%chk=000090621.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090621

0 1
 O    1.562700      -1.935100      0.8843000    
 O   -1.537300      -2.578000     -0.5586000    
 O    1.392500      -2.028100      -1.417800    
 O   -2.415200     -0.9297000      0.8011000    
 C  -4.4700000E-02  0.5898000     -7.5999998E-02
 C    1.285800       1.221000     -0.2908000    
 C   -1.226400       1.464300      0.1552000    
 C  -0.1785000     -0.7626000     -9.1799997E-02
 C    1.671700       1.535600      -1.576100    
 C   -1.546000       1.820500       1.447900    
 C    2.087200       1.468900      0.8028000    
 C   -1.961500       1.888000     -0.9312000    
 C    1.008200      -1.643800     -0.3241000    
 C   -1.515100      -1.399900      0.1228000    
 C    2.919100       2.126500      -1.777500    
 C   -2.654000       2.639800       1.664500    
 C    3.334600       2.060000      0.6016000    
 C   -3.069400       2.707400     -0.7145000    
 C    3.750500       2.388800     -0.6885000    
 C   -3.415700       3.083100      0.5833000    
 C    2.715300      -2.782000      0.8424000    
 C   -2.753400      -3.324800     -0.4535000    
 C    3.210500      -3.010700       2.254600    
 C   -2.621000      -4.598800      -1.260400    
 H    1.033400       1.334200      -2.431600    
 H  -0.9611000       1.480200       2.297600    
 H    1.774800       1.214800       1.811800    
 H   -1.702400       1.599900      -1.946000    
 H    3.243300       2.381800      -2.782000    
 H   -2.924000       2.932000       2.675100    
 H    3.982200       2.263200       1.449400    
 H   -3.662900       3.052000      -1.556200    
 H    4.721800       2.848500     -0.8453000    
 H   -4.278500       3.720700      0.7520000    
 H    2.447900      -3.740500      0.3837000    
 H    3.500200      -2.300500      0.2484000    
 H   -2.941400      -3.570200      0.5977000    
 H   -3.584700      -2.725500     -0.8414000    
 H    3.464400      -2.058600       2.732300    
 H    2.429800      -3.474900       2.866200    
 H    4.093800      -3.655400       2.259900    
 H   -1.781600      -5.200100     -0.8957000    
 H   -2.414800      -4.369600      -2.311100    
 H   -3.535300      -5.195800      -1.201800    


%chk=000090621-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000090621

0 1
O 1.437433 -2.382637 0.730786
O -1.349605 -2.501763 -0.294502
O 1.923179 -1.345529 -1.300918
O -1.983891 -1.048719 1.416140
C 0.047024 0.795752 -0.018282
C 1.338369 1.538879 -0.079248
C -1.207589 1.600555 -0.050558
C 0.018530 -0.585950 0.060063
C 1.494692 2.653685 -0.948030
C -1.318751 2.803403 0.699192
C 2.426208 1.169737 0.760167
C -2.302014 1.201171 -0.866402
C 1.213906 -1.431153 -0.272186
C -1.199958 -1.346764 0.484901
C 2.715672 3.357239 -1.001199
C -2.504444 3.566030 0.662174
C 3.641512 1.882129 0.716552
C -3.481281 1.971154 -0.914448
C 3.794194 2.974532 -0.169434
C -3.590665 3.153255 -0.144706
C 2.526055 -3.369043 0.459163
C -2.458200 -3.418674 0.105903
C 2.576101 -4.310002 1.658545
C -2.401278 -4.615128 -0.838461
H 0.662820 2.951063 -1.595516
H -0.480735 3.124207 1.327413
H 2.301181 0.340692 1.466362
H -2.210107 0.298930 -1.482237
H 2.827117 4.202164 -1.689538
H -2.582186 4.480056 1.261079
H 4.466217 1.592007 1.376854
H -4.311850 1.654880 -1.555089
H 4.740538 3.525707 -0.206092
H -4.509534 3.749285 -0.178712
H 2.288208 -3.893652 -0.484226
H 3.470897 -2.814151 0.313179
H -2.306785 -3.702814 1.163292
H -3.411988 -2.864601 0.034041
H 2.794716 -3.755068 2.586922
H 1.613688 -4.834271 1.787269
H 3.368366 -5.066413 1.509741
H -1.431996 -5.135819 -0.754278
H -2.533886 -4.297187 -1.886698
H -3.205082 -5.330775 -0.586276


