0 mol 10 unq 0 iso 0 dist 6.50444 5.94361 6.18431 6.23648 7.14537 5.83346 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 6.50444 5.94361 6.18431 4.87706 9.39486 4.99208 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.94703 4.04757 9.98592 6.58064 8.69288 5.32861 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.94703 4.04757 9.98592 6.40447 7.77964 3.84336 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 5.77745 4.32173 5.20109 5.23233 8.07318 4.98822 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 5.77745 4.32173 5.20109 6.29702 7.44277 5.46578 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 9.22183 3.9882 9.96912 9.43588 8.96682 12.358 numMergedOcc 0
7 mol 30 unq 0 iso 0 dist 5.14358 6.06435 5.22979 4.61651 7.27243 4.02746 numMergedOcc 0
8 mol 30 unq 1 iso 0 dist 5.14358 6.06435 5.22979 5.34619 8.23784 5.67846 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 9.762 7.25285 5.7684 10.8441 8.46627 12.3893 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 9.762 7.25285 5.7684 15.2203 9.22208 14.6305 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 6.63973 13.5835 8.77077 12.8806 9.08825 5.44918 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 9.54368 4.16536 8.98912 6.58337 8.89015 3.71113 numMergedOcc 0
13 mol 92 unq 1 iso 0 dist 9.54368 9.64683 8.93769 6.58337 8.89015 4.52323 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 9.46621 4.03135 7.56755 9.78374 9.09348 5.92927 numMergedOcc 0
15 mol 109 unq 1 iso 0 dist 9.94704 4.81814 7.56755 8.08642 9.09348 5.92927 numMergedOcc 0
16 mol 112 unq 0 iso 0 dist 4.77996 6.43704 6.11407 4.45743 7.31064 10.4943 numMergedOcc 0
17 mol 184 unq 0 iso 0 dist 8.27396 12.4352 7.58375 6.60692 4.61596 7.81466 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 9.18289 6.33168 6.56416 5.33968 5.67168 3.87169 numMergedOcc 0
19 mol 186 unq 1 iso 0 dist 9.18289 6.33168 6.56416 10.1509 7.74579 5.97542 numMergedOcc 0
20 mol 186 unq 2 iso 0 dist 9.18289 6.33168 6.56416 10.9974 5.86483 5.65634 numMergedOcc 0
21 mol 186 unq 3 iso 0 dist 6.26168 5.18732 9.99396 3.6848 8.5672 4.03697 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 9.27308 11.3186 9.89167 6.04066 9.34821 5.8463 numMergedOcc 0
23 mol 225 unq 1 iso 0 dist 9.49163 11.2979 9.82043 12.7552 9.3502 3.94409 numMergedOcc 0
24 mol 225 unq 2 iso 0 dist 9.49163 11.2979 9.82043 5.69755 9.34821 8.31193 numMergedOcc 0
25 mol 225 unq 3 iso 0 dist 9.49163 11.2979 9.82043 12.7092 6.46405 7.96454 numMergedOcc 0
26 mol 225 unq 4 iso 0 dist 9.49163 11.0488 8.22922 12.7552 9.3502 6.88465 numMergedOcc 0
27 mol 225 unq 5 iso 0 dist 9.49163 11.0488 8.22922 5.69755 9.34821 6.8122 numMergedOcc 0
28 mol 225 unq 6 iso 0 dist 9.49163 11.0488 8.22922 12.7092 6.46405 4.45116 numMergedOcc 0
29 mol 225 unq 7 iso 0 dist 9.99149 11.7808 9.82043 14.0407 9.3502 3.94409 numMergedOcc 0
30 mol 225 unq 8 iso 0 dist 9.99149 11.7808 9.82043 3.90755 9.34821 8.31193 numMergedOcc 0
31 mol 225 unq 9 iso 0 dist 9.99149 11.7808 9.82043 11.662 6.46405 7.96454 numMergedOcc 0
32 mol 225 unq 10 iso 0 dist 9.99149 10.2606 8.22922 14.0407 9.3502 6.88465 numMergedOcc 0
33 mol 225 unq 11 iso 0 dist 9.99149 10.2606 8.22922 3.90755 9.34821 6.8122 numMergedOcc 0
34 mol 225 unq 12 iso 0 dist 9.99149 10.2606 8.22922 11.662 6.46405 4.45116 numMergedOcc 0
35 mol 273 unq 0 iso 0 dist 8.89714 13.9497 5.61969 12.2057 9.02537 10.5462 numMergedOcc 0
36 mol 273 unq 1 iso 0 dist 8.89714 15.8207 9.0277 12.2057 9.02537 11.5353 numMergedOcc 0
