%chk=000033351.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033351

0 1
 O   0.7704000     -0.2077000      -1.062700    
 N   0.2776000       1.320200      0.6155000    
 N    3.391900     -0.2543000     -0.2467000    
 C   -1.026200       1.718300      0.1346000    
 C   -2.007100      0.5394000      8.5699998E-02
 C  -0.8387000       2.312100      -1.273700    
 C   -1.555100       2.810900       1.082000    
 C   -2.995500      0.5500000     -0.8684000    
 C   -1.855100     -0.4765000      0.9978000    
 C    1.072700      0.3835000     -2.8500000E-02
 C    2.370600      0.1384000      0.7137000    
 C   -3.887200     -0.5217000     -0.9132000    
 C   -2.746700      -1.548400      0.9529000    
 C   -3.762700      -1.570900     -2.4999999E-03
 C    4.661700     -0.5132000      0.4186000    
 C    5.742700     -0.8638000     -0.5985000    
 C   -4.716300      -2.716400     -4.9800001E-02
 C    7.102900      -1.100000      4.3200001E-02
 H   1.4000000E-02   3.003900      -1.289100    
 H  -0.6486000       1.558100      -2.045400    
 H   -1.704400       2.904300      -1.593400    
 H  -0.8736000       3.669100       1.118900    
 H   -1.661800       2.434200       2.106600    
 H   -2.538200       3.176600      0.7635000    
 H   0.6128000       1.727100       1.484400    
 H   -3.147200       1.353700      -1.578200    
 H   -1.089900     -0.4737000       1.766900    
 H    2.186500     -0.6574000       1.444100    
 H    2.673700       1.046600       1.247000    
 H   -4.679500     -0.5249000      -1.657200    
 H   -2.644000      -2.356600       1.672200    
 H    4.551000      -1.343400       1.126600    
 H    4.978600      0.3704000      0.9866000    
 H    3.516000      0.4889000     -0.9344000    
 H    5.840800     -5.4400001E-02  -1.332800    
 H    5.451900      -1.764100      -1.153800    
 H   -4.239200      -3.642000      0.2896000    
 H   -5.580600      -2.512300      0.5898000    
 H   -5.069600      -2.894500      -1.071200    
 H    7.445900     -0.2055000      0.5726000    
 H    7.058500      -1.927300      0.7586000    
 H    7.845300      -1.349500     -0.7212000    


%chk=000033351-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000033351

0 1
O 1.019434 0.564345 -1.205875
N 0.252122 1.650686 0.716257
N 3.275075 -0.294575 0.186928
C -1.141892 1.939821 0.260684
C -1.924733 0.624251 0.026246
C -1.084419 2.840602 -1.001167
C -1.821521 2.716000 1.425202
C -3.008850 0.560447 -0.883305
C -1.634458 -0.534099 0.788926
C 1.220612 1.022799 -0.039721
C 2.610281 0.937597 0.619429
C -3.769085 -0.621145 -1.027745
C -2.393663 -1.713270 0.642737
C -3.480848 -1.780092 -0.265371
C 4.740973 -0.304832 0.331756
C 5.337180 -1.632895 -0.175007
C -4.313149 -3.043365 -0.405147
C 6.874982 -1.675955 -0.051799
H -0.454922 3.724234 -0.793227
H -0.652317 2.286839 -1.849451
H -2.090089 3.202060 -1.276401
H -1.300585 3.673343 1.618317
H -1.831474 2.112936 2.352226
H -2.868806 2.939696 1.163233
H 0.507212 1.956599 1.657701
H -3.261667 1.426219 -1.504391
H -0.786793 -0.525060 1.483273
H 2.525439 0.969060 1.726325
H 3.169454 1.863618 0.316217
H -4.594957 -0.643987 -1.749853
H -2.132073 -2.599125 1.235008
H 4.993102 -0.180949 1.405403
H 5.231341 0.549166 -0.207460
H 2.954914 -0.550022 -0.759841
H 5.045028 -1.779687 -1.235348
H 4.880226 -2.463223 0.395739
H -3.705354 -3.948803 -0.230164
H -5.143587 -3.058888 0.327820
H -4.761739 -3.123165 -1.411086
H 7.346695 -0.867477 -0.641797
H 7.193251 -1.554042 1.000976
H 7.277963 -2.638462 -0.415544


