%chk=000012075.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012075

0 1
 O    3.215600       1.501600       0.000000    
 O    3.376300     -0.6877000      1.9999999E-04
 O   -3.598200       1.084100     -9.9999997E-05
 O   -3.475300      -1.107700     -1.9999999E-04
 N    2.691900      0.3626000     -9.9999997E-05
 N   -2.929800      2.2299999E-02  1.9999999E-04
 C   0.6450000     -0.9867000     -9.9999997E-05
 C    1.273400      0.2585000     -1.9999999E-04
 C  -0.7477000      -1.065200      9.9999997E-05
 C   -1.511900      0.1017000      1.9999999E-04
 C   0.5092000       1.425300     -9.9999997E-05
 C  -0.8835000       1.347000      1.9999999E-04
 C    1.435000      -2.255600       0.000000    
 H   -1.221500      -2.044200      9.9999997E-05
 H   0.9611000       2.414000     -1.9999999E-04
 H   -1.447000       2.276600      3.0000001E-04
 H    2.033700      -2.366300     -0.9101000    
 H    2.033500      -2.366200      0.9103000    
 H   0.7624000      -3.123500       0.000000    


%chk=000012075-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000012075

0 1
O 3.205945 1.647327 -0.001284
O 3.510227 -0.606979 -0.000856
O -3.651335 1.134959 0.004074
O -3.520092 -1.144361 0.003707
N 2.752157 0.437547 0.002289
N -2.985087 0.030053 -0.003514
C 0.669409 -1.044195 -0.000035
C 1.269279 0.253472 0.000808
C -0.748647 -1.070953 -0.001326
C -1.497801 0.119966 -0.001899
C 0.508975 1.448330 0.000254
C -0.892152 1.394053 -0.001008
C 1.411494 -2.364873 0.000376
H -1.280234 -2.026495 -0.002054
H 1.039855 2.403325 0.000923
H -1.507981 2.296151 -0.001460
H 2.073887 -2.457841 -0.877035
H 2.071947 -2.458340 0.879197
H 0.692353 -3.200546 -0.000657


