0 mol 24 unq 0 iso 0 dist 6.86014 8.86116 10.0952 7.95042 5.69214 5.11636 8.52463 7.29868 8.60554 5.80953 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.86116 6.86014 10.0952 7.95042 5.11636 5.69214 8.52463 8.60554 7.29868 5.80953 numMergedOcc 0
2 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 numMergedOcc 0
3 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 numMergedOcc 0
4 mol 25 unq 2 iso 0 dist 6.03987 7.31767 4.51512 7.6114 5.86705 6.10919 5.68392 6.85556 9.79094 6.29797 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 9.96708 9.78528 8.24309 9.55118 5.69391 9.78221 11.6378 9.27838 16.0048 7.58875 numMergedOcc 0
6 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 numMergedOcc 0
7 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 numMergedOcc 0
8 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 numMergedOcc 0
9 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 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 6.29155 6.80239 7.81217 8.77023 13.0405 13.7612 4.54648 6.16242 5.87634 8.83732 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 6.29155 8.00618 11.965 8.77023 13.0405 15.0115 4.54648 6.16242 10.9061 8.83732 numMergedOcc 0
12 mol 133 unq 2 iso 0 dist 6.80239 6.29155 7.81217 8.77023 13.7612 13.0405 4.54648 5.87634 6.16242 8.83732 numMergedOcc 0
13 mol 133 unq 3 iso 0 dist 6.80239 8.00618 7.79672 8.77023 13.7612 15.0115 4.54648 5.87634 10.9061 8.83732 numMergedOcc 0
14 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 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 6.37586 9.71307 6.81259 7.93372 8.06642 4.00092 5.29786 6.23142 9.94764 9.0176 numMergedOcc 0
16 mol 134 unq 2 iso 0 dist 9.86662 8.94367 6.81259 7.21868 4.00092 8.06642 4.57832 9.94764 6.23142 9.0176 numMergedOcc 0
17 mol 134 unq 3 iso 0 dist 9.71307 6.37586 6.81259 7.93372 4.00092 8.06642 5.29786 9.94764 6.23142 9.0176 numMergedOcc 0
18 mol 155 unq 0 iso 0 dist 6.43582 7.46303 7.66392 8.97626 4.91785 9.16779 5.50031 7.92304 12.2416 9.16358 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 8.03334 9.1374 13.2049 9.76212 6.50233 12.9532 4.43096 6.46704 12.4878 7.35884 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 7.81386 7.63312 8.85576 9.01624 5.71898 5.93724 7.20191 9.39829 6.41453 5.99437 numMergedOcc 0
21 mol 181 unq 2 iso 0 dist 7.81386 7.63312 8.85576 9.55105 5.83796 5.12833 7.20191 9.39829 6.41453 8.4848 numMergedOcc 0
22 mol 181 unq 3 iso 0 dist 7.63312 7.81386 8.85576 6.64173 10.6474 6.8757 5.63555 5.9176 10.4943 8.12266 numMergedOcc 0
23 mol 181 unq 4 iso 0 dist 7.63312 7.81386 8.85576 9.01624 5.93724 5.71898 7.20191 6.41453 9.39829 5.99437 numMergedOcc 0
24 mol 181 unq 5 iso 0 dist 7.63312 7.81386 8.85576 9.55105 5.12833 5.83796 5.63555 5.9176 10.4943 9.43306 numMergedOcc 0
25 mol 181 unq 6 iso 0 dist 7.63312 7.81386 8.85576 9.55105 5.12833 5.83796 7.20191 6.41453 9.39829 8.4848 numMergedOcc 0
26 mol 204 unq 0 iso 0 dist 8.51516 7.10633 10.8344 7.9133 5.57347 10.7169 5.86489 7.32294 11.5776 9.48625 numMergedOcc 0
27 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 numMergedOcc 0
28 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 numMergedOcc 0
29 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 numMergedOcc 0
30 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 numMergedOcc 0
