%chk=000104744.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104744

0 1
 O   -3.426300      -1.276600     -0.4443000    
 O   0.2005000       1.730300     -0.3584000    
 O   -4.796500      0.3892000      0.5828000    
 O    4.314400       1.480500       1.236000    
 O   0.9897000      -3.072000     -6.4300001E-02
 O    1.936600       3.230500     -0.2989000    
 C   -2.741500       1.081200     -0.5184000    
 C   -1.603900      0.1446000     -0.3958000    
 C    2.068400     -0.3343000     -0.1442000    
 C   0.6606000     -0.6709000     -0.2176000    
 C    3.210500      -1.284200     -2.6300000E-02
 C   -3.921900      8.3099999E-02 -0.5292000    
 C    2.476400      0.9363000     -0.1630000    
 C    3.957500       1.055500     -6.9600001E-02
 C  -0.2446000      0.3911000     -0.3234000    
 C    4.420100     -0.3848000     -0.3237000    
 C   -2.064000      -1.160300     -0.3676000    
 C   0.1713000      -1.987900     -0.1854000    
 C   -3.049100       1.886700      0.6818000    
 C   -1.203000      -2.239000     -0.2620000    
 C    1.551600       2.067900     -0.2762000    
 C   -4.186600       1.451800       1.209600    
 C    1.279600      -3.518800       1.258100    
 H   -2.701200       1.673600      -1.437300    
 H    3.180200      -2.102600     -0.7509000    
 H    3.289400      -1.684900      0.9884000    
 H   -4.509200      0.1709000      -1.451900    
 H    4.386800       1.741800     -0.8060000    
 H    5.286200     -0.6683000      0.2836000    
 H    4.695800     -0.5000000      -1.380300    
 H   -2.459800       2.708600       1.058500    
 H   -1.587800      -3.253700     -0.2364000    
 H   -4.701100       1.820700       2.078900    
 H    4.004000       2.396100       1.343100    
 H    2.217200      -4.080800       1.236000    
 H    1.379300      -2.686100       1.962400    
 H   0.4815000      -4.186300       1.597500    


%chk=000104744-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000104744

0 1
O -3.384987 -1.299669 -0.081872
O 0.209566 1.714720 -0.564902
O -4.793435 0.507163 0.726021
O 4.464208 2.381157 0.516853
O 1.231531 -2.955360 0.435188
O 1.867902 3.315140 -0.816228
C -2.745050 1.055649 -0.500308
C -1.551272 0.136162 -0.317057
C 2.173888 -0.269723 -0.060194
C 0.778555 -0.649438 -0.049271
C 3.416209 -1.113912 0.182420
C -3.956306 0.054943 -0.386559
C 2.543476 1.037484 -0.340358
C 4.046891 1.248181 -0.323466
C -0.176324 0.394372 -0.311141
C 4.571285 -0.070080 0.304105
C -1.988847 -1.169566 -0.045175
C 0.265323 -1.972090 0.204338
C -2.990834 1.993541 0.682681
C -1.120333 -2.246711 0.211756
C 1.615524 2.107908 -0.596230
C -4.117971 1.611776 1.326659
C 0.769048 -4.323293 0.703513
H -2.718700 1.596866 -1.461555
H 3.566995 -1.803839 -0.670339
H 3.311657 -1.752754 1.074210
H -4.610671 -0.082234 -1.258118
H 4.424065 1.405447 -1.357509
H 4.781340 0.148755 1.365925
H 5.505999 -0.418593 -0.164236
H -2.320877 2.807116 0.953882
H -1.525040 -3.240538 0.407356
H -4.620130 2.002866 2.209872
H 4.003692 3.193309 0.171785
H 1.687055 -4.909819 0.851491
H 0.147412 -4.360325 1.617817
H 0.200256 -4.725711 -0.155757


