! Freq RIJCOSX PBEh-3c
%output 
xyzfile=True 
end 
%scf 
maxiter 250 
end
%output
Print[P_Hirshfeld] = 1
end
% maxcore
4800
%pal nprocs 16
end
*xyz 0 1
O   -0.55590251  -3.14384196  -0.65051511 
Si  -0.29740274  -1.67800767  -0.35601116 
N    1.16570160  -1.01553047   0.24924252 
C    1.55065109   0.31019373  -0.07590154 
C    1.87153874   1.21235575   0.93369965 
C    2.21787052   2.51241275   0.61462533 
C    2.23766836   2.93057694  -0.70962401 
C    1.92323630   2.03214961  -1.71607061 
C    1.59265942   0.72170865  -1.40188682 
C    2.06578622  -1.79794641   1.01359692 
C    1.58956448  -2.69155897   1.96728910 
C    2.47075866  -3.47323095   2.69680032 
C    3.83824317  -3.35641791   2.50394253 
C    4.31527689  -2.45489724   1.56333361 
C    3.44001780  -1.68604341   0.81501644 
N   -1.41338296  -0.38828942  -0.55857993 
C   -1.39579821   0.72153016   0.32377270 
C   -1.33598511   2.01646893  -0.18186023 
C   -1.28687676   3.09463420   0.68279011 
C   -1.28546971   2.89390884   2.05741705 
C   -1.34952014   1.60550572   2.56219039 
C   -1.41826977   0.52176580   1.69846653 
C   -2.43792245  -0.45183210  -1.53301992 
C   -3.72160793   0.00378728  -1.24146515 
C   -4.71952672  -0.07091880  -2.19836752 
C   -4.46131008  -0.61355982  -3.44880506 
C   -3.18581148  -1.07215026  -3.73753655 
C   -2.17648903  -0.98011656  -2.79306237 
H    1.83492452   0.89183925   1.96622547 
H    2.45928462   3.20895767   1.40634567 
H    2.50283185   3.95042388  -0.95423293 
H    1.94851982   2.34337514  -2.75203919 
H    1.38129845   0.01251409  -2.19407506 
H    0.52531769  -2.78560019   2.14596717 
H    2.08117678  -4.16989569   3.42698411 
H    4.52527396  -3.96125603   3.08015374 
H    5.38010415  -2.35601992   1.39837578 
H    3.82468468  -0.99820515   0.07347059 
H   -1.31323578   2.16910283  -1.25242252 
H   -1.23191624   4.09751710   0.28098542 
H   -1.23956828   3.73956682   2.73047561 
H   -1.36214001   1.43912578   3.63124133 
H   -1.50692130  -0.48251867   2.09732000 
H   -3.94147067   0.41246098  -0.26394066 
H   -5.71209933   0.28587030  -1.95695270 
H   -5.24648704  -0.67855415  -4.18972011 
H   -2.96626382  -1.49604455  -4.70825964 
H   -1.18091170  -1.32531589  -3.04557925 
*
