! 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
O   -0.11376905   1.10140630   2.32133702 
C   -0.06497502   0.58658114   1.23413331 
N   -1.19611682   0.15887756   0.54373790 
C   -2.39087225  -0.09603531   1.25756459 
C   -2.36984959  -0.85218911   2.42614455 
C   -3.54775379  -1.11787148   3.10247821 
C   -4.76150646  -0.65200819   2.61780028 
C   -4.78313509   0.09150183   1.44883853 
C   -3.60626313   0.37654185   0.77402552 
C   -1.25027234   0.21571838  -0.87193861 
C   -0.91720352   1.38773423  -1.53908572 
C   -0.93298380   1.42545934  -2.92501952 
C   -1.30626094   0.30367414  -3.64884232 
C   -1.66853386  -0.85733167  -2.97920461 
C   -1.63920095  -0.90482752  -1.59649977 
N    1.12847595   0.36681709   0.55163499 
C    2.26960422   1.13050007   0.89362434 
C    2.19018758   2.51688546   0.98088606 
C    3.31702881   3.25866767   1.29107473 
C    4.53768847   2.63289217   1.49965806 
C    4.61810965   1.25289040   1.40208358 
C    3.49090460   0.50188888   1.10856122 
C    1.30354831  -0.76887041  -0.27811735 
C    1.81134344  -0.61327997  -1.56262500 
C    1.97107127  -1.71757130  -2.38087610 
C    1.61913078  -2.98208944  -1.92867148 
C    1.12477196  -3.13792087  -0.64289062 
C    0.97900968  -2.03679886   0.18733734 
H   -1.43516565  -1.23026647   2.81702066 
H   -3.51549207  -1.70142950   4.01308914 
H   -5.68031704  -0.86740427   3.14627607 
H   -5.72109293   0.46460867   1.05920689 
H   -3.63537706   0.96509771  -0.13354610 
H   -0.64321177   2.26991957  -0.97428854 
H   -0.66348333   2.33898441  -3.43860038 
H   -1.32081696   0.33465344  -4.73009865 
H   -1.96066239  -1.73682191  -3.53715430 
H   -1.89989275  -1.81471100  -1.07269702 
H    1.24780324   3.02028788   0.81223521 
H    3.23975530   4.33551996   1.36224142 
H    5.41728637   3.21657042   1.73534109 
H    5.56235667   0.75048355   1.56545875 
H    3.56384206  -0.57579185   1.04361208 
H    2.06515938   0.37586510  -1.91954383 
H    2.35729557  -1.58836865  -3.38304337 
H    1.73558441  -3.84259071  -2.57386725 
H    0.86254131  -4.12180398  -0.27668327 
H    0.61140952  -2.16374477   1.19789221 
*