%chk=000087895.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087895

0 1
 O   -2.962000     -0.1759000      3.0000001E-04
 O    3.029800      -1.903500      3.0000001E-04
 O   -2.074400       1.947900      6.9999998E-04
 O    2.875900       2.171800     -3.0000001E-04
 O    4.074600      0.3327000       0.000000    
 N    2.967800      0.9215000     -3.0000001E-04
 C  -0.6378000      4.5100000E-02   0.000000    
 C    1.776200      0.1450000     -3.9999999E-04
 C   0.5403000      0.7919000     -3.0000001E-04
 C  -0.5803000      -1.348600      1.9999999E-04
 C    1.833800      -1.248800     -9.9999997E-05
 C   0.6555000      -1.995400      1.9999999E-04
 C   -1.926800      0.7186000      6.9999998E-04
 C   -4.286600      0.3673000     -3.0000001E-04
 C   -5.285900     -0.7698000     -7.9999998E-04
 H   0.4766000       1.877700     -3.0000001E-04
 H   -1.470900      -1.970700      6.0000003E-04
 H   0.6856000      -3.081900      5.0000002E-04
 H   -4.426600      0.9849000      0.8936000    
 H   -4.425800      0.9849000     -0.8944000    
 H   -6.311200     -0.3896000     -1.2000001E-03
 H   -5.144200      -1.406700     -0.8802000    
 H   -5.145000      -1.406700      0.8787000    
 H    2.867700      -2.862500      5.0000002E-04


%chk=000087895-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000087895

0 1
O -3.017822 -0.207287 0.001824
O 3.153208 -1.936360 -0.001394
O -2.080798 1.930413 0.001171
O 2.775075 2.286429 -0.001971
O 4.178770 0.493769 -0.002651
N 3.000504 1.011029 -0.001771
C -0.633375 -0.032755 0.002327
C 1.815384 0.114753 -0.000356
C 0.548722 0.734841 0.000843
C -0.540991 -1.450249 0.002433
C 1.917159 -1.310808 -0.000184
C 0.714549 -2.071729 0.001234
C -1.941479 0.683128 0.003748
C -4.377357 0.417707 -0.000364
C -5.388321 -0.723432 -0.002378
H 0.493891 1.827272 0.000715
H -1.457962 -2.044914 0.003555
H 0.781057 -3.167387 0.001384
H -4.461896 1.060803 0.894139
H -4.458879 1.061283 -0.894800
H -6.413531 -0.310788 -0.003989
H -5.269227 -1.356535 -0.898216
H -5.272242 -1.357017 0.893515
H 3.041860 -2.922965 -0.001114


