0 mol 16 unq 0 iso 0 dist 7.46752 5.66097 7.63133 10.8592 10.8455 6.31718 15.4251 16.9082 10.4366 6.93532 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 7.84393 9.01721 7.82074 14.9301 10.3915 8.4674 17.7644 12.3215 9.74255 8.40416 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 7.84393 9.01721 7.82074 10.1953 5.03957 4.54938 17.7644 12.3215 9.74255 7.75618 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 8.18518 14.1404 8.4674 12.9091 5.80928 4.51865 10.5195 6.41575 4.64838 6.41423 numMergedOcc 0
4 mol 19 unq 3 iso 0 dist 8.18518 6.57145 4.54938 12.9091 5.80928 6.864 10.5195 6.41575 4.97119 6.41423 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.85331 9.20254 6.86014 10.4452 10.0952 8.86116 12.8157 7.29868 8.52463 8.60554 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 6.85331 9.20254 6.86014 10.4452 10.0952 8.86116 15.9012 16.1126 10.971 8.44664 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 6.85331 9.20254 6.86014 10.4452 10.0952 8.86116 19.0271 15.8209 13.4893 9.44691 numMergedOcc 0
8 mol 24 unq 3 iso 0 dist 6.35095 5.76725 5.54419 12.4687 12.3067 7.36323 8.7316 8.70827 5.59311 9.12854 numMergedOcc 0
9 mol 24 unq 4 iso 0 dist 5.87895 5.75653 7.36323 11.0381 12.3067 5.54419 5.076 9.12854 5.59311 8.70827 numMergedOcc 0
10 mol 24 unq 5 iso 0 dist 5.87895 5.75653 7.36323 11.0381 12.3067 5.54419 17.7288 18.673 12.176 6.73939 numMergedOcc 0
11 mol 59 unq 0 iso 0 dist 9.05547 6.34748 6.85766 13.5562 10.0246 7.71095 14.2977 14.8852 9.64444 6.73347 numMergedOcc 0
12 mol 75 unq 0 iso 0 dist 8.24814 5.06305 8.56639 7.118 5.64643 7.79912 9.08979 14.6043 11.4997 9.81166 numMergedOcc 0
13 mol 100 unq 0 iso 0 dist 9.57498 6.89762 6.45675 10.0165 5.33144 7.47343 9.09335 10.6086 12.2861 8.30845 numMergedOcc 0
14 mol 100 unq 1 iso 0 dist 9.57498 6.89762 6.45675 10.0165 5.33144 7.47343 18.2202 13.2102 15.5385 8.76378 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 7.15203 5.38237 7.24514 12.6562 6.761 9.91388 5.86611 7.71248 4.34568 9.97654 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 7.15203 5.38237 7.24514 10.7939 7.6656 9.52634 5.86611 7.71248 4.34568 6.66772 numMergedOcc 0
17 mol 133 unq 2 iso 0 dist 9.89098 8.96845 9.91388 13.5771 6.69554 9.52634 11.7971 9.97654 4.34568 6.66772 numMergedOcc 0
18 mol 133 unq 3 iso 0 dist 9.89098 8.96845 9.91388 12.2343 6.761 7.24514 11.7971 9.97654 4.34568 7.71248 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 5.67862 9.52819 6.37586 7.97208 5.00817 6.49416 15.4716 10.7586 9.87376 7.80532 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 7.97208 12.5576 6.54501 11.8406 5.79898 9.89303 15.4716 7.80532 7.41674 5.83771 numMergedOcc 0
21 mol 175 unq 0 iso 0 dist 6.73365 5.73338 5.6234 9.45659 5.35493 6.57069 14.0022 11.6765 8.29015 9.77896 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 9.07833 9.54619 9.09537 11.44 10.1912 5.98885 16.8666 18.0578 9.81073 8.90963 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 9.63295 12.5935 7.63312 13.3844 8.85576 7.81386 5.39949 6.41453 7.20191 9.39829 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 7.45401 6.8549 7.54065 15.0174 13.8792 9.70748 9.97675 12.4002 5.4141 7.66165 numMergedOcc 0
25 mol 186 unq 1 iso 0 dist 6.86297 8.03427 8.87694 10.7452 5.74635 7.54065 17.9144 14.2425 11.7429 8.73217 numMergedOcc 0
26 mol 186 unq 2 iso 0 dist 6.86297 8.03427 8.87694 13.9315 14.9058 9.70748 11.7703 14.0016 5.4141 7.66165 numMergedOcc 0
27 mol 206 unq 0 iso 0 dist 7.10166 13.609 9.774 11.1422 5.63422 7.7366 14.2366 7.75885 6.45859 6.16414 numMergedOcc 0
28 mol 206 unq 1 iso 0 dist 7.10166 13.609 9.774 11.1422 5.63422 7.7366 16.3642 11.4872 4.40897 7.33701 numMergedOcc 0
29 mol 206 unq 2 iso 0 dist 7.10166 13.609 9.774 11.1422 5.63422 7.7366 17.239 13.2041 7.62219 8.0871 numMergedOcc 0
30 mol 206 unq 3 iso 0 dist 8.73396 6.35321 7.7366 11.7176 5.63422 9.774 11.3915 6.16414 6.45859 7.75885 numMergedOcc 0
31 mol 206 unq 4 iso 0 dist 9.66896 12.0196 9.774 10.4092 5.63422 7.7366 5.91675 7.75885 6.45859 6.16414 numMergedOcc 0
32 mol 206 unq 5 iso 0 dist 9.66896 12.0196 9.774 10.4092 5.63422 7.7366 12.233 11.4872 4.40897 7.33701 numMergedOcc 0
33 mol 206 unq 6 iso 0 dist 9.66896 12.0196 9.774 10.4092 5.63422 7.7366 15.6288 13.2041 7.62219 8.0871 numMergedOcc 0
34 mol 258 unq 0 iso 0 dist 7.9357 8.73372 6.42289 13.7159 7.26417 6.60405 13.7482 11.2102 5.63675 7.21311 numMergedOcc 0
35 mol 258 unq 1 iso 0 dist 8.81059 9.78068 6.42289 14.0712 7.26417 6.60405 15.1358 11.2102 5.63675 7.21311 numMergedOcc 0
36 mol 259 unq 0 iso 0 dist 6.96379 12.7595 7.88519 11.1532 6.96053 7.46176 7.39099 7.98231 8.81835 7.08526 numMergedOcc 0
