0 mol 24 unq 0 iso 0 dist 8.13365 6.77987 10.2876 10.5449 6.86014 15.5096 17.544 10.0952 20.2796 8.86116 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.80849 6.74914 4.79736 13.9888 8.86116 12.3058 16.8105 10.0952 13.0134 6.86014 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 8.19077 6.12374 4.40004 6.12182 7.50293 7.26639 13.1327 5.79773 8.68364 9.91611 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.99509 7.86479 11.2061 8.14351 5.73819 12.9128 8.47617 5.06502 8.6477 6.20293 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.99509 7.86479 11.2061 8.14351 5.73819 12.9128 5.73331 5.89973 6.33831 8.93915 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 8.47617 7.86479 8.6477 8.14351 6.20293 12.9128 8.99509 5.06502 11.2061 5.73819 numMergedOcc 0
6 mol 43 unq 3 iso 0 dist 8.47617 7.86479 8.6477 8.14351 6.20293 12.9128 5.73331 6.45462 6.33831 8.93915 numMergedOcc 0
7 mol 43 unq 4 iso 0 dist 5.73331 7.86479 6.33831 8.14351 8.93915 12.9128 8.99509 5.89973 11.2061 5.73819 numMergedOcc 0
8 mol 43 unq 5 iso 0 dist 5.73331 7.86479 6.33831 8.14351 8.93915 12.9128 8.47617 6.45462 8.6477 6.20293 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 8.55238 9.83419 4.93864 10.7376 9.01083 10.5714 11.4018 5.53837 4.60151 7.2658 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 9.17862 9.77082 3.94537 15.821 7.27724 9.3948 15.8862 8.41707 11.3215 8.03644 numMergedOcc 0
11 mol 95 unq 2 iso 0 dist 8.27456 8.0675 3.94537 9.7565 7.27724 9.3948 15.5421 8.41707 11.3215 8.03644 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 5.11612 6.17349 4.48636 10.3475 9.33865 13.4105 11.7895 8.02349 11.835 6.11741 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 5.11612 6.17349 4.48636 6.86762 5.83991 7.69765 12.9567 10.8507 10.3209 7.30858 numMergedOcc 0
14 mol 115 unq 2 iso 0 dist 5.11612 6.17349 4.48636 6.86762 5.83991 7.69765 11.7895 8.02349 11.835 7.88312 numMergedOcc 0
15 mol 115 unq 3 iso 0 dist 5.11612 9.21978 6.63111 10.3475 9.33865 6.39384 11.7895 8.02349 6.07067 6.11741 numMergedOcc 0
16 mol 115 unq 4 iso 0 dist 5.11612 9.21978 6.63111 6.86762 5.83991 9.42082 12.9567 10.8507 15.3161 7.30858 numMergedOcc 0
17 mol 115 unq 5 iso 0 dist 5.11612 9.21978 6.63111 6.86762 5.83991 9.42082 11.7895 8.02349 6.07067 7.88312 numMergedOcc 0
18 mol 115 unq 6 iso 0 dist 5.22628 9.26505 6.95773 10.0419 9.33865 6.24825 11.2519 7.69052 6.01673 5.83991 numMergedOcc 0
19 mol 115 unq 7 iso 0 dist 5.22628 9.26505 6.95773 6.8104 6.11741 10.0255 11.2519 7.69052 6.01673 7.88312 numMergedOcc 0
20 mol 117 unq 0 iso 0 dist 9.60425 5.20001 6.57678 5.17524 9.84395 6.10127 12.6233 13.1058 10.5783 7.90328 numMergedOcc 0
21 mol 133 unq 0 iso 0 dist 8.94909 7.33743 15.0115 6.80087 8.00618 8.77023 12.8006 11.965 13.0405 6.29155 numMergedOcc 0
22 mol 133 unq 1 iso 0 dist 8.94909 7.33743 15.0115 6.80087 8.00618 8.77023 9.73536 7.79672 13.7612 6.80239 numMergedOcc 0
23 mol 175 unq 0 iso 0 dist 7.94593 8.03208 5.00913 13.2723 9.0018 13.6764 12.5882 6.2715 11.1374 5.6234 numMergedOcc 0
24 mol 175 unq 1 iso 0 dist 7.94593 8.03208 5.00913 13.2723 9.0018 13.6764 15.3964 8.16421 11.9979 6.57069 numMergedOcc 0
25 mol 175 unq 2 iso 0 dist 7.94593 8.03208 5.00913 8.63795 7.652 10.1305 12.5882 6.2715 11.1374 9.92231 numMergedOcc 0
26 mol 175 unq 3 iso 0 dist 7.94593 8.70409 5.42675 13.2723 9.0018 14.3303 12.5882 6.2715 10.604 5.6234 numMergedOcc 0
27 mol 175 unq 4 iso 0 dist 7.94593 8.70409 5.42675 13.2723 9.0018 14.3303 15.3964 8.16421 12.6196 6.57069 numMergedOcc 0
28 mol 175 unq 5 iso 0 dist 7.94593 8.70409 5.42675 8.63795 7.652 12.2424 12.5882 6.2715 10.604 9.92231 numMergedOcc 0
29 mol 181 unq 0 iso 0 dist 9.50454 9.19831 4.61184 11.755 7.63312 11.7785 15.3001 8.85576 11.3203 7.81386 numMergedOcc 0
30 mol 181 unq 1 iso 0 dist 7.15963 9.19831 9.83826 14.1493 9.1374 16.9717 17.347 13.2049 22.744 8.03334 numMergedOcc 0
31 mol 181 unq 2 iso 0 dist 7.15963 9.19831 9.83826 6.73556 5.98885 13.7845 11.5431 10.1912 18.0866 9.09537 numMergedOcc 0
32 mol 234 unq 0 iso 0 dist 6.15754 6.39499 5.53885 12.4455 6.56247 11.1872 8.9413 5.88703 3.95629 9.45496 numMergedOcc 0
33 mol 234 unq 1 iso 0 dist 6.15754 6.39499 5.53885 14.0876 9.36357 10.5689 8.9413 5.88703 3.95629 6.7625 numMergedOcc 0
34 mol 234 unq 2 iso 0 dist 8.9413 6.39499 3.95629 12.4455 9.45496 11.1872 6.15754 5.88703 5.53885 6.56247 numMergedOcc 0
35 mol 234 unq 3 iso 0 dist 8.9413 6.39499 3.95629 14.0876 6.7625 10.5689 6.15754 5.88703 5.53885 9.36357 numMergedOcc 0
