! 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
C   -1.21863045  -1.94791289  -1.23131217 
C   -1.93231676  -0.84107253  -0.50053199 
N   -0.99715566   0.08198894   0.25183608 
C   -1.60293514   1.16285018   1.14454469 
C   -2.43145051   2.14197846   0.34586278 
C    0.22297287  -0.02698266   0.15385528 
N    1.44767466  -0.11815247   0.07646560 
C    2.23568304  -0.98762939   1.03916285 
C    1.38301863  -1.64129930   2.09384448 
C    2.22562766   0.62448995  -0.99353660 
C    1.36246468   1.48985749  -1.87301013 
H   -1.97419423  -2.55902568  -1.72494541 
H   -0.55975815  -1.58309367  -2.02018453 
H   -0.67138371  -2.61382875  -0.56363100 
H   -2.48328359  -0.18532601  -1.17439605 
H   -2.61648630  -1.21372532   0.26279624 
H   -2.19250108   0.60698120   1.87450800 
H   -0.77573592   1.64805515   1.66109660 
H   -3.32033004   1.69504224  -0.09369634 
H   -1.85362514   2.64721210  -0.42633427 
H   -2.77776385   2.90683599   1.04208533 
H    2.74316188  -1.70960999   0.39808105 
H    2.98034542  -0.31170887   1.46102819 
H    2.04198513  -2.22947097   2.73242267 
H    0.88699586  -0.92116118   2.74548785 
H    0.65470418  -2.33866269   1.67959812 
H    2.96791516   1.20028443  -0.43941480 
H    2.73908368  -0.16183722  -1.54862388 
H    0.62984460   0.92054272  -2.44589341 
H    2.01429775   1.97027033  -2.60283699 
H    0.87187533   2.29421042  -1.32412825 
*