%chk=000004351.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004351

0 1
 O    1.640300     -0.2980000      0.6817000    
 O    1.115900       1.217000     -0.9629000    
 N  -0.3022000      0.8304000      0.8334000    
 N   -4.874600      -1.805300      0.1408000    
 C    2.868100     -0.5959000      7.4999998E-03
 C   -2.422000       1.108900     -0.3944000    
 C   -3.121100     -6.3600004E-02  0.3049000    
 C   -1.348200       1.750600      0.4797000    
 C    3.693500      0.6865000     -8.8799998E-02
 C    3.603900      -1.647700      0.8348000    
 C    2.540400      -1.138500      -1.382900    
 C   -4.238500     -0.6827000     -0.5376000    
 C   0.8443000      0.6383000      8.3899997E-02
 H   -1.974300      0.7551000      -1.331200    
 H   -3.165100       1.870400     -0.6590000    
 H   -2.384200     -0.8408000      0.5429000    
 H   -3.537300      0.2827000       1.259600    
 H  -0.9078000       2.603100     -4.8900001E-02
 H   -1.785600       2.122600       1.412300    
 H    3.686500       1.230400      0.8629000    
 H    4.736600      0.4518000     -0.3329000    
 H    3.362300       1.384300     -0.8619000    
 H    4.559000      -1.929900      0.3801000    
 H    2.992900      -2.550900      0.9465000    
 H    3.798200      -1.278300       1.848200    
 H    2.231800     -0.3800000      -2.106600    
 H    3.420600      -1.624200      -1.821000    
 H    1.736600      -1.882300      -1.333400    
 H   -4.998600      7.4900001E-02 -0.7566000    
 H   -3.832500      -1.026900      -1.495500    
 H  -0.4100000      0.2849000       1.683200    
 H   -4.182700      -2.530200      0.3267000    
 H   -5.569200      -2.224100     -0.4761000    


%chk=000004351-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000004351

0 1
O 1.674872 -0.292404 0.527004
O 1.137561 1.427074 -1.031288
N -0.307892 0.782866 0.700891
N -5.073832 -1.785551 0.313809
C 3.048927 -0.571162 -0.059502
C -2.544260 1.039959 -0.450202
C -3.262360 -0.084755 0.326263
C -1.395667 1.706223 0.345236
C 3.925918 0.691658 0.061651
C 3.559922 -1.701372 0.851682
C 2.900027 -1.047315 -1.519078
C -4.439516 -0.697848 -0.459957
C 0.859053 0.708722 -0.032516
H -2.137086 0.646933 -1.402451
H -3.276285 1.830251 -0.716280
H -2.535202 -0.889800 0.565488
H -3.651640 0.295686 1.291287
H -0.944996 2.513589 -0.257414
H -1.795275 2.153930 1.276194
H 3.964001 1.034917 1.110948
H 4.956607 0.458068 -0.263109
H 3.530562 1.504221 -0.568006
H 4.571716 -2.011724 0.534860
H 2.889563 -2.576594 0.797262
H 3.607436 -1.362179 1.900938
H 2.503077 -0.240634 -2.155032
H 3.886923 -1.357512 -1.909235
H 2.219629 -1.916083 -1.572703
H -5.202434 0.085857 -0.633949
H -4.068674 -1.012609 -1.467408
H -0.411602 0.137288 1.483717
H -4.442278 -2.568335 0.514294
H -5.969795 -2.108766 -0.063995


