0 mol 48 unq 0 iso 0 dist 7.78475 9.07969 5.61827 6.21391 9.49774 12.846 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 7.78475 9.61448 8.4772 6.21391 9.49774 13.6161 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 6.34966 7.95428 9.87177 9.80391 6.74766 15.4889 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 6.34966 5.88256 7.71726 9.80391 6.74766 13.7421 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 5.79841 6.2454 10.8586 15.4219 9.66222 20.0045 numMergedOcc 0
5 mol 116 unq 0 iso 0 dist 6.63731 8.75205 3.82942 10.0162 8.38606 12.0931 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 7.35385 4.33805 11.0215 7.20376 6.75376 11.431 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 8.35864 4.33805 10.7779 7.20376 9.10042 11.431 numMergedOcc 0
8 mol 141 unq 2 iso 0 dist 8.35864 4.33805 10.7779 10.1764 9.75059 13.8298 numMergedOcc 0
9 mol 141 unq 3 iso 0 dist 8.35864 4.33805 10.7779 14.3045 6.83404 16.4915 numMergedOcc 0
10 mol 162 unq 0 iso 0 dist 9.25835 9.95076 16.3342 8.75377 9.7361 18.7001 numMergedOcc 0
11 mol 162 unq 1 iso 0 dist 9.25835 7.76112 14.6018 8.75377 9.7361 16.2919 numMergedOcc 0
12 mol 184 unq 0 iso 0 dist 5.0207 9.16535 10.6777 8.44389 7.54099 13.3856 numMergedOcc 0
13 mol 192 unq 0 iso 0 dist 9.99783 7.578 13.4418 12.9926 9.36796 18.226 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 6.6069 9.0735 5.8463 5.32064 8.37739 9.82043 numMergedOcc 0
15 mol 225 unq 1 iso 0 dist 6.6069 9.0735 5.8463 6.76978 9.47237 8.22922 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 5.92532 8.18813 6.64795 5.10104 8.20644 12.5241 numMergedOcc 0
