%chk=000019724.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019724

0 1
 O    1.330500      0.2762000     -7.4800000E-02
 O    3.237900       1.459300      0.3561000    
 N   -3.759800     -0.6987000     -0.1076000    
 N    3.358900     -0.8192000     -9.3300000E-02
 C   -3.444000      0.6769000     -0.4705000    
 C   -5.184100     -0.9720000     -0.3098000    
 C   -3.385000     -0.9650000       1.282600    
 C    4.809400     -0.9245000      3.1700000E-02
 C    2.654000      -2.052000     -0.4142000    
 C    2.686100      0.3942000      8.4600002E-02
 C   -2.019200      0.9570000     -0.2703000    
 C   0.5677000       1.476900      9.2799999E-02
 C  -0.8524000       1.190900     -0.1073000    
 H   -4.042300       1.390000      0.1114000    
 H   -3.685200      0.8440000      -1.527600    
 H   -5.462900     -0.8051000      -1.356300    
 H   -5.820700     -0.3418000      0.3219000    
 H   -5.409800      -2.021400     -8.9800000E-02
 H   -2.300600     -0.9408000       1.432200    
 H   -3.693300      -1.977600       1.570000    
 H   -3.854600     -0.2627000       1.981700    
 H    5.220100      -1.282300     -0.9166000    
 H    5.043900      -1.635900      0.8285000    
 H    5.254700      4.4000000E-02  0.2728000    
 H    2.858800      -2.784100      0.3728000    
 H    3.034800      -2.431900      -1.367100    
 H    1.573200      -1.924900     -0.4977000    
 H   0.7298000       1.868500       1.103300    
 H   0.9039000       2.222100     -0.6369000    


%chk=000019724-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000019724

0 1
O 1.494431 -0.061594 -0.020696
O 3.255209 1.194414 0.905992
N -4.103568 -0.693359 0.285451
N 3.668601 -0.790684 -0.289107
C -3.342431 0.209645 -0.617774
C -5.420568 -1.028197 -0.292494
C -4.208973 -0.168009 1.661805
C 5.123849 -0.686034 -0.108157
C 3.164503 -1.947725 -1.044075
C 2.861415 0.188802 0.249982
C -1.954403 0.449622 -0.185395
C 0.581746 0.972531 0.557699
C -0.785565 0.672097 0.138882
H -3.851025 1.205121 -0.736788
H -3.323269 -0.254659 -1.623517
H -5.287147 -1.496327 -1.284586
H -6.094455 -0.140658 -0.413749
H -5.932692 -1.755988 0.360849
H -3.198084 0.006687 2.066944
H -4.713003 -0.914506 2.300456
H -4.783222 0.792129 1.724867
H 5.633781 -0.629317 -1.089381
H 5.511776 -1.566685 0.439590
H 5.345660 0.224615 0.467901
H 3.461748 -2.890998 -0.545258
H 3.583382 -1.949781 -2.069524
H 2.069387 -1.904446 -1.104312
H 0.682654 0.954491 1.659000
H 0.910064 1.968913 0.207995


