%chk=000095221.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095221

0 1
 O   -3.862500      -2.893200     -0.4404000    
 O   -2.127200      0.1053000     -7.2899997E-02
 O   -1.751300      0.9494000       2.035400    
 O    2.247000     -0.7376000     -7.7600002E-02
 O   0.6745000     -0.6875000       1.602800    
 C   -3.796500      -1.486400     -0.6855000    
 C   -2.967600      -2.453900      -1.470400    
 C   -3.200900     -0.6974000      0.4295000    
 C   -1.472200      0.8935000      0.8320000    
 C  -0.4061000       1.659200      0.1991000    
 C   0.8906000       1.154000      0.1038000    
 C  -0.7027000       2.920900     -0.3166000    
 C    1.890600       1.910700     -0.5074000    
 C   0.2972000       3.677300     -0.9278000    
 C    1.593700       3.172300      -1.023200    
 C    1.232100     -0.1597000      0.6334000    
 C    2.673300      -2.036600      0.3470000    
 C    3.778800      -2.494200     -0.5453000    
 C    5.009100      -2.796100     -0.1159000    
 H   -4.627300     -0.9998000      -1.176600    
 H   -3.250300      -2.654600      -2.495600    
 H   -1.906000      -2.519600      -1.270600    
 H   -2.812300      -1.359500       1.212700    
 H   -3.966900     -4.7200002E-02  0.8672000    
 H   -1.709400       3.325600     -0.2481000    
 H    2.914200       1.553600     -0.5853000    
 H   6.6399999E-02   4.660000      -1.328600    
 H    2.372800       3.763100      -1.496100    
 H    1.833700      -2.736400      0.2664000    
 H    2.997200      -1.986800       1.393100    
 H    3.559000      -2.588100      -1.605500    
 H    5.769500      -3.125400     -0.8157000    
 H    5.279300      -2.720900      0.9316000    


%chk=000095221-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095221

0 1
O -3.567081 -3.187240 -0.100175
O -1.976056 0.184721 -0.412530
O -2.701208 1.714906 1.191054
O 1.977128 -0.656344 -0.313198
O 0.187498 -0.719863 1.178091
C -2.870327 -2.015636 -0.756213
C -2.059869 -3.055518 -0.050472
C -3.141454 -0.688854 -0.086190
C -1.824793 1.311871 0.391789
C -0.532639 2.019911 0.108163
C 0.724164 1.357784 -0.016569
C -0.603963 3.422378 -0.067405
C 1.872620 2.111389 -0.369575
C 0.547234 4.164917 -0.406198
C 1.785816 3.504661 -0.571850
C 0.885460 -0.085312 0.350537
C 2.270641 -2.085828 0.032416
C 3.257692 -2.591393 -0.980899
C 4.432828 -3.184845 -0.657588
H -2.912013 -2.029368 -1.852330
H -1.519447 -3.804953 -0.641507
H -1.642160 -2.815746 0.934274
H -3.219692 -0.803226 1.008637
H -4.062930 -0.209701 -0.461956
H -1.572071 3.917787 0.057078
H 2.830350 1.592810 -0.464653
H 0.476180 5.248957 -0.543406
H 2.682199 4.072918 -0.841207
H 1.312735 -2.640215 0.001064
H 2.663238 -2.129141 1.063872
H 2.959916 -2.480352 -2.032169
H 5.105125 -3.578888 -1.427061
H 4.754678 -3.298591 0.385076


