! 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
N   -1.06439884  -0.66708478   0.38048718 
C   -2.42968450  -0.49949952   0.12927695 
C   -3.28051581  -1.49644103   0.61152354 
C   -4.64740941  -1.41991335   0.41764452 
C   -5.19817741  -0.34531422  -0.26327469 
C   -4.35437732   0.64396494  -0.74122373 
C   -2.98158846   0.58349765  -0.55482569 
C   -0.01633564   0.12423697  -0.02970663 
N    1.19692944  -0.36664118   0.39441836 
C    2.47577504   0.14304156   0.14940787 
C    2.73972860   1.30009505  -0.58361366 
C    4.05329995   1.70531070  -0.76661473 
C    5.11563021   0.99014536  -0.23807724 
C    4.85040455  -0.15747350   0.49304914 
C    3.54662802  -0.57590431   0.68505334 
O   -0.14680844   1.13201781  -0.68424206 
H   -0.84801177  -1.49868246   0.90323646 
H   -2.86925276  -2.34725614   1.14456164 
H   -5.28208820  -2.20772817   0.80137941 
H   -6.26631988  -0.28162104  -0.41878362 
H   -4.76629141   1.49077663  -1.27449672 
H   -2.35354586   1.36878939  -0.93960090 
H    1.19548245  -1.20995060   0.94297295 
H    1.93538063   1.87784258  -1.00589968 
H    4.24158334   2.60473318  -1.33818410 
H    6.13358569   1.32061612  -0.39231910 
H    5.66082488  -0.73466601   0.91815153 
H    3.35965291  -1.47679161   1.25979968 
*
