0 mol 11 unq 0 iso 0 dist 9.07476 9.89387 5.47299 5.23547 9.89425 12.9682 9.46202 6.83186 7.27588 12.0683 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 7.25138 11.1544 7.01397 5.56988 7.16844 11.5628 6.13411 4.46067 7.90686 3.73834 numMergedOcc 0
2 mol 101 unq 0 iso 0 dist 6.67863 6.01775 7.33426 13.2642 9.33112 9.92742 9.54415 8.19144 9.71802 7.5541 numMergedOcc 0
3 mol 101 unq 1 iso 0 dist 6.67863 12.2942 8.17175 13.2642 9.33112 3.73374 9.54415 8.19144 4.97717 7.5541 numMergedOcc 0
4 mol 169 unq 0 iso 0 dist 7.78577 11.8115 6.27378 8.55252 8.6961 7.58935 3.69097 5.10589 10.1931 9.60496 numMergedOcc 0
5 mol 169 unq 1 iso 0 dist 7.78577 11.8115 6.27378 8.55252 8.6961 7.58935 7.14832 4.63336 10.5136 10.5251 numMergedOcc 0
6 mol 169 unq 2 iso 0 dist 7.78577 11.8115 6.27378 8.55252 8.6961 7.58935 8.01356 6.10715 10.212 8.67112 numMergedOcc 0
7 mol 254 unq 0 iso 0 dist 7.89302 4.67942 9.83135 5.06168 5.6417 7.03003 5.81468 7.85841 9.22906 8.8967 numMergedOcc 0
8 mol 254 unq 1 iso 0 dist 7.89302 4.67942 9.83135 5.06168 5.6417 7.03003 8.51317 9.20109 12.319 10.929 numMergedOcc 0
9 mol 254 unq 2 iso 0 dist 7.89302 4.67942 9.83135 6.25965 7.42831 9.54026 5.81468 7.85841 9.22906 9.42679 numMergedOcc 0
10 mol 254 unq 3 iso 0 dist 7.89302 4.67942 9.83135 6.25965 7.42831 9.54026 8.51317 9.20109 12.319 10.706 numMergedOcc 0
11 mol 260 unq 0 iso 0 dist 9.46576 9.87568 4.76164 17.1277 9.73217 14.0954 3.48905 8.62655 9.45061 15.6308 numMergedOcc 0
12 mol 260 unq 1 iso 0 dist 9.46576 9.87568 4.76164 6.73886 7.49606 4.58993 3.48905 8.62655 9.45061 7.35802 numMergedOcc 0
13 mol 260 unq 2 iso 0 dist 9.46576 9.87568 4.76164 11.1586 8.06377 3.69763 3.48905 8.62655 9.45061 10.4054 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 9.35293 11.141 7.74133 10.858 8.20376 15.5262 7.2339 6.96692 13.3554 3.68488 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 9.35293 11.141 7.74133 10.858 8.20376 15.5262 12.15 8.25286 15.2892 3.14784 numMergedOcc 0
16 mol 266 unq 2 iso 0 dist 9.35293 11.141 7.74133 10.858 8.20376 15.5262 14.8334 9.9965 16.6916 5.95721 numMergedOcc 0
17 mol 266 unq 3 iso 0 dist 7.93375 12.1796 7.74133 7.54309 8.20376 15.5262 3.87565 6.96692 13.3554 3.68488 numMergedOcc 0
18 mol 266 unq 4 iso 0 dist 7.93375 12.1796 7.74133 7.54309 8.20376 15.5262 9.25882 8.25286 15.2892 3.14784 numMergedOcc 0
19 mol 266 unq 5 iso 0 dist 7.93375 12.1796 7.74133 7.54309 8.20376 15.5262 12.1357 9.9965 16.6916 5.95721 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 9.40443 5.24841 5.44942 8.85995 8.32982 6.71401 9.94473 6.24487 5.1451 5.55422 numMergedOcc 0
21 mol 287 unq 1 iso 0 dist 9.40443 5.1508 8.53689 8.85995 8.32982 4.06127 9.94473 6.24487 7.5241 5.55422 numMergedOcc 0
22 mol 287 unq 2 iso 0 dist 9.40443 13.9608 7.82157 8.85995 8.32982 10.5401 9.94473 6.24487 5.15725 5.55422 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 9.40443 5.24841 5.44942 8.85995 8.32982 6.71401 9.94473 6.24487 5.1451 5.55422 numMergedOcc 0
24 mol 288 unq 1 iso 0 dist 9.40443 5.1508 8.53689 8.85995 8.32982 4.06127 9.94473 6.24487 7.5241 5.55422 numMergedOcc 0
25 mol 288 unq 2 iso 0 dist 9.40443 13.9608 7.82157 8.85995 8.32982 10.5401 9.94473 6.24487 5.15725 5.55422 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 9.40443 5.24841 5.44942 8.85995 8.32982 6.71401 9.94473 6.24487 5.1451 5.55422 numMergedOcc 0
27 mol 289 unq 1 iso 0 dist 9.40443 5.1508 8.53689 8.85995 8.32982 4.06127 9.94473 6.24487 7.5241 5.55422 numMergedOcc 0
28 mol 289 unq 2 iso 0 dist 9.40443 13.9608 7.82157 8.85995 8.32982 10.5401 9.94473 6.24487 5.15725 5.55422 numMergedOcc 0
