0 mol 14 unq 0 iso 0 dist 7.59564 6.24146 7.73217 10.6355 5.8321 9.31271 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 8.10957 6.24146 5.99703 10.6355 10.2904 9.31271 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 8.8795 10.0338 8.44473 19.4573 16.1844 9.70415 numMergedOcc 0
3 mol 66 unq 0 iso 0 dist 8.68658 11.4986 7.3359 11.5233 4.0452 8.38282 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.86325 6.02362 9.95767 8.08277 5.42987 8.53393 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 9.86325 9.54341 5.68286 8.08277 5.42987 5.57265 numMergedOcc 0
6 mol 78 unq 2 iso 0 dist 9.86325 9.54341 5.68286 14.0161 4.37747 7.05258 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.84762 6.45382 9.20041 12.1823 4.64183 8.90009 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 5.2184 5.82484 9.20041 7.94271 4.64183 8.90009 numMergedOcc 0
9 mol 140 unq 0 iso 0 dist 8.94921 4.58643 8.92292 13.7978 10.3818 9.89896 numMergedOcc 0
10 mol 140 unq 1 iso 0 dist 8.94921 11.6044 8.67876 13.7978 10.3818 9.68229 numMergedOcc 0
11 mol 140 unq 2 iso 0 dist 7.77669 13.7353 8.92292 17.8663 10.3818 9.89896 numMergedOcc 0
12 mol 140 unq 3 iso 0 dist 7.77669 12.5321 8.67876 17.8663 10.3818 9.68229 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 5.32865 12.348 9.88662 17.267 13.3408 6.87299 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 8.92801 4.681 4.71906 11.7878 5.95853 9.18245 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 7.2833 5.34788 7.04524 11.6261 5.87625 8.3705 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 5.25149 6.19375 5.39218 12.1736 11.173 6.21273 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 8.10903 9.78068 9.04358 11.8229 4.23712 8.9706 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 9.86267 7.02254 6.11671 13.4217 5.66381 6.94113 numMergedOcc 0
19 mol 261 unq 0 iso 0 dist 8.88741 6.5875 7.30472 13.2037 6.27949 8.17205 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 7.52632 6.35501 6.45326 10.8833 4.85294 8.57445 numMergedOcc 0
21 mol 274 unq 0 iso 0 dist 9.34051 7.23876 8.88221 8.04439 10.6577 6.36173 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 8.04712 5.28949 6.03235 13.1115 7.20929 8.82899 numMergedOcc 0
