0 mol 34 unq 0 iso 0 dist 5.2422 5.41061 6.87871 11.7002 7.78892 14.5506 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 9.70415 14.0458 9.62468 16.1844 8.44473 12.9303 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 9.70415 6.47853 5.92705 16.1844 8.44473 13.2942 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 6.09906 4.19771 8.0614 5.46484 8.0139 9.59932 numMergedOcc 0
4 mol 134 unq 0 iso 0 dist 5.22024 4.63243 9.12599 5.22308 6.00727 5.34907 numMergedOcc 0
5 mol 134 unq 1 iso 0 dist 8.57582 7.95515 9.12599 8.11558 6.00727 5.34907 numMergedOcc 0
6 mol 147 unq 0 iso 0 dist 6.87299 11.6781 9.18866 13.3408 9.88662 9.20914 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 9.18245 6.31839 6.43406 5.75272 9.4775 10.3906 numMergedOcc 0
8 mol 181 unq 1 iso 0 dist 9.18245 6.31839 6.43406 5.95853 4.71906 7.11585 numMergedOcc 0
9 mol 210 unq 0 iso 0 dist 8.71409 17.7409 9.67457 13.7809 6.13878 5.02037 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 6.21273 9.98645 7.31105 11.173 5.39218 10.1832 numMergedOcc 0
11 mol 250 unq 0 iso 0 dist 7.63152 5.0051 9.9605 13.7473 9.22082 12.8554 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 8.9706 7.42035 8.58088 4.23712 9.04358 5.27718 numMergedOcc 0
13 mol 259 unq 0 iso 0 dist 6.94113 4.96619 5.90381 5.66381 6.11671 7.53628 numMergedOcc 0
14 mol 264 unq 0 iso 0 dist 6.85672 5.79293 7.22789 5.61397 8.91251 11.1442 numMergedOcc 0
15 mol 265 unq 0 iso 0 dist 8.57445 4.3101 9.72927 4.85294 6.45326 3.89234 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 6.36173 4.84163 9.02749 10.6577 8.88221 10.3702 numMergedOcc 0
17 mol 274 unq 1 iso 0 dist 6.36173 4.84163 9.02749 11.0378 9.65027 14.5909 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 8.82899 5.76075 6.60309 7.20929 6.03235 4.81768 numMergedOcc 0
