%chk=000020788.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020788

0 1
 O    3.338600      0.1687000      0.3205000    
 O    1.854200      -1.579800      0.2016000    
 O    5.611100       1.064800      -1.055600    
 N    1.168300      0.5736000      0.7258000    
 C  -0.9896000      0.4802000     -0.4392000    
 C  -0.2431000      0.3096000      0.8863000    
 C   -2.462600      0.2345000     -0.2943000    
 C   -2.967900      -1.048200     -0.4751000    
 C   -3.309600       1.291800      1.8900000E-02
 C   -4.337400      -1.276700     -0.3409000    
 C   -4.679100       1.063400      0.1533000    
 C    2.095200     -0.3932000      0.3975000    
 C   -5.193000     -0.2208000     -2.6799999E-02
 C    4.407300     -0.7236000     -1.4600000E-02
 C    5.707600      5.5799998E-02 -5.7599999E-02
 H  -0.5736000     -0.1986000      -1.195600    
 H  -0.8191000       1.489600     -0.8368000    
 H  -0.3741000     -0.7062000       1.276700    
 H  -0.6200000       1.010900       1.638900    
 H    1.496100       1.526000      0.8551000    
 H   -2.310200      -1.878300     -0.7181000    
 H   -2.919900       2.295700      0.1631000    
 H   -4.737500      -2.276700     -0.4804000    
 H   -5.345300       1.885400      0.3984000    
 H   -6.259300     -0.3986000      7.8000002E-02
 H    4.472400      -1.517800      0.7370000    
 H    4.202400      -1.158900     -0.9994000    
 H    6.547300     -0.6023000     -0.2993000    
 H    5.892900      0.5501000      0.9011000    
 H    6.456700       1.545000      -1.057800    


%chk=000020788-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000020788

0 1
O 3.375923 0.184722 0.382384
O 1.742927 -1.485265 0.027340
O 5.836976 0.943755 -1.117608
N 1.200291 0.644090 0.860963
C -0.985070 0.659752 -0.406532
C -0.245355 0.398212 0.939789
C -2.463278 0.320121 -0.300544
C -2.889653 -1.033863 -0.344196
C -3.440423 1.331085 -0.113391
C -4.255111 -1.367520 -0.206474
C -4.808726 1.001740 0.024550
C 2.060513 -0.320731 0.389021
C -5.220555 -0.349946 -0.020523
C 4.394810 -0.741052 -0.166207
C 5.747269 -0.061500 -0.049716
H -0.497990 0.035604 -1.178507
H -0.847412 1.718708 -0.695771
H -0.397686 -0.655223 1.232236
H -0.671157 1.036338 1.735366
H 1.585745 1.566569 1.063227
H -2.146170 -1.826338 -0.497565
H -3.127966 2.382824 -0.084104
H -4.567314 -2.417326 -0.248331
H -5.550851 1.796583 0.162241
H -6.280630 -0.607515 0.083370
H 4.372250 -1.684365 0.409913
H 4.161327 -0.964767 -1.222221
H 6.537029 -0.834942 -0.170313
H 5.844543 0.395573 0.956873
H 6.644546 1.500081 -0.984572


