0 mol 72 unq 0 iso 0 dist 6.21799 5.03251 3.43675 7.04035 9.74228 10.7906 6.11922 9.14817 9.76686 6.00418 7.66093 5.75711 5.26077 12.952 9.437 numMergedOcc 0
1 mol 72 unq 1 iso 0 dist 6.21799 5.03251 3.43675 8.24309 7.12321 9.35457 6.11922 9.14817 9.76686 9.0131 7.66093 5.75711 5.26077 12.1131 9.437 numMergedOcc 0
2 mol 72 unq 2 iso 0 dist 6.21799 7.66093 5.75711 7.04035 9.74228 12.952 6.11922 9.14817 9.437 6.00418 5.03251 3.43675 5.26077 10.7906 9.76686 numMergedOcc 0
3 mol 72 unq 3 iso 0 dist 6.21799 7.66093 5.75711 8.24309 7.12321 12.1131 6.11922 9.14817 9.437 9.0131 5.03251 3.43675 5.26077 9.35457 9.76686 numMergedOcc 0
4 mol 72 unq 4 iso 0 dist 5.03251 6.21799 3.43675 5.8486 9.56773 10.9808 6.11922 9.76686 9.14817 9.93049 7.66093 5.26077 5.75711 13.336 9.437 numMergedOcc 0
5 mol 72 unq 5 iso 0 dist 5.03251 7.66093 5.26077 5.8486 9.56773 13.336 6.11922 9.76686 9.437 9.93049 6.21799 3.43675 5.75711 10.9808 9.14817 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 6.85523 5.77326 8.2592 7.19663 8.65848 12.35 4.92509 5.47706 8.07568 5.22036 11.5776 7.95975 15.4762 7.25801 8.89842 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 8.65848 7.25801 7.95975 7.19663 6.85523 11.5776 5.22036 5.47706 8.89842 4.92509 12.35 8.2592 15.4762 5.77326 8.07568 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 5.92242 7.02507 9.6331 9.51923 5.10496 9.89095 9.74284 6.61111 14.6927 8.70415 10.8223 6.70343 16.1571 9.81956 4.44979 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 5.92242 7.02507 9.6331 9.42358 5.2571 12.7417 9.74284 6.61111 14.6927 10.0962 10.8223 6.70343 16.1571 7.54889 4.44979 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 5.92242 7.02507 9.6331 13.9786 8.7497 17.1287 9.74284 6.61111 14.6927 11.2452 10.8223 6.70343 16.1571 7.78931 4.44979 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 9.10524 6.42772 7.62195 14.069 9.00918 11.8779 14.0644 5.73203 11.8267 5.9915 10.6728 4.87973 6.05407 7.99477 6.57379 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 6.42772 9.10524 7.62195 11.6064 9.1998 12.1179 5.31077 6.44575 10.3419 6.74887 9.70973 5.83782 13.208 8.69531 7.43401 numMergedOcc 0
13 mol 134 unq 2 iso 0 dist 6.42772 9.10524 7.62195 13.7309 8.70621 9.69086 5.31077 6.44575 10.3419 10.9715 9.70973 5.83782 13.208 10.3432 7.43401 numMergedOcc 0
14 mol 134 unq 3 iso 0 dist 5.35237 8.70621 6.05407 6.90348 7.99477 11.8779 8.96357 6.57379 11.8267 5.9915 9.69086 4.87973 7.62195 9.00918 5.73203 numMergedOcc 0
15 mol 134 unq 4 iso 0 dist 8.70621 5.35237 6.05407 13.7309 6.42772 10.6728 10.9715 6.44575 10.0977 5.31077 10.3432 5.83782 10.5379 9.70973 7.43401 numMergedOcc 0
16 mol 134 unq 5 iso 0 dist 8.70621 5.35237 6.05407 7.09823 9.1998 9.71716 10.9715 6.44575 10.0977 6.74887 10.3432 5.83782 10.5379 8.69531 7.43401 numMergedOcc 0
17 mol 167 unq 0 iso 0 dist 6.84752 7.68266 3.55199 6.44246 7.86563 7.6616 7.69326 7.30954 10.5288 9.46955 10.5499 6.81449 9.25262 14.1851 9.1326 numMergedOcc 0
18 mol 167 unq 1 iso 0 dist 6.84752 7.68266 3.55199 4.70068 7.02548 9.2289 7.69326 7.30954 10.5288 6.36909 10.5499 6.81449 9.25262 7.20495 9.1326 numMergedOcc 0
19 mol 167 unq 2 iso 0 dist 7.86563 7.6616 3.55199 6.44246 6.84752 7.68266 9.46955 7.30954 10.5288 7.69326 14.1851 6.81449 9.25262 10.5499 9.1326 numMergedOcc 0
20 mol 167 unq 3 iso 0 dist 7.86563 7.6616 3.55199 10.3445 7.02548 9.2289 9.46955 7.30954 10.5288 6.36909 14.1851 6.81449 9.25262 7.20495 9.1326 numMergedOcc 0
21 mol 167 unq 4 iso 0 dist 7.02548 9.2289 3.55199 4.70068 6.84752 7.68266 6.36909 7.30954 10.5288 7.69326 7.20495 6.81449 9.25262 10.5499 9.1326 numMergedOcc 0
22 mol 167 unq 5 iso 0 dist 7.02548 9.2289 3.55199 10.3445 7.86563 7.6616 6.36909 7.30954 10.5288 9.46955 7.20495 6.81449 9.25262 14.1851 9.1326 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 9.01624 6.64173 11.196 11.5866 5.05973 15.3823 6.7991 6.76746 9.09234 8.35755 9.55105 3.55187 10.1041 8.40951 8.92098 numMergedOcc 0
24 mol 181 unq 1 iso 0 dist 9.01624 9.55105 3.55187 11.5866 5.05973 8.40951 6.7991 6.76746 8.92098 8.35755 6.64173 11.196 10.1041 15.3823 9.09234 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 6.50998 9.09424 8.05944 13.3965 8.1945 14.7849 8.69249 8.91356 11.0655 10.7506 11.7112 9.9109 4.94506 14.181 9.57455 numMergedOcc 0
26 mol 225 unq 1 iso 0 dist 6.50998 8.14831 13.7858 13.3965 8.1945 21.1757 8.69249 8.91356 13.9144 10.7506 11.7112 9.9109 14.2631 14.181 9.57455 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 6.99888 9.07475 3.46869 10.1813 9.08509 12.47 5.54325 5.43613 8.82776 5.17471 8.63015 11.1752 13.8133 10.1172 7.24334 numMergedOcc 0
28 mol 238 unq 1 iso 0 dist 6.99888 9.07475 3.46869 10.1813 9.08509 12.47 10.0613 7.06768 9.82327 5.03393 14.3724 8.33582 9.64248 9.7696 9.08687 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 5.85442 6.95511 3.51848 9.98105 6.9899 10.4017 5.79468 6.23661 9.43105 5.31048 11.7465 8.0048 10.1712 8.03219 8.84648 numMergedOcc 0
30 mol 292 unq 0 iso 0 dist 9.9182 8.9221 9.43063 10.3106 7.30758 14.8054 18.0293 8.73515 15.6627 12.1551 17.5894 8.21724 13.253 14.4052 6.1905 numMergedOcc 0
31 mol 292 unq 1 iso 0 dist 9.9182 8.9221 9.43063 10.3106 7.30758 14.8054 18.0293 8.73515 15.6627 12.1551 13.4489 3.57128 11.4257 9.46442 5.84792 numMergedOcc 0
32 mol 292 unq 2 iso 0 dist 9.9182 8.9221 9.43063 12.1693 9.10788 8.85064 18.0293 8.73515 15.6627 10.8709 17.5894 8.21724 13.253 12.0935 6.1905 numMergedOcc 0
33 mol 292 unq 3 iso 0 dist 9.9182 8.9221 9.43063 12.1693 9.10788 8.85064 18.0293 8.73515 15.6627 10.8709 13.4489 3.57128 11.4257 9.96037 5.84792 numMergedOcc 0
34 mol 292 unq 4 iso 0 dist 7.30758 9.46442 3.57128 10.3106 9.9182 13.4489 12.1551 8.73515 5.84792 18.0293 14.4052 8.21724 4.99426 17.5894 6.1905 numMergedOcc 0
35 mol 292 unq 5 iso 0 dist 7.30758 9.46442 3.57128 12.6861 9.10788 9.96037 12.1551 8.73515 5.84792 10.8709 14.4052 8.21724 4.99426 12.0935 6.1905 numMergedOcc 0
36 mol 292 unq 6 iso 0 dist 7.30758 9.5785 10.0941 10.3106 9.9182 13.7082 12.1551 8.73515 15.8988 18.0293 14.4052 8.21724 14.9392 17.5894 6.1905 numMergedOcc 0
37 mol 292 unq 7 iso 0 dist 7.30758 9.5785 10.0941 10.3106 9.9182 13.7082 12.1551 8.73515 15.8988 18.0293 9.46442 3.57128 11.3907 13.4489 5.84792 numMergedOcc 0
38 mol 292 unq 8 iso 0 dist 7.30758 9.5785 10.0941 12.6861 9.10788 18.9744 12.1551 8.73515 15.8988 10.8709 14.4052 8.21724 14.9392 12.0935 6.1905 numMergedOcc 0
39 mol 292 unq 9 iso 0 dist 7.30758 9.5785 10.0941 12.6861 9.10788 18.9744 12.1551 8.73515 15.8988 10.8709 9.46442 3.57128 11.3907 9.96037 5.84792 numMergedOcc 0
40 mol 292 unq 10 iso 0 dist 7.30758 9.76319 13.2166 10.3106 9.9182 18.0254 12.1551 8.73515 15.8206 18.0293 14.4052 8.21724 17.1484 17.5894 6.1905 numMergedOcc 0
41 mol 292 unq 11 iso 0 dist 7.30758 9.76319 13.2166 10.3106 9.9182 18.0254 12.1551 8.73515 15.8206 18.0293 9.46442 3.57128 13.609 13.4489 5.84792 numMergedOcc 0
42 mol 292 unq 12 iso 0 dist 7.30758 9.76319 13.2166 12.6861 9.10788 21.1604 12.1551 8.73515 15.8206 10.8709 14.4052 8.21724 17.1484 12.0935 6.1905 numMergedOcc 0
43 mol 292 unq 13 iso 0 dist 7.30758 9.76319 13.2166 12.6861 9.10788 21.1604 12.1551 8.73515 15.8206 10.8709 9.46442 3.57128 13.609 9.96037 5.84792 numMergedOcc 0
44 mol 292 unq 14 iso 0 dist 9.10788 8.85064 9.43063 12.1693 9.9182 8.9221 10.8709 8.73515 15.6627 18.0293 12.0935 8.21724 13.253 17.5894 6.1905 numMergedOcc 0
45 mol 292 unq 15 iso 0 dist 9.10788 8.85064 9.43063 12.1693 9.9182 8.9221 10.8709 8.73515 15.6627 18.0293 9.96037 3.57128 11.4257 13.4489 5.84792 numMergedOcc 0
46 mol 292 unq 16 iso 0 dist 9.10788 8.85064 9.43063 12.6861 7.30758 14.8054 10.8709 8.73515 15.6627 12.1551 12.0935 8.21724 13.253 14.4052 6.1905 numMergedOcc 0
47 mol 292 unq 17 iso 0 dist 9.10788 8.85064 9.43063 12.6861 7.30758 14.8054 10.8709 8.73515 15.6627 12.1551 9.96037 3.57128 11.4257 9.46442 5.84792 numMergedOcc 0
