%chk=000003436.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003436

-1 1
 O   -2.945200     -0.9095000      0.6038000    
 O   -5.610800      4.9999999E-03   1.068000    
 O   -5.185300       1.853200     -0.1571000    
 N    4.822600     -0.2163000       1.283900    
 C   0.8769000     -0.8249000     -0.8675000    
 C    2.258800     -0.7437000      -1.427200    
 C   -1.328100      0.1203000     -0.5912000    
 C  -3.1199999E-02  0.2108000      -1.126400    
 C   -1.655300     -0.9953000      0.1727000    
 C   0.5093000      -1.929200     -9.4400004E-02
 C    3.234700     -4.7499999E-02 -0.4973000    
 C  -0.7748000      -2.040300      0.4470000    
 C   -2.497400      0.9252000     -0.6194000    
 C   -3.446300      0.2567000      0.1191000    
 C    3.410600       1.314100     -0.5810000    
 C    3.939400     -0.7747000      0.4260000    
 C    4.310900       1.924900      0.2849000    
 C   -4.874300      0.7487000      0.3653000    
 C    4.985700       1.122500       1.190700    
 H    2.631700      -1.749900      -1.663600    
 H    2.244900     -0.2281000      -2.397400    
 H   0.2543000       1.069000      -1.727900    
 H    1.224400      -2.726300      9.7900003E-02
 H   -1.067300      -2.893500       1.047200    
 H   -2.619100       1.875200      -1.121500    
 H    2.866600       1.915200      -1.302900    
 H    3.829300      -1.849500      0.5223000    
 H    4.479000       2.995300      0.2517000    
 H    5.698600       1.550300       1.887900    


%chk=000003436-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003436

-1 1
O -3.034252 -0.546465 0.801493
O -5.759596 0.248849 1.048202
O -5.517154 1.604220 -0.866538
N 5.691632 -0.164756 0.191147
C 0.835477 -0.738513 -0.791806
C 2.237223 -0.775564 -1.396080
C -1.470340 0.092311 -0.795488
C -0.174190 0.062172 -1.375162
C -1.710022 -0.699834 0.374460
C 0.551151 -1.511509 0.376514
C 3.330022 -0.158772 -0.523456
C -0.729347 -1.502844 0.975213
C -2.721933 0.758207 -1.084198
C -3.652559 0.372078 -0.125614
C 3.089340 0.973944 0.295598
C 4.649241 -0.682684 -0.526065
C 4.150432 1.528595 1.043796
C -5.123092 0.769331 0.052102
C 5.430474 0.933072 0.961219
H 2.530595 -1.817974 -1.633741
H 2.222636 -0.234511 -2.364164
H 0.046298 0.654035 -2.272564
H 1.348754 -2.121716 0.818557
H -0.954310 -2.095126 1.867458
H -2.959296 1.447869 -1.889429
H 2.079871 1.396128 0.348893
H 4.886053 -1.568458 -1.130902
H 3.990557 2.401659 1.685417
H 6.278936 1.333955 1.528738


