0 mol 5 unq 0 iso 0 dist 9.58876 9.05086 8.68577 10.7066 3.50411 7.64769 4.32004 8.13672 4.73885 8.31759 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 9.58876 9.05086 8.68577 14.1917 5.30421 9.70883 20.2058 12.7584 16.0393 9.65565 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 9.58876 4.32004 8.13672 10.7066 3.50411 8.31759 9.05086 8.68577 4.73885 7.64769 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 6.61697 5.70681 5.31126 9.12562 5.7147 4.49669 5.08157 7.16619 2.75715 5.88896 numMergedOcc 0
4 mol 113 unq 1 iso 0 dist 6.61697 5.08157 7.16619 9.12562 5.7147 5.88896 5.70681 5.31126 2.75715 4.49669 numMergedOcc 0
5 mol 113 unq 2 iso 0 dist 6.36631 5.86518 5.31126 6.24308 2.75715 7.16619 4.8668 4.49669 5.7147 5.88896 numMergedOcc 0
6 mol 113 unq 3 iso 0 dist 6.36631 4.8668 4.49669 6.24308 2.75715 5.88896 5.86518 5.31126 5.7147 7.16619 numMergedOcc 0
7 mol 113 unq 4 iso 0 dist 6.24308 5.86518 7.16619 6.36631 2.75715 5.31126 4.8668 5.88896 5.7147 4.49669 numMergedOcc 0
8 mol 113 unq 5 iso 0 dist 6.24308 5.86518 7.16619 6.36631 2.75715 5.31126 8.60367 7.84239 8.09465 6.00221 numMergedOcc 0
9 mol 113 unq 6 iso 0 dist 6.24308 4.8668 5.88896 6.36631 2.75715 4.49669 5.86518 7.16619 5.7147 5.31126 numMergedOcc 0
10 mol 113 unq 7 iso 0 dist 6.24308 4.8668 5.88896 6.36631 2.75715 4.49669 8.60367 7.84239 3.74304 6.00221 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 9.60192 7.33656 5.86379 12.3841 3.66281 8.64686 10.5073 6.21029 3.19822 8.16325 numMergedOcc 0
12 mol 115 unq 1 iso 0 dist 9.60192 10.5073 6.21029 12.3841 3.66281 8.16325 7.33656 5.86379 3.19822 8.64686 numMergedOcc 0
13 mol 115 unq 2 iso 0 dist 9.82655 10.5817 5.86379 10.4156 3.19822 6.21029 13.8778 8.64686 3.66281 8.16325 numMergedOcc 0
14 mol 115 unq 3 iso 0 dist 9.82655 13.8778 8.64686 10.4156 3.19822 8.16325 10.5817 5.86379 3.66281 6.21029 numMergedOcc 0
15 mol 120 unq 0 iso 0 dist 8.0889 8.14689 7.84207 8.34958 5.26524 6.98791 13.2872 11.8836 5.7181 9.31385 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 9.32969 7.35757 5.10542 10.261 3.78714 4.68722 7.99136 7.52366 5.61057 5.18325 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 8.47283 10.816 9.93489 10.2826 2.95898 8.32259 4.27546 7.64057 8.59834 8.54737 numMergedOcc 0
18 mol 204 unq 1 iso 0 dist 8.47283 4.27546 7.64057 10.2826 2.95898 8.54737 10.816 9.93489 8.59834 8.32259 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 7.93054 4.26898 7.42759 9.57294 2.86233 7.96338 12.7192 10.7359 10.5332 8.66082 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 7.96613 6.80038 7.8598 14.3456 11.938 8.25286 12.2573 10.9313 5.76129 6.96692 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 7.96613 6.80038 7.8598 14.3456 11.938 8.25286 4.5731 7.80711 3.00605 9.9965 numMergedOcc 0
22 mol 266 unq 2 iso 0 dist 7.96613 4.5731 7.80711 14.3456 11.938 9.9965 12.2573 10.9313 8.75066 6.96692 numMergedOcc 0
23 mol 266 unq 3 iso 0 dist 7.96613 4.5731 7.80711 14.3456 11.938 9.9965 6.80038 7.8598 3.00605 8.25286 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 8.70774 14.9564 7.98956 19.8814 13.9697 6.79748 18.5392 11.2004 3.75238 6.53598 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 7.73997 9.39306 6.53598 11.2898 3.75238 6.79748 18.6183 11.2004 13.9697 7.98956 numMergedOcc 0
26 mol 277 unq 2 iso 0 dist 7.73997 9.39306 6.53598 11.2898 3.75238 6.79748 15.5444 8.41856 12.1514 5.86185 numMergedOcc 0
27 mol 281 unq 0 iso 0 dist 9.73306 12.2582 7.90368 17.1358 12.7734 6.69267 15.7178 9.46544 3.77058 6.56886 numMergedOcc 0
28 mol 281 unq 1 iso 0 dist 7.8046 7.60311 7.90368 11.1901 12.7734 6.69267 11.1675 9.46544 3.77058 6.56886 numMergedOcc 0
29 mol 281 unq 2 iso 0 dist 7.5689 9.10512 6.56886 11.1004 3.77058 6.69267 15.5309 9.46544 12.7734 7.90368 numMergedOcc 0
