%chk=000095511.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095511

0 1
 O   3.8800001E-02   1.513400       1.702600    
 O   -3.079700       1.591200      -1.146700    
 O   -2.084000       2.857100      0.4544000    
 C  -0.8331000       1.000000     -0.5522000    
 C   0.3556000       1.548100      0.3070000    
 C   -1.187300     -0.4276000     -0.3053000    
 C    1.632800      0.7491000      0.1478000    
 C   -2.040500       1.927300     -0.3383000    
 C  -0.5220000      -1.440700     -0.9958000    
 C   -2.183500     -0.7499000      0.6165000    
 C    1.868100     -0.3209000      0.9924000    
 C    2.533700       1.107700     -0.8388000    
 C  -0.8531000      -2.775900     -0.7650000    
 C   -2.514400      -2.085100      0.8475000    
 C    3.043900      -1.056900      0.8458000    
 C    3.709500      0.3717000     -0.9854000    
 C   -1.849200      -3.098100      0.1567000    
 C    3.964500     -0.7106000     -0.1432000    
 H  -0.5585000       1.122300      -1.610200    
 H   0.5530000       2.598900      5.8300000E-02
 H   0.2483000      -1.206900      -1.725700    
 H   -2.706000      9.9999998E-03   1.190500    
 H    1.166800     -0.6222000       1.764700    
 H    2.341200       1.947300      -1.500200    
 H  -0.7006000       2.125100       1.855600    
 H  -0.3365000      -3.564400      -1.304100    
 H   -3.286000      -2.336700       1.569200    
 H    3.241400      -1.901500       1.499400    
 H    4.425900      0.6405000      -1.756100    
 H   -2.106100      -4.137800      0.3373000    
 H    4.879500      -1.284300     -0.2581000    
 H   -3.852900       2.179600      -1.011100    


%chk=000095511-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095511

0 1
O -0.116194 1.510320 1.820296
O -2.671289 2.133918 -1.655234
O -2.483104 2.438811 0.629691
C -0.826364 1.021512 -0.546748
C 0.303286 1.562492 0.426997
C -1.206106 -0.443691 -0.302469
C 1.592027 0.770996 0.261807
C -2.047715 1.917458 -0.432386
C -0.731714 -1.437034 -1.195015
C -1.993084 -0.836635 0.810159
C 1.969998 -0.211036 1.206854
C 2.416532 1.004933 -0.866480
C -1.033011 -2.800029 -0.981201
C -2.295619 -2.200059 1.022570
C 3.157349 -0.954221 1.020195
C 3.600505 0.258190 -1.056708
C -1.817773 -3.186235 0.129501
C 3.973785 -0.726534 -0.111915
H -0.445040 1.112058 -1.578611
H 0.485966 2.620127 0.127199
H -0.117036 -1.143513 -2.054222
H -2.369004 -0.084835 1.511136
H 1.333673 -0.367133 2.082160
H 2.144006 1.782173 -1.593149
H -0.989801 1.989292 1.879523
H -0.655801 -3.556463 -1.678310
H -2.903271 -2.492525 1.886394
H 3.445738 -1.711092 1.758530
H 4.233866 0.449936 -1.930307
H -2.055285 -4.242925 0.296061
H 4.894354 -1.304132 -0.253624
H -3.484272 2.695677 -1.523192


