! 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 2 1
N   -1.13092394  -0.40423293  -2.35895559 
C   -1.37332502   0.03028541  -1.09484020 
C   -1.31359189  -0.84205819   0.02617631 
C   -1.54563598  -0.33335507   1.28394658 
C   -1.82508237   1.02086444   1.44889930 
C   -1.94204899   1.87755496   0.33789046 
C   -1.72698269   1.39692278  -0.92231498 
S   -0.05994927  -1.56178136  -2.88445038 
N    1.04813597  -1.77149487  -1.66197335 
C    1.34031752  -0.95549839  -0.61581162 
C    1.29717302   0.46161877  -0.72877351 
C    1.57306966   1.23147601   0.37854033 
C    1.88338393   0.62377831   1.59235080 
C    1.98704386  -0.77660007   1.69521737 
C    1.72639613  -1.56398201   0.61023527 
H   -1.37172404   0.24130220  -3.11185173 
H   -1.20928184  -1.91060128  -0.11422703 
H   -1.53763713  -0.99353779   2.14008374 
H   -2.00690571   1.41247661   2.44152545 
H   -2.20615790   2.91616426   0.48329258 
H   -1.80819986   2.05320837  -1.78121446 
H    1.27981125  -2.75822473  -1.54281014 
H    1.17135893   0.93091186  -1.69620081 
H    1.57598012   2.30947520   0.29611090 
H    2.09967127   1.23648837   2.45813649 
H    2.27712995  -1.22822678   2.63411819 
H    1.79807500  -2.64293409   0.68690004 
*