! Freq RIJCOSX PBEh-3c
%output 
xyzfile=True 
end 
%scf 
maxiter 250 
end
%output
Print[P_Hirshfeld] = 1
end
% maxcore
4800
%pal nprocs 8
end
*xyz 0 1
C   -3.21810501   1.25855294   0.80266027 
C   -2.27842995   1.35169657  -0.39207182 
N   -1.16890676   0.41129841  -0.39962139 
C   -1.52353256  -0.99510296  -0.54170644 
C   -1.50674410  -1.79457253   0.75450915 
C   -0.03943530   0.79752139   0.30035468 
N    1.11289672   0.08592833   0.04892469 
C    2.24936695   0.36679539   0.91434913 
C    3.03046453   1.62618355   0.56162960 
C    1.44615819  -0.43751226  -1.26534380 
C    1.81546196  -1.91432610  -1.26343478 
O   -0.05960330   1.71526434   1.09976652 
H   -3.71891534   0.29072270   0.85697637 
H   -3.99684832   2.01813794   0.72181545 
H   -2.67967059   1.42463269   1.73339901 
H   -2.84316681   1.19207570  -1.31508122 
H   -1.87031104   2.35912173  -0.45231600 
H   -0.88993550  -1.48897698  -1.28030129 
H   -2.52750251  -1.01987944  -0.96846289 
H   -1.81570780  -2.82364022   0.56542580 
H   -2.18402148  -1.37033176   1.49460059 
H   -0.50868128  -1.82409503   1.19075571 
H    1.89404334   0.43443490   1.94136552 
H    2.91138262  -0.50121543   0.87474754 
H    3.87815701   1.73899349   1.23834137 
H    2.40319261   2.50961079   0.65575496 
H    3.43243945   1.59334679  -0.45218830 
H    2.28747186   0.13474783  -1.67214236 
H    0.61774442  -0.24853764  -1.94552752 
H    2.04798909  -2.24627341  -2.27569471 
H    1.00678199  -2.53640990  -0.88051804 
H    2.69596689  -2.10829180  -0.65086580 
*
