%chk=000133314.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133314

0 1
 O  -3.0000001E-04  0.8031000       2.301000    
 O  -1.2000001E-03  -2.447800     -0.1578000    
 O  -1.9000000E-03   2.881000       3.321100    
 O    4.704200      -2.845400      0.1537000    
 O   -4.707000      -2.841400      0.1531000    
 O   2.4000001E-03   6.384100     -0.5311000    
 O   5.5000000E-03   5.685000      -2.693900    
 O    4.895900      -1.905200      -1.981500    
 O   -4.897500      -1.899600      -1.981500    
 C  -1.9999999E-04  0.2580000      0.9433000    
 C   6.9999998E-04   1.504900      0.1190000    
 C    1.258200     -0.5683000      0.7656000    
 C   -1.259100     -0.5674000      0.7652000    
 C   6.9999998E-04   2.613400      0.9462000    
 C    1.179600      -1.852100      0.2138000    
 C   -1.181700      -1.851400      0.2138000    
 C   3.0000001E-04   2.174200       2.333200    
 C   1.4000000E-03   1.663100      -1.257900    
 C    2.525600     -6.8499997E-02   1.113500    
 C   -2.526200     -6.6299997E-02   1.112300    
 C   1.5000000E-03   3.908200      0.4617000    
 C    2.334700      -2.613200      4.4999998E-03
 C   -2.337300      -2.611700      4.6000001E-03
 C   2.2000000E-03   2.960800      -1.778000    
 C   2.2000000E-03   4.075900     -0.9233000    
 C    3.677500     -0.8307000      0.9110000    
 C   -3.678600     -0.8277000      0.9102000    
 C    3.582000      -2.102400      0.3546000    
 C   -3.584100      -2.099900      0.3547000    
 C   3.8999999E-03   5.416300      -1.488200    
 C    5.301500      -2.655100      -1.103400    
 C   -5.302700      -2.651300      -1.104800    
 C    6.525000      -3.513900      -1.226400    
 C   -6.527300      -3.508800      -1.228600    
 H   1.4000000E-03  0.8058000      -1.922800    
 H    2.630900      0.9251000       1.541700    
 H   -2.630700      0.9277000       1.539800    
 H   1.9000000E-03   4.738400       1.159300    
 H    2.259300      -3.608100     -0.4282000    
 H   -2.262500      -3.606800     -0.4279000    
 H   2.7999999E-03   3.088100      -2.858000    
 H    4.645900     -0.4225000       1.187500    
 H   -4.646700     -0.4184000       1.186000    
 H   3.1000001E-03   7.284000     -0.9219000    
 H    7.246900      -3.240500     -0.4530000    
 H    6.984300      -3.353000      -2.205800    
 H    6.246600      -4.567000      -1.139200    
 H   -6.252000      -4.561600      -1.129200    
 H   -6.978600      -3.357000      -2.213200    
 H   -7.254200      -3.226300     -0.4632000    


%chk=000133314-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133314

0 1
O -0.000265 0.531977 2.045003
O -0.000529 -2.700774 0.030491
O -0.000136 2.433133 3.406718
O 4.708990 -3.004856 -0.299278
O -4.709949 -3.002987 -0.302247
O 0.001092 6.667958 -0.018559
O 0.001537 6.225835 -2.299613
O 6.488431 -1.454891 -0.358409
O -6.489703 -1.453113 -0.352520
C -0.000055 0.224756 0.513121
C 0.000300 1.629875 -0.085977
C 1.257018 -0.573061 0.227986
C -1.257332 -0.572592 0.227550
C 0.000290 2.602342 0.933934
C 1.206097 -1.978247 0.052929
C -1.206859 -1.977758 0.052447
C -0.000051 1.934782 2.267878
C 0.000612 2.010733 -1.441229
C 2.534764 0.037423 0.211483
C -2.534849 0.038405 0.210520
C 0.000583 3.979400 0.650290
C 2.369970 -2.748241 -0.122055
C -2.370973 -2.747327 -0.123078
C 0.000901 3.388297 -1.745191
C 0.000881 4.368950 -0.711638
C 3.721586 -0.696138 0.035647
C -3.721875 -0.694692 0.034182
C 3.619821 -2.103077 -0.126408
C -3.620525 -2.101671 -0.127874
C 0.001193 5.802845 -1.119122
C 6.074002 -2.628370 -0.399302
C -6.075082 -2.626351 -0.398775
C 6.906632 -3.878581 -0.561218
C -6.907706 -3.875906 -0.565873
H 0.000633 1.262208 -2.239413
H 2.606007 1.121255 0.351228
H -2.605686 1.122258 0.350303
H 0.000566 4.724137 1.450575
H 2.301133 -3.830295 -0.252744
H -2.302416 -3.829374 -0.253939
H 0.001149 3.735977 -2.783523
H 4.692070 -0.201919 0.028383
H -4.692213 -0.200188 0.026823
H 0.001327 7.608787 -0.341178
H 6.751532 -4.552037 0.299287
H 7.968812 -3.605953 -0.635745
H 6.596068 -4.427944 -1.466761
H -6.606816 -4.413192 -1.481985
H -7.971020 -3.604033 -0.625561
H -6.741656 -4.559964 0.284035


