%chk=000113497.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113497

0 1
 O   -1.595100     -0.2286000      0.3650000    
 O    1.131700     -6.8999998E-02 -0.2183000    
 O    3.126500      0.2095000      0.9130000    
 C  -0.9528000       1.036700      0.2157000    
 C   0.5048000      0.8855000      0.6320000    
 C   -1.074500       1.482000      -1.233700    
 C   -2.970200     -0.1530000      2.2299999E-02
 C   -3.598300      -1.519100      0.1990000    
 C    2.452300     -0.3125000      3.5500001E-02
 C    2.975800      -1.331600     -0.9306000    
 H   -1.429500       1.769000      0.8788000    
 H    1.025700       1.847300      0.5602000    
 H   0.5546000      0.5199000       1.664500    
 H   -2.067500       1.890100      -1.449300    
 H  -0.3638000       2.286100      -1.455000    
 H  -0.8935000      0.6587000      -1.933600    
 H   -3.478200      0.5747000      0.6648000    
 H   -3.115900      0.1244000      -1.025100    
 H   -4.662000      -1.497400     -5.4600000E-02
 H   -3.098800      -2.259000     -0.4352000    
 H   -3.489700      -1.861900       1.233300    
 H    2.883700     -0.9549000      -1.952300    
 H    2.425800      -2.268900     -0.8144000    
 H    4.032900      -1.519600     -0.7224000    


%chk=000113497-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113497

0 1
O -1.671925 -0.259363 0.228849
O 1.227897 0.012686 -0.350792
O 2.980989 -0.115343 1.178803
C -0.959657 1.024796 0.095155
C 0.443271 0.784159 0.651072
C -0.964023 1.572551 -1.345271
C -3.117774 -0.179470 -0.028689
C -3.728648 -1.508012 0.418497
C 2.498342 -0.401424 0.059140
C 3.156079 -1.238094 -1.016981
H -1.444218 1.769190 0.772775
H 0.964873 1.739466 0.845324
H 0.391986 0.205909 1.589450
H -1.987396 1.822743 -1.674914
H -0.354927 2.493315 -1.406459
H -0.535637 0.826815 -2.034227
H -3.556089 0.672570 0.540358
H -3.309270 -0.005859 -1.108804
H -4.816574 -1.520188 0.222632
H -3.264248 -2.345279 -0.130628
H -3.561159 -1.668821 1.497266
H 2.961499 -0.815851 -2.015974
H 2.732636 -2.258722 -0.998215
H 4.237974 -1.299376 -0.828768


