%chk=000083052.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083052

0 1
 O    1.633100     -0.1573000      0.2393000    
 O   -1.713600     -0.2025000     -0.4778000    
 O   0.7047000      -2.772000      0.4631000    
 C   5.4400001E-02  -1.843600     -0.4080000    
 C    1.095600     -0.8411000     -0.8881000    
 C   -1.068700      -1.156200      0.3601000    
 C    2.627600      0.7798000     -0.1475000    
 C   -2.796300      0.4281000      0.1910000    
 C    2.011600       1.804200      -1.088100    
 C    3.212100       1.431900       1.096300    
 C   -2.272800       1.143300       1.427200    
 C   -3.487800       1.385600     -0.7675000    
 H  -0.3477000      -2.393300      -1.265600    
 H   0.6123000     -0.1611000      -1.594200    
 H    1.907000      -1.374300      -1.397800    
 H  -0.6422000     -0.6966000       1.256900    
 H   -1.791500      -1.911200      0.6942000    
 H    3.440400      0.2513000     -0.6614000    
 H   -3.528100     -0.3332000      0.4893000    
 H    2.661500       2.680600      -1.187700    
 H    1.883000       1.406500      -2.099900    
 H    1.031800       2.140800     -0.7315000    
 H    4.003400       2.143400      0.8416000    
 H    3.628100      0.6712000       1.765700    
 H    2.435100       1.957500       1.662400    
 H   -3.014800       1.853300       1.808800    
 H   -2.069500      0.4478000       2.248000    
 H   -1.348700       1.692200       1.214200    
 H   -4.346700       1.873200     -0.2966000    
 H   -3.834600      0.8496000      -1.657600    
 H   -2.792700       2.157300      -1.116400    
 H    1.096200      -2.268500       1.197400    


%chk=000083052-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083052

0 1
O 1.778839 -0.061561 0.184944
O -1.894512 -0.160096 -0.365276
O 0.799377 -2.568822 0.501921
C 0.030499 -1.621848 -0.316279
C 0.975863 -0.581909 -0.938920
C -1.069367 -0.969086 0.542185
C 2.969782 0.724168 -0.214805
C -3.149710 0.343013 0.236281
C 2.566382 2.060978 -0.866080
C 3.786882 0.913157 1.068801
C -2.878637 1.419422 1.306923
C -3.981050 0.873632 -0.938022
H -0.444952 -2.213428 -1.117341
H 0.387748 0.220601 -1.422535
H 1.646000 -1.066895 -1.680314
H -0.607225 -0.342562 1.332723
H -1.676658 -1.767202 1.019155
H 3.552122 0.117556 -0.946265
H -3.676844 -0.518605 0.708499
H 3.467176 2.652463 -1.112950
H 1.997981 1.906079 -1.800095
H 1.940424 2.648595 -0.170785
H 4.719886 1.464999 0.855663
H 4.049536 -0.063902 1.510096
H 3.202524 1.484566 1.811889
H -3.832547 1.809559 1.707960
H -2.295960 1.016569 2.154522
H -2.314434 2.260666 0.865142
H -4.965835 1.232395 -0.587931
H -4.138697 0.078488 -1.686669
H -3.455664 1.712270 -1.429425
H 1.493272 -2.016561 0.956788


