0 mol 54 unq 0 iso 0 dist 7.34695 5.0478 5.01159 6.11985 4.22514 6.54052 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 7.33408 5.58337 5.45603 5.14497 10.5012 8.04111 numMergedOcc 0
2 mol 69 unq 1 iso 0 dist 7.92149 5.58337 9.71548 5.14497 13.0401 8.04111 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 7.47107 7.14572 7.8245 12.8582 16.163 8.70305 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 7.18661 8.99674 8.07487 10.0293 12.0375 4.86532 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 8.57865 7.41599 4.36082 5.34896 9.9815 8.19198 numMergedOcc 0
6 mol 120 unq 1 iso 0 dist 9.52648 7.41599 12.2353 5.34896 14.6236 8.19198 numMergedOcc 0
7 mol 125 unq 0 iso 0 dist 9.99265 8.6317 14.6801 5.29844 13.9385 5.05869 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 6.10045 9.96946 15.9654 15.5154 21.4011 5.65876 numMergedOcc 0
9 mol 136 unq 0 iso 0 dist 7.79731 9.2211 12.1315 7.19078 13.0769 4.91837 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 5.77703 9.45931 13.1683 12.9231 15.4995 6.93424 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 5.77703 6.35397 9.00056 12.9231 15.4995 6.8891 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 6.50055 5.6688 5.71112 6.57868 8.99149 5.87853 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 6.66619 5.11863 4.84884 11.4233 13.8657 9.13228 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 8.01717 6.74767 4.63072 4.02994 6.9486 7.62513 numMergedOcc 0
15 mol 247 unq 0 iso 0 dist 7.80979 6.76933 6.96883 5.03659 10.3961 5.18532 numMergedOcc 0
16 mol 278 unq 0 iso 0 dist 7.46794 9.58671 7.41736 9.00229 8.0742 8.91606 numMergedOcc 0
