0 mol 7 unq 0 iso 0 dist 8.88982 10.5313 6.22805 13.9585 7.10621 6.96396 6.10226 5.70161 8.0166 12.2471 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.88982 10.5313 6.22805 13.9585 7.10621 6.96396 5.80034 4.57188 9.32945 10.2729 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.88982 10.5313 6.22805 13.9585 7.10621 6.96396 9.83056 6.09254 9.90117 7.21217 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 9.02927 12.9916 4.68793 14.1634 6.19529 5.72331 16.9184 10.9806 8.28673 13.7715 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.04163 7.90858 4.24428 6.34076 5.93252 6.58444 11.3999 8.04817 5.39171 11.905 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 6.04163 7.90858 4.24428 6.34076 5.93252 6.58444 12.0249 9.76331 9.27355 14.8258 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 6.04163 7.90858 4.24428 6.34076 5.93252 6.58444 11.2944 10.4402 8.60363 14.0323 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 8.88953 7.82091 4.24428 3.92763 5.93252 6.58444 12.6863 8.04817 5.39171 11.905 numMergedOcc 0
8 mol 73 unq 4 iso 0 dist 8.88953 7.82091 4.24428 3.92763 5.93252 6.58444 16.1646 9.76331 9.27355 14.8258 numMergedOcc 0
9 mol 73 unq 5 iso 0 dist 8.88953 7.82091 4.24428 3.92763 5.93252 6.58444 14.2743 10.4402 8.60363 14.0323 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 9.50454 18.3782 9.63295 11.755 7.63312 12.5935 13.9406 5.16386 6.47689 11.5992 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 8.80581 7.11843 9.63295 10.209 7.63312 12.5935 9.02183 5.16386 6.47689 11.5992 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 7.86668 12.3207 8.07523 5.06314 6.18308 13.3929 8.14413 5.82028 6.24111 9.67457 numMergedOcc 0
13 mol 210 unq 1 iso 0 dist 7.86668 12.3207 8.07523 5.06314 6.18308 13.3929 12.3596 4.62641 8.60412 9.90494 numMergedOcc 0
14 mol 210 unq 2 iso 0 dist 7.86668 12.2935 7.56882 5.06314 6.18308 12.3088 8.14413 5.82028 9.00343 9.67457 numMergedOcc 0
15 mol 210 unq 3 iso 0 dist 7.86668 12.2935 7.56882 5.06314 6.18308 12.3088 12.3596 4.62641 7.05535 9.90494 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 9.61379 7.33406 4.79841 9.57016 8.95269 11.4653 11.3088 5.41021 7.62593 9.33771 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 6.92721 4.95913 9.27989 9.00069 6.16342 12.1502 7.76984 11.4465 8.34832 15.8376 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 8.18588 6.5604 6.40592 10.2076 7.4631 7.93809 12.8152 4.86437 9.174 9.72526 numMergedOcc 0
19 mol 253 unq 0 iso 0 dist 9.86979 14.3804 8.07341 7.79167 9.02271 16.581 20.4914 11.4733 9.58767 19.9111 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 5.31858 4.69752 8.81059 6.60345 6.42289 9.78068 10.6825 13.8694 6.08181 15.2652 numMergedOcc 0
21 mol 258 unq 1 iso 0 dist 5.31858 4.69752 8.81059 6.60345 6.42289 9.78068 8.8726 9.22664 7.70189 8.58088 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 6.68878 8.9397 9.43169 4.31412 6.05727 6.5875 11.6871 8.80293 6.41477 10.2386 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 7.63115 7.34826 5.17586 5.82892 9.70696 5.9229 13.558 6.03718 8.57035 14.3672 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 7.34596 5.5267 6.84554 4.36798 8.76532 9.67023 5.72197 4.58403 7.93511 5.67266 numMergedOcc 0
25 mol 282 unq 1 iso 0 dist 7.12228 5.5267 9.51581 4.36798 6.33524 9.67023 5.72197 5.04235 7.93511 5.67266 numMergedOcc 0
