0 mol 0 unq 0 iso 0 dist 9.16606 9.83355 14.8746 5.47921 11.788 6.26831 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.16606 8.88219 10.6886 7.49611 15.8319 9.56794 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 6.96907 9.03822 4.95703 5.12111 5.68648 7.92414 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 8.0757 9.01516 8.80788 14.3481 15.7264 8.63486 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 5.68894 8.0534 9.94048 4.91508 5.36012 8.03303 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 7.32265 8.0534 6.88106 4.91508 6.3777 8.03303 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 9.20236 9.60416 16.4595 11.8887 20.7325 7.26086 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 8.75093 6.07991 11.4872 9.52181 10.8086 6.34525 numMergedOcc 0
8 mol 126 unq 0 iso 0 dist 9.63161 9.31118 8.49668 5.50061 10.2273 9.46588 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 6.21554 7.67321 6.00932 13.9674 15.1302 9.28592 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 9.82274 6.39075 10.1254 5.90361 12.3814 8.56003 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 9.61 9.95533 9.74349 5.65454 10.5027 5.49226 numMergedOcc 0
12 mol 147 unq 1 iso 0 dist 9.61 9.95533 9.74349 10.1056 13.0689 6.28351 numMergedOcc 0
13 mol 170 unq 0 iso 0 dist 9.15159 5.59924 6.59428 7.62198 13.5939 8.15099 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 9.58817 6.86144 14.864 5.65167 15.1168 6.51749 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 9.58817 6.86144 14.864 9.23179 15.6336 7.20392 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 7.6409 9.03496 4.89182 11.4876 11.2123 6.72641 numMergedOcc 0
17 mol 203 unq 0 iso 0 dist 7.72215 6.97422 4.58862 11.7852 13.1246 8.72527 numMergedOcc 0
18 mol 203 unq 1 iso 0 dist 5.46529 6.97422 5.82861 11.7852 13.1177 8.72527 numMergedOcc 0
19 mol 209 unq 0 iso 0 dist 6.74526 9.93982 9.79525 9.80484 14.282 8.41195 numMergedOcc 0
20 mol 209 unq 1 iso 0 dist 8.12326 9.93982 7.48645 9.80484 13.2724 8.41195 numMergedOcc 0
21 mol 209 unq 2 iso 0 dist 8.20431 9.9518 7.48645 11.2558 13.2724 8.41195 numMergedOcc 0
22 mol 209 unq 3 iso 0 dist 8.8886 9.9518 3.88024 11.2558 9.62543 8.41195 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 9.01742 9.28463 14.7066 4.99401 13.3195 6.66971 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 9.01742 9.28463 14.7066 5.07768 11.9194 6.4398 numMergedOcc 0
25 mol 238 unq 2 iso 0 dist 9.01742 9.28463 14.7066 9.99053 10.5485 7.32982 numMergedOcc 0
26 mol 264 unq 0 iso 0 dist 7.27155 9.54836 10.1043 6.46871 9.77155 7.52281 numMergedOcc 0
27 mol 264 unq 1 iso 0 dist 7.27155 9.54836 10.1043 6.62911 10.1365 6.42588 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 7.79173 9.44207 5.99306 7.26296 9.65027 7.44083 numMergedOcc 0
29 mol 282 unq 0 iso 0 dist 8.30313 7.44868 9.69725 6.00521 11.4098 8.0241 numMergedOcc 0
30 mol 282 unq 1 iso 0 dist 6.51248 7.44868 5.63803 6.00521 10.4378 8.0241 numMergedOcc 0
