%chk=000032112.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032112

0 1
 O  -0.9269000      0.3944000       2.067200    
 O   -1.559900      -2.448600      -1.099600    
 O   -3.916300       1.297900      -1.112800    
 O   -6.370700      0.8741000     -9.1700003E-02
 O    5.672600     -0.5215000     -0.2078000    
 O    5.198100       1.545200     -0.7920000    
 N   -2.962100     -0.3056000      0.2749000    
 N    4.856500      0.4187000     -0.3589000    
 C   -1.596500     -0.1765000     -0.1969000    
 C  -0.6186000     -0.4627000      0.9631000    
 C   0.8334000     -0.2288000      0.6128000    
 C   -1.395100      -1.074000      -1.423600    
 C    1.743800      -1.259100      0.7777000    
 C    1.223400       1.010700      0.1344000    
 C   -4.005500      0.4490000     -0.2299000    
 C    3.083500      -1.043400      0.4548000    
 C    2.563100       1.226400     -0.1885000    
 C    3.493200      0.1993000     -2.8200001E-02
 C   -5.315900      0.1045000      0.4451000    
 H   -1.484500      0.8651000     -0.5219000    
 H  -0.7608000      -1.489900       1.322000    
 H   -2.123900     -0.8257000      -2.203300    
 H  -0.3946000     -0.9390000      -1.846500    
 H   -3.164900      -1.031800      0.9563000    
 H    1.436300      -2.231100       1.152100    
 H   0.5167000       1.826200      1.5300000E-02
 H   -1.862100      0.2543000       2.293300    
 H    3.779600      -1.867000      0.5920000    
 H    2.846000       2.208100     -0.5598000    
 H   -1.417600      -2.954000      -1.918000    
 H   -5.540300     -0.9537000      0.2803000    
 H   -5.244200      0.2915000       1.521000    
 H   -6.201500       1.803600      0.1391000    


%chk=000032112-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000032112

0 1
O -1.045300 0.831453 1.886211
O -1.501852 -2.681386 -0.514223
O -3.769095 1.629960 -0.494057
O -6.341723 1.172772 0.122100
O 5.595836 -0.620836 -0.738028
O 5.335988 1.643057 -0.636199
N -3.013725 -0.468796 0.208666
N 4.887051 0.437770 -0.520805
C -1.615495 -0.300420 -0.240398
C -0.669291 -0.281569 1.013308
C 0.790032 -0.088703 0.635696
C -1.277915 -1.412046 -1.241691
C 1.619485 -1.216739 0.406950
C 1.327463 1.215812 0.495238
C -3.996689 0.475176 -0.014213
C 2.965151 -1.054618 0.026505
C 2.671465 1.397105 0.116007
C 3.470561 0.256270 -0.118228
C -5.435548 0.071850 0.361361
H -1.553279 0.685066 -0.736964
H -0.790816 -1.251390 1.538984
H -1.952038 -1.336051 -2.117827
H -0.227275 -1.327107 -1.577267
H -3.271243 -1.423707 0.481063
H 1.205702 -2.223705 0.536083
H 0.688053 2.075157 0.714682
H -2.031718 0.829145 1.989444
H 3.625080 -1.907731 -0.150505
H 3.110185 2.392076 0.003862
H -1.411318 -3.448259 -1.131020
H -5.737161 -0.807495 -0.246240
H -5.473492 -0.218719 1.431238
H -5.792778 1.913209 -0.267734


