0 mol 25 unq 0 iso 0 dist 6.16347 9.48085 9.62058 4.79873 5.46578 12.7147 10.9391 7.45383 9.49421 12.3944 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 7.45383 9.49421 9.62058 7.52933 11.0227 16.0628 10.9391 6.16347 9.48085 16.4232 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 7.45383 9.49421 9.62058 6.55597 4.98822 12.1732 10.9391 6.16347 9.48085 11.037 numMergedOcc 0
3 mol 25 unq 3 iso 0 dist 7.45383 9.49421 9.62058 9.71956 10.3547 8.99147 10.9391 6.16347 9.48085 14.581 numMergedOcc 0
4 mol 25 unq 4 iso 0 dist 7.45383 9.49421 9.62058 7.07751 7.91914 9.54872 10.9391 6.16347 9.48085 13.0315 numMergedOcc 0
5 mol 25 unq 5 iso 0 dist 7.45383 9.49421 9.62058 8.23761 11.7069 14.6175 10.9391 6.16347 9.48085 17.2964 numMergedOcc 0
6 mol 25 unq 6 iso 0 dist 9.01548 9.49421 5.38592 7.52933 15.1255 16.0628 10.9391 13.8469 9.48085 16.4232 numMergedOcc 0
7 mol 25 unq 7 iso 0 dist 9.01548 9.49421 5.38592 6.55597 13.4321 12.1732 10.9391 13.8469 9.48085 11.037 numMergedOcc 0
8 mol 25 unq 8 iso 0 dist 9.01548 9.49421 5.38592 9.71956 8.84447 8.99147 10.9391 13.8469 9.48085 14.581 numMergedOcc 0
9 mol 25 unq 9 iso 0 dist 9.01548 9.49421 5.38592 7.07751 9.66912 9.54872 10.9391 13.8469 9.48085 13.0315 numMergedOcc 0
10 mol 25 unq 10 iso 0 dist 9.01548 9.49421 5.38592 8.23761 13.1117 14.6175 10.9391 13.8469 9.48085 17.2964 numMergedOcc 0
11 mol 25 unq 11 iso 0 dist 7.92503 9.48085 10.2758 4.79873 11.0175 12.7147 10.9391 16.8925 9.49421 12.3944 numMergedOcc 0
12 mol 58 unq 0 iso 0 dist 7.68678 8.96727 5.66912 8.01308 5.76523 6.20884 4.81926 5.93884 9.22598 9.55996 numMergedOcc 0
13 mol 73 unq 0 iso 0 dist 6.02816 5.61588 8.26195 8.72682 13.952 9.76138 8.07446 12.4089 5.5087 10.2939 numMergedOcc 0
14 mol 73 unq 1 iso 0 dist 6.02816 5.61588 8.26195 6.45841 6.26495 3.32668 8.07446 12.4089 5.5087 8.62198 numMergedOcc 0
15 mol 73 unq 2 iso 0 dist 6.02816 5.61588 8.26195 7.83244 12.382 5.30471 8.07446 12.4089 5.5087 6.08682 numMergedOcc 0
16 mol 73 unq 3 iso 0 dist 6.02816 7.83244 12.382 8.72682 13.952 5.81659 8.07446 12.4089 6.08682 10.2939 numMergedOcc 0
17 mol 73 unq 4 iso 0 dist 6.02816 7.83244 12.382 6.45841 6.26495 8.07648 8.07446 12.4089 6.08682 8.62198 numMergedOcc 0
18 mol 73 unq 5 iso 0 dist 6.02816 7.83244 12.382 5.61588 8.26195 5.30471 8.07446 12.4089 6.08682 5.5087 numMergedOcc 0
19 mol 95 unq 0 iso 0 dist 9.49454 8.27883 15.7954 5.75428 10.4348 6.27231 6.59884 15.8861 7.7152 10.0848 numMergedOcc 0
20 mol 95 unq 1 iso 0 dist 9.49454 8.27883 15.7954 8.57395 5.88327 11.734 6.59884 15.8861 7.7152 14.2618 numMergedOcc 0
21 mol 95 unq 2 iso 0 dist 9.49454 8.27883 15.7954 9.85409 3.96826 17.4304 6.59884 15.8861 7.7152 15.9129 numMergedOcc 0
22 mol 98 unq 0 iso 0 dist 4.47349 7.54889 3.92737 5.2571 3.94967 6.70343 13.659 12.5931 9.64383 14.0897 numMergedOcc 0
23 mol 98 unq 1 iso 0 dist 4.47349 7.54889 3.92737 5.2571 3.94967 6.70343 5.02887 5.65185 7.78931 8.7497 numMergedOcc 0
24 mol 98 unq 2 iso 0 dist 4.47349 5.2571 3.94967 7.54889 3.92737 6.70343 8.40073 6.7117 5.10496 9.81956 numMergedOcc 0
25 mol 98 unq 3 iso 0 dist 4.47349 5.2571 3.94967 7.54889 3.92737 6.70343 9.42358 9.42961 5.92242 10.8223 numMergedOcc 0
26 mol 98 unq 4 iso 0 dist 4.47349 5.2571 3.94967 7.54889 3.92737 6.70343 5.02887 5.65185 8.7497 7.78931 numMergedOcc 0
27 mol 98 unq 5 iso 0 dist 5.65185 7.78931 3.92737 8.7497 3.94967 6.70343 14.591 12.5931 9.64383 14.0897 numMergedOcc 0
28 mol 98 unq 6 iso 0 dist 5.65185 7.78931 3.92737 8.7497 3.94967 6.70343 5.02887 4.47349 7.54889 5.2571 numMergedOcc 0
29 mol 98 unq 7 iso 0 dist 5.65185 8.7497 3.94967 7.78931 3.92737 6.70343 10.2427 6.7117 5.10496 9.81956 numMergedOcc 0
30 mol 98 unq 8 iso 0 dist 5.65185 8.7497 3.94967 7.78931 3.92737 6.70343 13.9786 9.42961 5.92242 10.8223 numMergedOcc 0
31 mol 98 unq 9 iso 0 dist 5.65185 8.7497 3.94967 7.78931 3.92737 6.70343 5.02887 4.47349 5.2571 7.54889 numMergedOcc 0
32 mol 100 unq 0 iso 0 dist 7.80975 9.21662 12.48 9.90751 15.0328 6.25463 10.8375 14.8081 8.91882 13.2137 numMergedOcc 0
33 mol 134 unq 0 iso 0 dist 9.94764 9.1998 11.5269 8.69531 6.93712 5.83782 11.6064 12.1214 6.42772 9.70973 numMergedOcc 0
34 mol 134 unq 1 iso 0 dist 9.94764 9.1998 11.5269 8.69531 6.93712 5.83782 7.09823 15.049 8.70621 10.3432 numMergedOcc 0
35 mol 134 unq 2 iso 0 dist 9.94764 8.69531 6.93712 9.1998 11.5269 5.83782 6.81259 6.23142 9.33094 11.0808 numMergedOcc 0
36 mol 167 unq 0 iso 0 dist 9.67741 9.2289 8.91275 7.20495 5.43662 9.25262 4.70068 11.6896 7.68266 10.5499 numMergedOcc 0
37 mol 167 unq 1 iso 0 dist 9.67741 9.2289 8.91275 7.20495 5.43662 9.25262 10.3445 12.8466 7.6616 14.1851 numMergedOcc 0
38 mol 167 unq 2 iso 0 dist 9.67741 9.2289 8.91275 7.02548 5.95858 3.55199 4.70068 11.6896 7.68266 6.84752 numMergedOcc 0
39 mol 167 unq 3 iso 0 dist 9.67741 9.2289 8.91275 7.02548 5.95858 3.55199 10.3445 12.8466 7.6616 7.86563 numMergedOcc 0
40 mol 167 unq 4 iso 0 dist 9.67741 7.02548 5.95858 7.20495 5.43662 6.81449 4.70068 11.6896 6.84752 10.5499 numMergedOcc 0
41 mol 167 unq 5 iso 0 dist 9.67741 7.02548 5.95858 7.20495 5.43662 6.81449 10.3445 12.8466 7.86563 14.1851 numMergedOcc 0
42 mol 167 unq 6 iso 0 dist 9.67741 7.02548 5.95858 9.2289 8.91275 3.55199 4.70068 11.6896 6.84752 7.68266 numMergedOcc 0
43 mol 167 unq 7 iso 0 dist 9.67741 7.02548 5.95858 9.2289 8.91275 3.55199 10.3445 12.8466 7.86563 7.6616 numMergedOcc 0
44 mol 181 unq 0 iso 0 dist 5.94469 9.01624 11.9796 6.64173 4.98436 11.196 11.5866 14.8638 5.05973 15.3823 numMergedOcc 0
45 mol 181 unq 1 iso 0 dist 5.94469 9.01624 11.9796 9.55105 12.3589 3.55187 11.5866 14.8638 5.05973 8.40951 numMergedOcc 0
46 mol 235 unq 0 iso 0 dist 8.69356 8.19317 10.0135 6.29377 5.2878 4.8835 7.218 10.3932 5.1823 5.70635 numMergedOcc 0
47 mol 235 unq 1 iso 0 dist 8.69356 6.29377 5.2878 8.19317 10.0135 4.8835 7.218 10.3932 5.70635 5.1823 numMergedOcc 0
48 mol 238 unq 0 iso 0 dist 7.10685 6.99888 6.65214 9.07475 5.37176 3.46869 10.1813 14.7484 9.08509 12.47 numMergedOcc 0
49 mol 259 unq 0 iso 0 dist 7.08526 5.85442 4.47425 6.95511 4.10176 3.51848 9.98105 10.4552 6.9899 10.4017 numMergedOcc 0
50 mol 259 unq 1 iso 0 dist 7.08526 6.95511 4.10176 5.85442 4.47425 3.51848 6.96053 7.98231 9.46361 10.3406 numMergedOcc 0
51 mol 292 unq 0 iso 0 dist 7.83341 9.9182 13.4805 8.9221 8.14131 9.43063 10.3106 16.7493 7.30758 14.8054 numMergedOcc 0
52 mol 292 unq 1 iso 0 dist 7.83341 9.9182 13.4805 8.9221 8.14131 9.43063 12.1693 16.0086 9.10788 8.85064 numMergedOcc 0
53 mol 292 unq 2 iso 0 dist 7.83341 8.9221 8.14131 9.9182 13.4805 9.43063 12.1693 16.0086 8.85064 9.10788 numMergedOcc 0
54 mol 292 unq 3 iso 0 dist 8.87028 7.30758 4.09485 9.46442 6.00981 3.57128 10.3106 10.0775 9.9182 13.4489 numMergedOcc 0
55 mol 292 unq 4 iso 0 dist 8.87028 7.30758 4.09485 9.46442 6.00981 3.57128 12.6861 12.7202 9.10788 9.96037 numMergedOcc 0
56 mol 292 unq 5 iso 0 dist 8.87028 7.30758 4.09485 9.5785 7.31215 10.0941 10.3106 10.0775 9.9182 13.7082 numMergedOcc 0
57 mol 292 unq 6 iso 0 dist 8.87028 7.30758 4.09485 9.5785 7.31215 10.0941 12.6861 12.7202 9.10788 18.9744 numMergedOcc 0
58 mol 292 unq 7 iso 0 dist 8.87028 7.30758 4.09485 9.76319 12.3226 13.2166 10.3106 10.0775 9.9182 18.0254 numMergedOcc 0
59 mol 292 unq 8 iso 0 dist 8.87028 7.30758 4.09485 9.76319 12.3226 13.2166 12.6861 12.7202 9.10788 21.1604 numMergedOcc 0
60 mol 292 unq 9 iso 0 dist 7.07965 8.38121 13.8468 7.20674 13.8094 9.14614 11.8061 18.2597 9.90967 10.1532 numMergedOcc 0
