0 mol 19 unq 0 iso 0 dist 8.18518 14.1404 8.4674 10.5195 6.41575 4.64838 12.9091 5.80928 4.51865 6.41423 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.18518 6.57145 4.54938 10.5195 6.41575 4.97119 10.7917 7.34551 7.20519 10.741 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 8.18518 6.57145 4.54938 10.5195 6.41575 4.97119 12.9091 5.80928 6.864 6.41423 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.85331 9.20254 6.86014 10.7574 7.33768 4.32034 10.4452 10.0952 8.86116 12.9284 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.85331 9.20254 6.86014 15.2995 9.01567 8.67951 10.4452 10.0952 8.86116 13.4393 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 6.85331 9.20254 6.86014 12.8157 7.29868 8.52463 10.4452 10.0952 8.86116 8.60554 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 6.35095 5.76725 5.54419 8.7316 8.70827 5.59311 12.4687 12.3067 7.36323 9.12854 numMergedOcc 0
7 mol 24 unq 4 iso 0 dist 6.35095 5.76725 5.54419 10.9987 6.73939 12.176 12.4687 12.3067 7.36323 18.673 numMergedOcc 0
8 mol 24 unq 5 iso 0 dist 5.87895 5.75653 7.36323 5.076 9.12854 5.59311 11.0381 12.3067 5.54419 8.70827 numMergedOcc 0
9 mol 75 unq 0 iso 0 dist 7.16583 6.77761 7.79912 6.05353 9.81166 11.4997 11.6681 5.64643 8.56639 14.6043 numMergedOcc 0
10 mol 75 unq 1 iso 0 dist 7.16583 6.77761 7.79912 6.05353 9.81166 11.4997 13.9013 10.4899 8.59017 18.7078 numMergedOcc 0
11 mol 75 unq 2 iso 0 dist 7.118 5.06305 7.79912 9.08979 9.81166 11.4997 8.24814 5.64643 8.56639 14.6043 numMergedOcc 0
12 mol 75 unq 3 iso 0 dist 7.118 5.06305 7.79912 9.08979 9.81166 11.4997 11.548 10.4899 8.59017 18.7078 numMergedOcc 0
13 mol 95 unq 0 iso 0 dist 8.26838 15.4217 8.03644 9.61054 9.49454 11.4333 15.3713 8.41707 7.27724 12.1092 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 7.15203 5.38237 7.24514 5.86611 7.71248 4.34568 12.6562 6.761 9.91388 9.97654 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 7.15203 5.38237 7.24514 5.86611 7.71248 4.34568 10.7939 7.6656 9.52634 6.66772 numMergedOcc 0
16 mol 133 unq 2 iso 0 dist 7.15203 9.71227 8.22656 5.86611 7.71248 10.6025 11.0475 5.61668 6.82262 12.4749 numMergedOcc 0
17 mol 133 unq 3 iso 0 dist 9.89098 8.96845 9.91388 11.7971 9.97654 4.34568 13.5771 6.69554 9.52634 6.66772 numMergedOcc 0
18 mol 133 unq 4 iso 0 dist 9.89098 8.96845 9.91388 11.7971 9.97654 4.34568 12.2343 6.761 7.24514 7.71248 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 7.97208 12.5576 6.54501 15.4716 7.80532 7.41674 11.8406 5.79898 9.89303 5.83771 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 7.97208 9.52819 6.49416 15.4716 7.80532 9.87376 10.738 8.80819 8.94367 10.5252 numMergedOcc 0
21 mol 134 unq 2 iso 0 dist 7.97208 9.52819 6.49416 15.4716 7.80532 9.87376 5.67862 5.00817 6.37586 10.7586 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 9.45659 5.73338 6.57069 14.0022 9.77896 8.29015 12.3723 8.16421 9.0018 10.4182 numMergedOcc 0
23 mol 175 unq 1 iso 0 dist 9.45659 5.73338 6.57069 14.0022 9.77896 8.29015 6.73365 5.35493 5.6234 11.6765 numMergedOcc 0
24 mol 181 unq 0 iso 0 dist 9.63295 12.5935 7.63312 14.1039 5.9176 5.63555 13.3844 8.85576 7.81386 10.4943 numMergedOcc 0
25 mol 181 unq 1 iso 0 dist 9.63295 12.5935 7.63312 5.39949 6.41453 7.20191 13.3844 8.85576 7.81386 9.39829 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 7.45401 6.8549 7.54065 6.0361 8.73217 11.7429 15.0174 13.8792 9.70748 17.7621 numMergedOcc 0
27 mol 186 unq 1 iso 0 dist 7.45401 6.8549 7.54065 6.0361 8.73217 11.7429 11.5381 5.74635 8.87694 14.2425 numMergedOcc 0
28 mol 206 unq 0 iso 0 dist 7.10166 13.609 9.774 14.2366 7.75885 6.45859 11.1422 5.63422 7.7366 6.16414 numMergedOcc 0
29 mol 206 unq 1 iso 0 dist 8.73396 6.35321 7.7366 11.3915 6.16414 6.45859 11.7176 5.63422 9.774 7.75885 numMergedOcc 0
30 mol 206 unq 2 iso 0 dist 8.73396 6.35321 7.7366 7.26571 7.33701 4.40897 11.7176 5.63422 9.774 11.4872 numMergedOcc 0
31 mol 206 unq 3 iso 0 dist 8.73396 6.35321 7.7366 6.33838 8.0871 7.62219 11.7176 5.63422 9.774 13.2041 numMergedOcc 0
32 mol 206 unq 4 iso 0 dist 9.66896 12.0196 9.774 5.91675 7.75885 6.45859 10.4092 5.63422 7.7366 6.16414 numMergedOcc 0
33 mol 259 unq 0 iso 0 dist 6.96379 10.908 8.13497 7.39099 7.98231 8.41846 14.2826 10.582 8.53687 15.5791 numMergedOcc 0
34 mol 259 unq 1 iso 0 dist 6.96379 12.7595 7.88519 7.39099 7.98231 8.81835 11.7889 4.86771 7.84554 11.6972 numMergedOcc 0
35 mol 259 unq 2 iso 0 dist 6.96379 12.7595 7.88519 7.39099 7.98231 8.81835 11.1532 6.96053 7.46176 7.08526 numMergedOcc 0
36 mol 259 unq 3 iso 0 dist 6.96379 12.7595 7.88519 7.39099 7.98231 8.81835 17.4423 10.4881 9.18903 15.8414 numMergedOcc 0
