%chk=000033372.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033372

0 1
 O    3.450600     -8.7700002E-02 -0.6752000    
 O   -4.896400     -0.9853000      0.2909000    
 O   -6.537600       1.167700      0.3513000    
 N   -5.152600       1.309600      0.1888000    
 C    1.572600      -1.396400      3.6300000E-02
 C    2.105300     -0.2308000     -0.5146000    
 C    4.072600       1.000100      5.7999999E-03
 C    5.511100      0.6227000      0.3248000    
 C  -0.6545000     -0.4900000     -0.2002000    
 C   0.1926000      -1.526000      0.1935000    
 C    1.258000      0.8050000     -0.9083000    
 C  -0.1219000      0.6755000     -0.7510000    
 C    2.464600      -2.515300      0.4621000    
 C    6.234700       1.731900       1.066700    
 C   -2.093400     -0.6246000     -3.6499999E-02
 C   -2.975100      0.4000000     -9.2000002E-03
 C   -4.430500      0.1435000      0.1747000    
 H    3.538200       1.232100      0.9363000    
 H    4.047900       1.883400     -0.6426000    
 H    5.525800     -0.2960000      0.9237000    
 H    6.043900      0.3855000     -0.6038000    
 H  -0.2207000      -2.435400      0.6248000    
 H    1.657700       1.713300      -1.351000    
 H  -0.7429000       1.498500      -1.092300    
 H    3.044900      -2.884300     -0.3901000    
 H    3.152000      -2.176200       1.244200    
 H    1.897900      -3.361200      0.8654000    
 H    5.740900       1.955200       2.017800    
 H    7.266000       1.434700       1.281500    
 H    6.262900       2.649400      0.4702000    
 H   -2.456400      -1.643500      8.1200004E-02
 H   -2.666500       1.436200     -9.4499998E-02
 H   -4.805900       2.245300      9.4999997E-03
 H   -6.614100       1.315600       1.309300    


%chk=000033372-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000033372

0 1
O 3.505469 -0.291434 0.262747
O -5.095058 -0.906129 0.020440
O -6.819784 1.054769 -0.110719
N -5.415580 1.344863 -0.084520
C 1.450781 -1.508119 0.248398
C 2.107112 -0.240265 0.213660
C 4.256353 0.980557 0.235053
C 5.744272 0.629965 0.306391
C -0.737048 -0.325794 0.125306
C 0.044573 -1.518102 0.203262
C 1.359224 0.963673 0.134566
C -0.045248 0.916334 0.091172
C 2.265008 -2.782000 0.331338
C 6.625888 1.898156 0.280886
C -2.195776 -0.443281 0.085792
C -3.117385 0.568831 0.015758
C -4.555122 0.265053 -0.013634
H 3.953748 1.607436 1.099740
H 4.022013 1.528509 -0.701451
H 5.931671 0.051479 1.230008
H 5.997244 -0.030059 -0.543999
H -0.473565 -2.485164 0.229827
H 1.864423 1.933325 0.106179
H -0.603606 1.856914 0.029941
H 2.956990 -2.868349 -0.526354
H 2.895222 -2.792974 1.239486
H 1.610284 -3.669567 0.346363
H 6.403602 2.561471 1.137760
H 7.695623 1.630238 0.333231
H 6.470312 2.479153 -0.647490
H -2.609423 -1.461920 0.116772
H -2.818037 1.624653 -0.019477
H -5.219950 2.342656 -0.119951
H -6.782530 0.037623 -0.066979


