0 mol 25 unq 0 iso 0 dist 5.04899 7.05196 6.47509 11.6045 12.3944 7.44277 11.9561 10.9391 5.63212 4.79873 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 7.57578 4.79873 10.2864 5.63212 10.9703 7.44277 11.9561 15.5644 11.6045 7.05196 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 7.17969 4.79873 11.4148 5.63212 10.3338 7.44277 11.9561 16.1048 11.6045 7.05196 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 5.73819 6.66407 5.07458 4.96926 6.75943 8.34145 10.5523 8.13395 10.8828 6.6263 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.80331 6.6263 5.41726 10.8828 10.0168 8.34145 10.5523 5.06502 4.96926 6.66407 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 6.20293 6.75943 5.41726 5.07458 10.0168 8.34145 5.73819 5.06502 4.96926 6.66407 numMergedOcc 0
6 mol 43 unq 3 iso 0 dist 8.93915 6.75943 10.0383 5.07458 10.9975 8.34145 5.73819 5.89973 4.96926 6.66407 numMergedOcc 0
7 mol 56 unq 0 iso 0 dist 8.66265 9.03564 6.75591 9.96534 13.2483 8.77529 14.5295 11.9005 9.67727 9.2898 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 7.27724 9.3948 3.94537 13.086 10.3995 8.75345 20.613 19.274 16.9857 9.11586 numMergedOcc 0
9 mol 95 unq 1 iso 0 dist 8.03644 9.3948 11.3215 13.086 18.3711 8.75345 20.613 26.886 16.9857 9.11586 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 8.69985 7.07971 4.69373 5.00433 8.52024 9.09348 13.1098 7.15843 10.9531 9.89083 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 7.30858 9.42082 15.3161 6.01673 13.22 7.65564 5.83991 10.8507 6.63111 6.24825 numMergedOcc 0
12 mol 115 unq 1 iso 0 dist 9.33865 6.24825 6.95773 6.63111 6.39384 7.65564 5.83991 7.69052 6.01673 9.42082 numMergedOcc 0
13 mol 115 unq 2 iso 0 dist 5.83991 6.24825 6.01673 6.63111 9.42082 7.65564 9.33865 7.69052 6.95773 6.39384 numMergedOcc 0
14 mol 115 unq 3 iso 0 dist 6.11741 6.39384 6.07067 6.95773 10.0255 7.65564 9.33865 8.02349 6.63111 6.24825 numMergedOcc 0
15 mol 115 unq 4 iso 0 dist 7.88312 9.42082 6.07067 6.01673 10.0255 7.65564 5.83991 8.02349 6.63111 6.24825 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 7.24514 8.26547 5.03174 6.9945 10.4642 7.48208 8.22656 6.65743 4.88025 7.22643 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 8.22656 7.22643 6.9945 4.88025 8.26547 7.48208 6.82262 5.61668 4.19723 9.05342 numMergedOcc 0
18 mol 133 unq 2 iso 0 dist 6.82262 7.22643 4.19723 4.88025 9.05342 7.48208 8.22656 5.61668 6.9945 8.26547 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 8.94367 7.21868 8.06642 7.41373 9.33094 8.62504 9.86662 6.81259 4.00092 8.69531 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 8.94367 9.33094 7.41373 8.06642 7.21868 8.62504 11.7385 5.62899 4.46337 9.66543 numMergedOcc 0
21 mol 134 unq 2 iso 0 dist 8.94367 9.33094 7.41373 8.06642 7.21868 8.62504 6.37586 5.49782 10.8635 7.93372 numMergedOcc 0
22 mol 134 unq 3 iso 0 dist 6.37586 7.93372 8.06642 10.8635 9.33094 8.62504 9.71307 6.81259 4.00092 8.69531 numMergedOcc 0
23 mol 134 unq 4 iso 0 dist 6.37586 9.33094 10.8635 8.06642 7.93372 8.62504 11.7385 10.7144 4.46337 9.66543 numMergedOcc 0
24 mol 134 unq 5 iso 0 dist 6.37586 9.33094 10.8635 8.06642 7.93372 8.62504 8.94367 5.49782 7.41373 7.21868 numMergedOcc 0
25 mol 134 unq 6 iso 0 dist 6.49416 9.33094 12.3479 8.06642 11.988 8.62504 11.7385 12.8168 4.46337 9.66543 numMergedOcc 0
26 mol 134 unq 7 iso 0 dist 6.49416 9.33094 12.3479 8.06642 11.988 8.62504 8.94367 8.80819 7.41373 7.21868 numMergedOcc 0
27 mol 134 unq 8 iso 0 dist 6.49416 9.33094 12.3479 8.06642 11.988 8.62504 6.37586 5.00817 10.8635 7.93372 numMergedOcc 0
28 mol 134 unq 9 iso 0 dist 9.86662 7.21868 4.00092 7.41373 8.69531 8.62504 8.94367 6.81259 8.06642 9.33094 numMergedOcc 0
29 mol 134 unq 10 iso 0 dist 9.86662 8.69531 7.41373 4.00092 7.21868 8.62504 11.3835 5.62899 4.46337 9.66543 numMergedOcc 0
30 mol 134 unq 11 iso 0 dist 9.86662 8.69531 7.41373 4.00092 7.21868 8.62504 9.71307 5.49782 10.8635 7.93372 numMergedOcc 0
31 mol 134 unq 12 iso 0 dist 9.71307 7.93372 4.00092 10.8635 8.69531 8.62504 6.37586 6.81259 8.06642 9.33094 numMergedOcc 0
32 mol 134 unq 13 iso 0 dist 9.71307 8.69531 10.8635 4.00092 7.93372 8.62504 11.3835 10.7144 4.46337 9.66543 numMergedOcc 0
33 mol 134 unq 14 iso 0 dist 9.71307 8.69531 10.8635 4.00092 7.93372 8.62504 9.86662 5.49782 7.41373 7.21868 numMergedOcc 0
34 mol 205 unq 0 iso 0 dist 9.61492 6.49765 10.6504 8.97813 15.255 5.03818 10.0042 12.6324 4.3093 7.21137 numMergedOcc 0
35 mol 205 unq 1 iso 0 dist 9.61492 6.49765 10.6504 8.97813 15.255 5.03818 13.4269 14.7378 8.90569 8.4844 numMergedOcc 0
36 mol 205 unq 2 iso 0 dist 7.45763 6.49765 8.67921 8.97813 8.95122 5.03818 10.0042 12.9309 4.3093 7.21137 numMergedOcc 0
37 mol 205 unq 3 iso 0 dist 7.45763 6.49765 8.67921 8.97813 8.95122 5.03818 13.4269 9.33648 8.90569 8.4844 numMergedOcc 0
38 mol 264 unq 0 iso 0 dist 9.17653 8.29262 10.7813 13.2035 19.5824 9.78237 9.90113 14.4574 5.71153 5.90924 numMergedOcc 0
39 mol 264 unq 1 iso 0 dist 9.17653 8.29262 10.7813 13.2035 19.5824 9.78237 14.5869 20.6232 12.6872 5.90058 numMergedOcc 0
40 mol 264 unq 2 iso 0 dist 9.17653 8.29262 10.7813 13.2035 19.5824 9.78237 13.9815 16.6464 6.56539 9.58916 numMergedOcc 0
