! 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    1.18205997   0.00417805   1.12764157 
C    2.38621715   0.04675617  -0.04282322 
C    3.51541338   0.75687642   0.66151384 
C    1.80530372   0.80551488  -1.20609313 
C    2.63793623  -1.41571501  -0.31476580 
C    0.04739380   0.44844918   1.01729452 
N   -1.09267515   0.85719043   0.84191986 
C   -2.38363051  -0.03876069   0.25658878 
C   -1.85109065  -1.42722330   0.02067856 
C   -3.39473757   0.05344984   1.37289920 
C   -2.76643162   0.70425154  -0.99997032 
H    1.45870650  -0.43024217   2.01540661 
H    4.35167380   0.79672749  -0.04052786 
H    3.87362387   0.22151916   1.54081690 
H    3.27338524   1.78462650   0.92799636 
H    2.57391151   0.84807684  -1.98017880 
H    1.56241561   1.84124993  -0.96551438 
H    0.94868682   0.30545627  -1.66063191 
H    1.77570765  -1.92331047  -0.74477528 
H    2.98622657  -1.96145504   0.56198696 
H    3.44239596  -1.46936060  -1.05235284 
H   -1.31403137   1.82983855   1.08332294 
H   -2.67757010  -2.02829570  -0.36279594 
H   -1.07145435  -1.46650891  -0.74183206 
H   -1.51943414  -1.92159870   0.93464185 
H   -3.05548903  -0.41353418   2.29629729 
H   -4.28054006  -0.49520838   1.04422444 
H   -3.71947831   1.07424237   1.57415617 
H   -3.07826215   1.73169703  -0.81241736 
H   -3.63197428   0.19003654  -1.42440210 
H   -1.98425849   0.69127594  -1.75780485 
*
