0 mol 16 unq 0 iso 0 dist 6.31718 7.63133 10.8455 8.43054 4.65873 9.81307 10.4366 6.93532 16.9082 10.0132 6.92781 5.05803 12.5273 6.57331 5.30082 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 7.57578 7.17969 4.33106 9.48085 5.18617 5.68041 6.08585 8.50222 7.55264 6.53269 10.9391 12.7009 12.8117 9.49421 5.77929 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 7.17969 7.57578 4.33106 9.48085 5.68041 5.18617 6.08585 7.55264 8.50222 6.53269 10.9391 12.8117 12.7009 9.49421 5.77929 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 6.20293 5.73819 5.06502 6.75943 5.41726 4.96926 8.38399 8.95682 12.3649 10.3764 8.13395 8.80331 10.5523 6.6263 6.18002 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 6.20293 8.93915 6.45462 6.75943 5.41726 10.0383 8.38399 8.95682 14.3789 10.3764 8.13395 8.80331 14.7803 6.6263 6.18002 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.96396 9.38498 15.7123 9.73086 5.70116 17.4121 5.11416 9.24757 13.8696 6.14542 5.4148 6.19304 10.2049 7.4369 6.56633 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 9.96396 9.75218 12.016 9.73086 5.70116 14.844 5.11416 9.24757 13.0145 6.14542 5.4148 6.19304 11.6369 7.4369 6.56633 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 9.60661 6.65086 5.88134 8.91882 4.03277 6.23008 5.80144 7.01812 8.30845 6.59691 10.8375 10.1489 13.2001 9.21662 5.42531 numMergedOcc 0
8 mol 100 unq 1 iso 0 dist 6.65086 9.60661 5.88134 8.91882 6.23008 4.03277 5.80144 8.30845 7.01812 6.59691 10.8375 13.2001 10.1489 9.21662 5.42531 numMergedOcc 0
9 mol 100 unq 2 iso 0 dist 6.65086 9.60661 5.88134 8.91882 6.23008 4.03277 12.3577 8.76378 10.0635 13.2391 10.8375 13.2001 10.1489 9.21662 17.9629 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.94367 9.86662 6.81259 7.21868 8.06642 4.00092 4.57832 6.23142 9.94764 9.0176 5.62899 11.7385 11.3835 9.66543 7.1797 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 8.94367 9.86662 6.81259 7.21868 8.06642 4.00092 4.57832 6.23142 9.94764 9.0176 5.49782 6.37586 9.71307 7.93372 5.29786 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 6.37586 9.71307 6.81259 7.93372 8.06642 4.00092 5.29786 6.23142 9.94764 9.0176 10.7144 11.7385 11.3835 9.66543 7.1797 numMergedOcc 0
13 mol 134 unq 3 iso 0 dist 6.37586 9.71307 6.81259 7.93372 8.06642 4.00092 5.29786 6.23142 9.94764 9.0176 5.49782 8.94367 9.86662 7.21868 4.57832 numMergedOcc 0
14 mol 134 unq 4 iso 0 dist 6.49416 8.94367 8.80819 9.33094 12.3479 7.41373 9.87376 7.80532 10.5252 10.1824 6.81259 12.5075 9.86662 8.69531 14.9876 numMergedOcc 0
15 mol 134 unq 5 iso 0 dist 6.49416 6.37586 5.00817 9.33094 12.3479 10.8635 9.87376 7.80532 10.7586 10.1824 6.81259 12.5075 9.71307 8.69531 14.9876 numMergedOcc 0
16 mol 134 unq 6 iso 0 dist 9.86662 8.94367 6.81259 7.21868 4.00092 8.06642 4.57832 9.94764 6.23142 9.0176 5.62899 11.3835 11.7385 9.66543 7.1797 numMergedOcc 0
17 mol 134 unq 7 iso 0 dist 9.86662 8.94367 6.81259 7.21868 4.00092 8.06642 4.57832 9.94764 6.23142 9.0176 5.49782 9.71307 6.37586 7.93372 5.29786 numMergedOcc 0
18 mol 134 unq 8 iso 0 dist 9.71307 6.37586 6.81259 7.93372 4.00092 8.06642 5.29786 9.94764 6.23142 9.0176 10.7144 11.3835 11.7385 9.66543 7.1797 numMergedOcc 0
19 mol 134 unq 9 iso 0 dist 9.71307 6.37586 6.81259 7.93372 4.00092 8.06642 5.29786 9.94764 6.23142 9.0176 5.49782 9.86662 8.94367 7.21868 4.57832 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 9.1374 8.03334 13.2049 9.76212 12.9532 6.50233 8.91338 8.90963 16.082 17.8171 6.01247 9.94371 10.9639 8.59874 11.85 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 8.03334 9.1374 13.2049 9.76212 6.50233 12.9532 4.43096 6.46704 12.4878 7.35884 6.01247 10.9639 9.94371 8.59874 6.06566 numMergedOcc 0
22 mol 181 unq 2 iso 0 dist 8.03334 9.1374 13.2049 9.76212 6.50233 12.9532 8.04639 6.59025 10.6908 11.6588 6.01247 10.9639 9.94371 8.59874 13.0409 numMergedOcc 0
23 mol 181 unq 3 iso 0 dist 7.81386 7.63312 8.85576 9.01624 5.71898 5.93724 7.20191 9.39829 6.41453 5.99437 11.5866 9.81747 9.11469 5.05973 5.48529 numMergedOcc 0
24 mol 181 unq 4 iso 0 dist 7.63312 7.81386 8.85576 9.01624 5.93724 5.71898 5.63555 5.9176 10.4943 10.5303 11.5866 9.11469 9.81747 5.05973 13.8719 numMergedOcc 0
25 mol 181 unq 5 iso 0 dist 7.63312 7.81386 8.85576 9.01624 5.93724 5.71898 7.20191 6.41453 9.39829 5.99437 11.5866 9.11469 9.81747 5.05973 5.48529 numMergedOcc 0
26 mol 227 unq 0 iso 0 dist 7.22101 7.09863 4.39704 5.23634 5.0317 5.83175 6.35849 7.43071 6.02296 9.18728 5.22356 8.65997 10.8157 6.91318 10.204 numMergedOcc 0
27 mol 227 unq 1 iso 0 dist 7.22101 7.09863 4.39704 5.23634 5.0317 5.83175 10.9607 5.41321 9.74265 8.91971 5.22356 8.65997 10.8157 6.91318 9.72615 numMergedOcc 0
28 mol 227 unq 2 iso 0 dist 7.09863 7.22101 4.39704 5.23634 5.83175 5.0317 6.35849 6.02296 7.43071 9.18728 5.22356 10.8157 8.65997 6.91318 10.204 numMergedOcc 0
29 mol 229 unq 0 iso 0 dist 8.22528 7.03423 5.57838 7.27993 5.70473 7.22525 6.65022 8.66332 11.1976 9.37336 5.1556 11.3979 11.9282 9.51168 5.42069 numMergedOcc 0
30 mol 229 unq 1 iso 0 dist 8.22528 7.03423 5.57838 7.27993 5.70473 7.22525 6.65022 8.66332 11.1976 9.37336 7.0298 11.7165 11.4362 6.95201 10.2411 numMergedOcc 0
31 mol 259 unq 0 iso 0 dist 8.13497 8.53687 10.582 9.07743 8.8603 6.73882 8.41846 7.98231 15.5791 14.6679 4.69778 7.88519 10.5767 7.66153 8.81835 numMergedOcc 0
32 mol 259 unq 1 iso 0 dist 7.88519 7.84554 4.86771 7.66153 8.8603 5.8801 8.81835 7.98231 11.6972 14.6679 4.69778 8.13497 9.95973 9.07743 8.41846 numMergedOcc 0
33 mol 259 unq 2 iso 0 dist 7.88519 7.46176 6.96053 7.66153 8.8603 11.8896 8.81835 7.98231 7.08526 14.6679 4.69778 8.13497 10.3935 9.07743 8.41846 numMergedOcc 0
34 mol 259 unq 3 iso 0 dist 7.88519 9.18903 10.4881 7.66153 8.8603 5.81576 8.81835 7.98231 15.8414 14.6679 4.69778 8.13497 12.6839 9.07743 8.41846 numMergedOcc 0
35 mol 259 unq 4 iso 0 dist 7.46176 7.88519 6.96053 7.66153 11.8896 8.8603 8.81835 7.08526 7.98231 14.6679 4.69778 10.3935 8.13497 9.07743 8.41846 numMergedOcc 0
36 mol 259 unq 5 iso 0 dist 7.46176 7.84554 7.64658 7.66153 11.8896 5.8801 8.81835 7.08526 11.6972 14.6679 4.69778 10.3935 9.95973 9.07743 8.41846 numMergedOcc 0
37 mol 259 unq 6 iso 0 dist 7.46176 9.18903 10.5239 7.66153 11.8896 5.81576 8.81835 7.08526 15.8414 14.6679 4.69778 10.3935 12.6839 9.07743 8.41846 numMergedOcc 0
