%chk=000029331.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029331

0 1
 O  -0.9709000      0.6653000     -0.1889000    
 O    1.804100      0.3492000     -1.9400001E-02
 O    3.786600      -1.361000      0.9670000    
 C   -3.113200     -0.4448000     -0.3506000    
 C   -2.276900      0.6161000      0.3703000    
 C   -2.494400      -1.836700     -0.2038000    
 C   -4.546200     -0.4428000      0.1771000    
 C  -0.1591000       1.630000      0.4667000    
 C    1.216400       1.635600     -0.1720000    
 C    3.090100      0.2897000     -0.6207000    
 C    3.663500      -1.100700     -0.4259000    
 H   -3.131600     -0.2056000      -1.421600    
 H   -2.751200       1.598800      0.2596000    
 H   -2.210100      0.3824000       1.440200    
 H   -3.101600      -2.587100     -0.7213000    
 H   -2.421000      -2.128900      0.8493000    
 H   -1.489000      -1.870700     -0.6359000    
 H   -5.158200      -1.178100     -0.3559000    
 H   -5.009900      0.5398000      3.9400000E-02
 H   -4.577800     -0.6861000       1.244700    
 H  -0.6144000       2.622600      0.3792000    
 H  -7.3200002E-02   1.361600       1.526000    
 H    1.847400       2.392200      0.3070000    
 H    1.126200       1.860800      -1.240900    
 H    3.013400      0.5132000      -1.690400    
 H    3.741100       1.029300     -0.1404000    
 H    4.652900      -1.184700     -0.8837000    
 H    3.006000      -1.864500     -0.8528000    
 H    2.901900      -1.269300       1.360400    


%chk=000029331-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000029331

0 1
O -1.078904 0.764923 -0.250125
O 1.897920 0.315976 0.037286
O 4.108580 -0.966261 1.223179
C -3.236539 -0.358446 -0.367832
C -2.345910 0.577792 0.466604
C -2.579452 -1.748220 -0.526465
C -4.640010 -0.461570 0.273503
C -0.120822 1.578782 0.496465
C 1.201527 1.572580 -0.256948
C 3.129269 0.143217 -0.749512
C 3.790145 -1.121531 -0.198997
H -3.335779 0.099640 -1.372801
H -2.846249 1.562695 0.616155
H -2.152762 0.131294 1.470149
H -3.176691 -2.393413 -1.197001
H -2.502095 -2.257084 0.454465
H -1.562200 -1.649453 -0.941689
H -5.294539 -1.118489 -0.327671
H -5.130357 0.527474 0.350060
H -4.578407 -0.893063 1.291603
H -0.496164 2.623493 0.590053
H 0.033839 1.170350 1.519456
H 1.830357 2.433456 0.062608
H 1.002557 1.660969 -1.346032
H 2.890181 0.036522 -1.830140
H 3.797376 1.021197 -0.608555
H 4.749803 -1.310709 -0.708647
H 3.115359 -1.987746 -0.362396
H 3.280867 -0.628774 1.655923


