0 mol 16 unq 0 iso 0 dist 4.7319 6.72833 6.51133 6.86055 7.65889 5.94982 10.4852 11.6856 6.93532 5.01101 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 5.05803 6.93532 5.30082 5.01101 6.42835 5.94982 10.4852 11.0958 6.72833 6.86055 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.86014 7.29868 8.52463 5.69214 7.95042 5.80953 15.5315 15.5324 8.4051 13.6174 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.86014 7.29868 8.52463 5.69214 7.95042 5.80953 10.0952 8.86116 8.60554 5.11636 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 8.86116 8.60554 8.52463 5.11636 7.95042 5.80953 14.6259 15.5324 8.4051 13.6174 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 8.86116 8.60554 8.52463 5.11636 7.95042 5.80953 10.0952 6.86014 7.29868 5.69214 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 5.54419 8.4051 5.11617 10.1698 5.68215 6.61696 15.5315 11.0194 7.29868 8.91183 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 5.54419 8.4051 5.11617 10.1698 5.68215 6.61696 14.6259 13.2433 8.60554 14.8647 numMergedOcc 0
8 mol 24 unq 6 iso 0 dist 7.36323 8.75662 6.7828 5.50396 7.27472 9.586 14.6259 15.5296 9.44691 14.4081 numMergedOcc 0
9 mol 25 unq 0 iso 0 dist 5.04899 7.45383 7.33728 6.47509 7.05196 5.20109 10.9391 11.9561 6.16347 5.63212 numMergedOcc 0
10 mol 25 unq 1 iso 0 dist 5.04899 8.87757 5.77929 4.69295 6.55597 9.16515 15.5644 12.7009 8.50222 13.2447 numMergedOcc 0
11 mol 25 unq 2 iso 0 dist 5.04899 8.87757 5.77929 4.69295 6.55597 9.16515 16.1048 12.8117 7.55264 14.9982 numMergedOcc 0
12 mol 25 unq 3 iso 0 dist 5.04899 8.87757 5.77929 8.79309 7.07751 9.82987 15.5644 12.7009 8.50222 11.8139 numMergedOcc 0
13 mol 25 unq 4 iso 0 dist 5.04899 8.87757 5.77929 8.79309 7.07751 9.82987 16.1048 12.8117 7.55264 14.1251 numMergedOcc 0
14 mol 25 unq 5 iso 0 dist 5.04899 8.87757 5.77929 13.6145 9.49421 6.53269 15.5644 12.7009 8.50222 5.18617 numMergedOcc 0
15 mol 25 unq 6 iso 0 dist 5.04899 8.87757 5.77929 13.6145 9.49421 6.53269 16.1048 12.8117 7.55264 5.68041 numMergedOcc 0
16 mol 25 unq 7 iso 0 dist 7.57578 8.50222 6.08585 5.18617 9.48085 6.53269 15.5644 11.9561 8.87757 13.6145 numMergedOcc 0
17 mol 25 unq 8 iso 0 dist 7.57578 8.50222 6.08585 5.18617 9.48085 6.53269 4.33106 7.17969 7.55264 5.68041 numMergedOcc 0
18 mol 25 unq 9 iso 0 dist 7.17969 7.55264 6.08585 5.68041 9.48085 6.53269 16.1048 11.9561 8.87757 13.6145 numMergedOcc 0
19 mol 25 unq 10 iso 0 dist 7.17969 7.55264 6.08585 5.68041 9.48085 6.53269 4.33106 7.57578 8.50222 5.18617 numMergedOcc 0
20 mol 100 unq 0 iso 0 dist 9.60661 7.01812 5.80144 4.03277 8.91882 6.59691 5.88134 6.65086 8.30845 6.23008 numMergedOcc 0
21 mol 100 unq 1 iso 0 dist 6.65086 8.30845 5.80144 6.23008 8.91882 6.59691 5.88134 9.60661 7.01812 4.03277 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 6.29155 6.16242 4.54648 13.0405 8.77023 8.83732 7.81217 6.80239 5.87634 13.7612 numMergedOcc 0
23 mol 133 unq 1 iso 0 dist 6.80239 5.87634 4.54648 13.7612 8.77023 8.83732 7.81217 6.29155 6.16242 13.0405 numMergedOcc 0
24 mol 134 unq 0 iso 0 dist 8.94367 6.23142 4.57832 8.06642 7.21868 9.0176 5.00526 11.9139 7.69991 12.847 numMergedOcc 0
25 mol 134 unq 1 iso 0 dist 8.94367 6.23142 4.57832 8.06642 7.21868 9.0176 6.81259 9.86662 9.94764 4.00092 numMergedOcc 0
26 mol 134 unq 2 iso 0 dist 6.37586 6.23142 5.29786 8.06642 7.93372 9.0176 5.00526 9.5126 7.69991 12.847 numMergedOcc 0
27 mol 134 unq 3 iso 0 dist 6.37586 6.23142 5.29786 8.06642 7.93372 9.0176 6.81259 9.71307 9.94764 4.00092 numMergedOcc 0
28 mol 134 unq 4 iso 0 dist 9.86662 9.94764 4.57832 4.00092 7.21868 9.0176 11.3271 11.9139 7.69991 12.847 numMergedOcc 0
29 mol 134 unq 5 iso 0 dist 9.86662 9.94764 4.57832 4.00092 7.21868 9.0176 6.81259 8.94367 6.23142 8.06642 numMergedOcc 0
30 mol 134 unq 6 iso 0 dist 9.71307 9.94764 5.29786 4.00092 7.93372 9.0176 11.3271 9.5126 7.69991 12.847 numMergedOcc 0
31 mol 134 unq 7 iso 0 dist 9.71307 9.94764 5.29786 4.00092 7.93372 9.0176 6.81259 6.37586 6.23142 8.06642 numMergedOcc 0
32 mol 170 unq 0 iso 0 dist 9.76807 6.35982 4.34698 4.78249 9.51256 6.47164 6.52462 12.8696 9.10511 4.12764 numMergedOcc 0
33 mol 181 unq 0 iso 0 dist 7.81386 9.39829 7.20191 5.71898 9.01624 5.99437 8.85576 7.63312 6.41453 5.93724 numMergedOcc 0
34 mol 181 unq 1 iso 0 dist 7.81386 9.39829 7.20191 5.83796 9.55105 8.4848 8.85576 7.63312 6.41453 5.12833 numMergedOcc 0
35 mol 181 unq 2 iso 0 dist 7.63312 6.41453 7.20191 5.93724 9.01624 5.99437 8.85576 7.81386 9.39829 5.71898 numMergedOcc 0
36 mol 181 unq 3 iso 0 dist 7.63312 6.41453 7.20191 5.12833 9.55105 8.4848 8.85576 7.81386 9.39829 5.83796 numMergedOcc 0
37 mol 227 unq 0 iso 0 dist 7.22101 7.43071 6.35849 5.0317 5.23634 9.18728 4.39704 7.09863 6.02296 5.83175 numMergedOcc 0
38 mol 227 unq 1 iso 0 dist 8.65997 7.43071 10.204 5.0317 6.91318 9.18728 4.39704 10.8157 6.02296 5.83175 numMergedOcc 0
39 mol 227 unq 2 iso 0 dist 7.09863 6.02296 6.35849 5.83175 5.23634 9.18728 4.39704 7.22101 7.43071 5.0317 numMergedOcc 0
40 mol 232 unq 0 iso 0 dist 8.27212 9.40808 4.9377 5.10213 6.71524 9.9183 6.56633 10.5803 8.50102 9.74344 numMergedOcc 0
