8.7497 17.1287 10.8223 6.70343 16.1571 7.78931 numMergedOcc 0
23 mol 98 unq 1 iso 1 dist 8.7497 7.78931 6.70343 13.9786 5.92242 10.8223 17.1287 9.6331 16.1571 7.02507 numMergedOcc 0
24 mol 134 unq 0 iso 0 dist 9.10524 6.42772 7.62195 14.069 9.00918 11.8779 10.6728 4.87973 6.05407 7.99477 numMergedOcc 0
25 mol 134 unq 0 iso 1 dist 9.00918 7.99477 4.87973 14.069 9.10524 10.6728 11.8779 7.62195 6.05407 6.42772 numMergedOcc 0
26 mol 134 unq 1 iso 0 dist 6.42772 9.10524 7.62195 11.6064 9.1998 12.1179 9.70973 5.83782 13.208 8.69531 numMergedOcc 0
27 mol 134 unq 1 iso 1 dist 9.1998 8.69531 5.83782 11.6064 6.42772 9.70973 12.1179 7.62195 13.208 9.10524 numMergedOcc 0
28 mol 134 unq 2 iso 0 dist 6.42772 9.10524 7.62195 13.7309 8.70621 9.69086 10.6728 6.05407 4.87973 5.35237 numMergedOcc 0
29 mol 134 unq 2 iso 1 dist 8.70621 5.35237 6.05407 13.7309 6.42772 10.6728 9.69086 7.62195 4.87973 9.10524 numMergedOcc 0
30 mol 134 unq 2 iso 0 dist 9.1998 8.69531 5.83782 7.09823 8.70621 10.3432 9.71716 6.05407 10.5379 5.35237 numMergedOcc 0
31 mol 134 unq 2 iso 1 dist 8.70621 5.35237 6.05407 7.09823 9.1998 9.71716 10.3432 5.83782 10.5379 8.69531 numMergedOcc 0
32 mol 134 unq 3 iso 0 dist 5.35237 8.70621 6.05407 6.90348 7.99477 11.8779 9.69086 4.87973 7.62195 9.00918 numMergedOcc 0
33 mol 134 unq 3 iso 1 dist 7.99477 9.00918 4.87973 6.90348 5.35237 9.69086 11.8779 6.05407 7.62195 8.70621 numMergedOcc 0
34 mol 167 unq 0 iso 0 dist 7.68266 6.84752 3.55199 4.70068 9.2289 7.02548 10.5499 9.25262 6.81449 7.20495 numMergedOcc 0
35 mol 167 unq 0 iso 1 dist 9.2289 7.20495 9.25262 4.70068 7.68266 10.5499 7.02548 3.55199 6.81449 6.84752 numMergedOcc 0
36 mol 167 unq 1 iso 0 dist 6.84752 7.68266 3.55199 4.70068 7.02548 9.2289 10.5499 6.81449 9.25262 7.20495 numMergedOcc 0
37 mol 167 unq 1 iso 1 dist 7.02548 7.20495 6.81449 4.70068 6.84752 10.5499 9.2289 3.55199 9.25262 7.68266 numMergedOcc 0
38 mol 167 unq 2 iso 0 dist 7.6616 7.86563 3.55199 10.3445 9.2289 7.02548 14.1851 9.25262 6.81449 7.20495 numMergedOcc 0
39 mol 167 unq 2 iso 1 dist 9.2289 7.20495 9.25262 10.3445 7.6616 14.1851 7.02548 3.55199 6.81449 7.86563 numMergedOcc 0
40 mol 167 unq 3 iso 0 dist 7.86563 7.6616 3.55199 10.3445 7.02548 9.2289 14.1851 6.81449 9.25262 7.20495 numMergedOcc 0
41 mol 167 unq 3 iso 1 dist 7.02548 7.20495 6.81449 10.3445 7.86563 14.1851 9.2289 3.55199 9.25262 7.6616 numMergedOcc 0
42 mol 192 unq 0 iso 0 dist 5.64942 9.78634 5.9655 5.76246 6.97962 12.8149 7.43054 3.60331 7.70298 6.79229 numMergedOcc 0
43 mol 192 unq 0 iso 1 dist 6.97962 6.79229 3.60331 5.76246 5.64942 7.43054 12.8149 5.9655 7.70298 9.78634 numMergedOcc 0
44 mol 192 unq 1 iso 0 dist 7.43054 9.78634 7.70298 5.76246 6.79229 12.8149 5.64942 3.60331 5.9655 6.97962 numMergedOcc 0
45 mol 192 unq 1 iso 1 dist 6.79229 6.97962 3.60331 5.76246 7.43054 5.64942 12.8149 7.70298 5.9655 9.78634 numMergedOcc 0
46 mol 207 unq 0 iso 0 dist 9.98372 9.1528 4.66347 5.99308 6.0563 8.1244 10.4761 6.07936 10.1734 5.12567 numMergedOcc 0
47 mol 207 unq 0 iso 1 dist 6.0563 5.12567 6.07936 5.99308 9.98372 10.4761 8.1244 4.66347 10.1734 9.1528 numMergedOcc 0
48 mol 207 unq 1 iso 0 dist 9.1528 9.98372 4.66347 5.99308 8.1244 6.0563 10.4761 10.1734 6.07936 5.12567 numMergedOcc 0
49 mol 207 unq 1 iso 1 dist 8.1244 5.12567 10.1734 5.99308 9.1528 10.4761 6.0563 4.66347 6.07936 9.98372 numMergedOcc 0
50 mol 259 unq 0 iso 0 dist 5.85442 6.95511 3.51848 9.98105 6.9899 10.4017 11.7465 8.0048 10.1712 8.03219 numMergedOcc 0
51 mol 259 unq 0 iso 1 dist 6.9899 8.03219 8.0048 9.98105 5.85442 11.7465 10.4017 3.51848 10.1712 6.95511 numMergedOcc 0
52 mol 277 unq 0 iso 0 dist 5.46926 5.13913 3.39114 7.08227 8.9682 6.92711 14.9313 16.9644 15.8851 9.35539 numMergedOcc 0
53 mol 277 unq 0 iso 1 dist 8.9682 9.35539 16.9644 7.08227 5.46926 14.9313 6.92711 3.39114 15.8851 5.13913 numMergedOcc 0
54 mol 277 unq 1 iso 0 dist 5.13913 5.46926 3.39114 7.08227 6.92711 8.9682 14.9313 15.8851 16.9644 9.35539 numMergedOcc 0
55 mol 277 unq 1 iso 1 dist 6.92711 9.35539 15.8851 7.08227 5.13913 14.9313 8.9682 3.39114 16.9644 5.46926 numMergedOcc 0
56 mol 292 unq 0 iso 0 dist 9.9182 8.9221 9.43063 10.3106 7.30758 14.8054 13.4489 3.57128 11.4257 9.46442 numMergedOcc 0
57 mol 292 unq 0 iso 1 dist 7.30758 9.46442 3.57128 10.3106 9.9182 13.4489 14.8054 9.43063 11.4257 8.9221 numMergedOcc 0
58 mol 292 unq 1 iso 0 dist 9.9182 8.9221 9.43063 10.3106 7.30758 14.8054 13.7082 10.0941 17.0742 9.5785 numMergedOcc 0
59 mol 292 unq 1 iso 1 dist 7.30758 9.5785 10.0941 10.3106 9.9182 13.7082 14.8054 9.43063 17.0742 8.9221 numMergedOcc 0
60 mol 292 unq 2 iso 0 dist 9.9182 8.9221 9.43063 10.3106 7.30758 14.8054 18.0254 13.2166 21.9463 9.76319 numMergedOcc 0
61 mol 292 unq 2 iso 1 dist 7.30758 9.76319 13.2166 10.3106 9.9182 18.0254 14.8054 9.43063 21.9463 8.9221 numMergedOcc 0
62 mol 292 unq 1 iso 0 dist 7.30758 9.46442 3.57128 12.6861 9.10788 9.96037 14.8054 9.43063 11.4257 8.85064 numMergedOcc 0
63 mol 292 unq 1 iso 1 dist 9.10788 8.85064 9.43063 12.6861 7.30758 14.8054 9.96037 3.57128 11.4257 9.46442 numMergedOcc 0
64 mol 292 unq 2 iso 0 dist 7.30758 9.5785 10.0941 12.6861 9.10788 18.9744 14.8054 9.43063 17.0742 8.85064 numMergedOcc 0
65 mol 292 unq 2 iso 1 dist 9.10788 8.85064 9.43063 12.6861 7.30758 14.8054 18.9744 10.0941 17.0742 9.5785 numMergedOcc 0
66 mol 292 unq 3 iso 0 dist 7.30758 9.76319 13.2166 12.6861 9.10788 21.1604 14.8054 9.43063 21.9463 8.85064 numMergedOcc 0
67 mol 292 unq 3 iso 1 dist 9.10788 8.85064 9.43063 12.6861 7.30758 14.8054 21.1604 13.2166 21.9463 9.76319 numMergedOcc 0
68 mol 292 unq 4 iso 0 dist 9.90967 9.9886 8.10966 11.8061 8.38121 10.9396 10.1532 9.14614 5.26492 7.20674 numMergedOcc 0
69 mol 292 unq 4 iso 1 dist 8.38121 7.20674 9.14614 11.8061 9.90967 10.1532 10.9396 8.10966 5.26492 9.9886 numMergedOcc 0
