0 mol 24 unq 0 iso 0 dist 8.94703 13.7241 9.03541 4.04757 9.98592 13.0288 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 5.61567 10.3553 9.66847 7.27795 6.00377 4.62743 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 8.85156 7.63046 8.63912 4.37642 9.53438 6.64072 numMergedOcc 0
3 mol 71 unq 0 iso 0 dist 9.47964 13.6309 8.23389 11.8589 9.0504 6.03363 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 9.42184 10.3721 7.75341 15.0409 8.4701 7.94629 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 6.63973 15.9053 9.3711 13.5835 8.77077 9.64988 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.43496 12.5193 9.48388 15.7834 6.87506 9.5868 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.10803 10.872 6.39945 6.49348 6.18678 5.8134 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 9.10803 12.1048 7.14258 6.49348 6.18678 10.4975 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 5.56446 5.05068 7.11411 12.541 7.58337 12.4984 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 9.18289 9.45075 7.7734 6.33168 6.56416 8.69697 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 9.49163 6.31615 9.0735 11.2979 9.82043 5.32064 numMergedOcc 0
12 mol 225 unq 1 iso 0 dist 9.49163 6.31615 9.0735 11.0488 8.22922 6.76978 numMergedOcc 0
13 mol 225 unq 2 iso 0 dist 9.99149 7.70265 9.0735 11.7808 9.82043 5.32064 numMergedOcc 0
14 mol 225 unq 3 iso 0 dist 9.99149 7.70265 9.0735 10.2606 8.22922 6.76978 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 5.39924 4.26151 5.38046 4.32578 7.39085 6.18998 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 7.63381 7.04644 7.69491 15.9388 8.95511 13.0625 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 7.63381 7.04644 7.69491 4.22981 5.85002 4.88461 numMergedOcc 0
18 mol 239 unq 2 iso 0 dist 7.63381 4.99161 6.64008 15.9388 8.95511 15.1473 numMergedOcc 0
19 mol 239 unq 3 iso 0 dist 7.63381 4.99161 6.64008 4.22981 5.85002 6.62656 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 6.22195 7.00525 9.0208 6.00136 9.63518 8.19557 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 6.22195 9.84205 9.30393 6.00136 9.63518 15.6606 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 8.89714 12.565 5.63226 13.9497 5.61969 6.30473 numMergedOcc 0
23 mol 273 unq 1 iso 0 dist 8.89714 12.565 5.63226 15.8207 9.0277 8.96178 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 7.59142 12.8668 8.9352 4.01471 7.17958 13.4771 numMergedOcc 0
25 mol 279 unq 1 iso 0 dist 7.59142 12.3885 5.8845 4.01471 7.17958 12.7014 numMergedOcc 0
26 mol 282 unq 0 iso 0 dist 7.60738 10.4435 9.33418 9.11162 9.38222 10.1355 numMergedOcc 0
