%chk=000096534.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096534

0 1
 O    2.570900       1.450000       0.000000    
 O    1.802800      -2.522100      3.0000001E-04
 O    3.250000     -0.8713000     -3.0000001E-04
 O   -3.629500      0.5630000       0.000000    
 O   -2.973100      -1.531900     -3.0000001E-04
 N    2.073000      -1.299200      9.9999997E-05
 N   -2.723600     -0.3035000       0.000000    
 C  -0.3214000     -0.8024000       0.000000    
 C    1.001400     -0.3598000       0.000000    
 C   0.2349000       1.931300     -1.9999999E-04
 C   -1.366100      0.1219000       0.000000    
 C    1.279500       1.007000     -9.9999997E-05
 C   -1.088000       1.488700       0.000000    
 C  -0.6227000      -2.270600      9.9999997E-05
 C   0.5117000       3.398800      1.9999999E-04
 H   -1.885900       2.227800      1.9999999E-04
 H  -7.1400002E-02  -2.728600     -0.8317000    
 H  -0.3576000      -2.712800      0.9676000    
 H   -1.557800      -2.735500     -0.2795000    
 H    1.072400       3.686100      0.8960000    
 H    1.072800       3.686400     -0.8950000    
 H  -0.4134000       3.986000      9.9999997E-05
 H    2.615400       2.418300     -9.9999997E-05


%chk=000096534-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096534

0 1
O 2.604113 1.379798 0.043640
O 2.402638 -1.951582 0.998703
O 2.793638 -1.355492 -1.172211
O -3.678958 0.660671 -0.188352
O -3.140759 -1.513480 0.206213
N 2.137631 -1.283203 -0.069554
N -2.811085 -0.281189 0.000789
C -0.339504 -0.891587 -0.032503
C 0.970995 -0.358896 -0.027828
C 0.205083 1.976937 0.036300
C -1.376718 0.091123 -0.006205
C 1.262823 1.025170 0.011065
C -1.106579 1.480969 0.020745
C -0.562548 -2.389029 -0.098747
C 0.510229 3.461160 0.083966
H -1.959102 2.165080 0.031557
H 0.376505 -2.932434 -0.279528
H -1.002624 -2.757625 0.843150
H -1.284582 -2.645072 -0.890789
H 1.071227 3.742094 0.997605
H 1.096246 3.794330 -0.795839
H -0.421551 4.048255 0.087358
H 2.727184 2.361602 0.057867


