0 mol 24 unq 0 iso 0 dist 8.86116 9.41441 14.012 11.6226 8.09311 19.932 12.3058 4.79736 18.0797 7.77964 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 5.04899 7.45383 7.33728 6.47509 7.05196 5.20109 6.55597 4.69295 4.98822 8.07318 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 5.04899 7.45383 7.33728 6.47509 7.05196 5.20109 12.3944 11.6045 5.46578 7.44277 numMergedOcc 0
3 mol 25 unq 2 iso 0 dist 5.04899 9.01548 13.9331 6.47509 7.05196 12.506 6.55597 4.69295 13.4321 8.07318 numMergedOcc 0
4 mol 25 unq 3 iso 0 dist 5.04899 9.01548 13.9331 6.47509 7.05196 12.506 12.3944 11.6045 16.9163 7.44277 numMergedOcc 0
5 mol 25 unq 4 iso 0 dist 5.04899 8.87757 5.77929 4.69295 6.55597 9.16515 7.05196 6.47509 3.904 8.07318 numMergedOcc 0
6 mol 25 unq 5 iso 0 dist 7.57578 8.50222 6.08585 10.2864 4.79873 9.35791 10.9703 5.63212 3.904 7.44277 numMergedOcc 0
7 mol 25 unq 6 iso 0 dist 7.17969 7.55264 6.08585 11.4148 4.79873 9.35791 10.3338 5.63212 3.904 7.44277 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 8.80331 8.95682 6.18002 5.41726 6.6263 10.3764 10.0168 10.8828 12.8935 8.34145 numMergedOcc 0
9 mol 43 unq 1 iso 0 dist 6.20293 8.95682 8.38399 5.41726 6.75943 10.3764 10.0168 5.07458 12.8935 8.34145 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 8.70481 9.24757 15.3808 11.2069 5.5087 14.6027 15.0347 6.41115 21.4533 8.46627 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 8.70481 9.24757 15.3808 10.6713 6.08682 13.8591 15.0347 6.41115 21.4533 9.22208 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 9.64443 8.91313 13.3881 5.31547 9.36001 12.273 12.8197 6.77937 18.8996 9.99441 numMergedOcc 0
13 mol 92 unq 1 iso 0 dist 9.64443 8.16392 5.90097 5.31547 9.36001 10.9647 12.8197 6.77937 11.4018 9.99441 numMergedOcc 0
14 mol 95 unq 0 iso 0 dist 8.03644 9.49454 11.4333 11.3215 9.3948 16.0499 18.3711 13.086 19.8087 8.75345 numMergedOcc 0
15 mol 109 unq 0 iso 0 dist 8.69985 7.80523 7.74599 5.00433 8.52024 7.56755 7.07971 4.69373 5.92927 9.09348 numMergedOcc 0
16 mol 129 unq 0 iso 0 dist 5.83384 6.28565 4.55551 9.00231 5.58833 9.8591 11.8464 6.16616 8.3321 8.25397 numMergedOcc 0
17 mol 129 unq 1 iso 0 dist 5.83384 7.58957 10.5488 9.00231 5.58833 15.5412 11.8464 6.16616 14.6137 8.25397 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 8.22656 7.71248 10.6025 6.9945 7.22643 13.0475 8.26547 4.88025 8.88402 7.48208 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 8.94367 6.23142 4.57832 8.06642 7.21868 9.0176 9.33094 7.41373 6.93712 8.62504 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 6.37586 6.23142 5.29786 8.06642 7.93372 9.0176 9.33094 10.8635 6.93712 8.62504 numMergedOcc 0
21 mol 134 unq 2 iso 0 dist 6.49416 7.80532 9.87376 12.3479 9.33094 10.1824 11.988 8.06642 15.0575 8.62504 numMergedOcc 0
22 mol 134 unq 3 iso 0 dist 9.86662 9.94764 4.57832 4.00092 7.21868 9.0176 8.69531 7.41373 6.93712 8.62504 numMergedOcc 0
23 mol 134 unq 4 iso 0 dist 9.71307 9.94764 5.29786 4.00092 7.93372 9.0176 8.69531 10.8635 6.93712 8.62504 numMergedOcc 0
24 mol 143 unq 0 iso 0 dist 5.99315 7.78652 6.48978 4.78563 5.37047 5.06564 5.40637 7.39837 10.0079 9.29944 numMergedOcc 0
25 mol 143 unq 1 iso 0 dist 5.99315 8.91301 5.20762 4.78563 5.37047 7.5373 5.40637 7.39837 9.05366 9.29944 numMergedOcc 0
26 mol 170 unq 0 iso 0 dist 9.76807 6.35982 4.34698 4.78249 9.51256 6.47164 10.7199 5.7304 5.04147 8.75024 numMergedOcc 0
27 mol 170 unq 1 iso 0 dist 9.76807 7.51126 5.75144 4.78249 9.51256 9.65126 10.7199 5.7304 10.518 8.75024 numMergedOcc 0
28 mol 181 unq 0 iso 0 dist 7.81386 9.39829 7.20191 5.71898 9.01624 5.99437 9.81178 5.42158 6.16988 9.92831 numMergedOcc 0
29 mol 181 unq 1 iso 0 dist 7.63312 5.9176 5.63555 5.93724 9.01624 10.5303 10.6106 5.42158 10.513 9.92831 numMergedOcc 0
30 mol 181 unq 2 iso 0 dist 7.63312 6.41453 7.20191 5.93724 9.01624 5.99437 10.6106 5.42158 6.16988 9.92831 numMergedOcc 0
31 mol 222 unq 0 iso 0 dist 7.21333 7.67576 7.75656 6.84862 5.56538 8.43195 12.0171 8.34852 6.67077 8.14294 numMergedOcc 0
32 mol 222 unq 1 iso 0 dist 7.21333 7.67576 7.75656 9.53117 7.48954 8.23406 12.0171 8.34852 6.67077 5.72 numMergedOcc 0
33 mol 222 unq 2 iso 0 dist 7.21333 9.82371 16.0949 6.84862 5.56538 14.0832 12.0171 8.34852 16.6736 8.14294 numMergedOcc 0
34 mol 222 unq 3 iso 0 dist 7.21333 9.82371 16.0949 9.53117 7.48954 14.9425 12.0171 8.34852 16.6736 5.72 numMergedOcc 0
35 mol 227 unq 0 iso 0 dist 7.22101 7.43071 6.35849 5.0317 5.23634 9.18728 11.595 4.664 8.62578 8.85955 numMergedOcc 0
36 mol 227 unq 1 iso 0 dist 7.22101 7.43071 6.35849 5.0317 5.23634 9.18728 9.91384 4.1511 10.5007 6.09335 numMergedOcc 0
37 mol 227 unq 2 iso 0 dist 7.22101 5.41321 10.9607 5.0317 5.23634 8.91971 11.595 4.664 15.624 8.85955 numMergedOcc 0
38 mol 227 unq 3 iso 0 dist 7.22101 5.41321 10.9607 5.0317 5.23634 8.91971 9.91384 4.1511 12.8337 6.09335 numMergedOcc 0
39 mol 227 unq 4 iso 0 dist 8.65997 7.43071 10.204 5.0317 6.91318 9.18728 11.595 8.49509 8.62578 8.85955 numMergedOcc 0
40 mol 227 unq 5 iso 0 dist 8.65997 7.43071 10.204 5.0317 6.91318 9.18728 9.91384 4.69247 10.5007 6.09335 numMergedOcc 0
41 mol 227 unq 6 iso 0 dist 8.65997 5.41321 9.72615 5.0317 6.91318 8.91971 11.595 8.49509 15.624 8.85955 numMergedOcc 0
42 mol 227 unq 7 iso 0 dist 8.65997 5.41321 9.72615 5.0317 6.91318 8.91971 9.91384 4.69247 12.8337 6.09335 numMergedOcc 0
43 mol 227 unq 8 iso 0 dist 7.09863 6.02296 6.35849 5.83175 5.23634 9.18728 10.1802 4.664 8.62578 8.85955 numMergedOcc 0
44 mol 227 unq 9 iso 0 dist 7.09863 6.02296 6.35849 5.83175 5.23634 9.18728 10.3016 4.1511 10.5007 6.09335 numMergedOcc 0
45 mol 243 unq 0 iso 0 dist 8.23192 8.76935 6.60697 5.71505 8.69318 11.4892 10.5519 10.2068 9.79024 8.30024 numMergedOcc 0
46 mol 243 unq 1 iso 0 dist 8.23192 8.76935 6.60697 5.71505 8.69318 11.4892 7.10671 5.74165 3.85188 8.20943 numMergedOcc 0
47 mol 243 unq 2 iso 0 dist 8.23192 8.47652 4.26017 5.71505 8.69318 11.295 10.5519 10.2068 12.2828 8.30024 numMergedOcc 0
48 mol 243 unq 3 iso 0 dist 8.23192 8.47652 4.26017 5.71505 8.69318 11.295 7.10671 5.74165 6.25256 8.20943 numMergedOcc 0
