! 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    0.03396988  -2.89212529  -1.21550888 
Se  -0.08960237  -1.50229253  -0.35926928 
P    1.51859260  -0.00147543  -1.27081566 
C    1.71881041   1.05544402   0.20869476 
C    1.70689136   2.43174772  -0.00094125 
C    1.85944409   3.31069130   1.06184348 
C    2.01019162   2.82196470   2.34883795 
C    2.01299384   1.45065278   2.57252978 
C    1.87188595   0.57337062   1.51091416 
C    2.93914132  -1.14293040  -1.17084376 
C    4.07253220  -0.89308334  -0.39697015 
C    5.15853682  -1.75306372  -0.44720218 
C    5.12443246  -2.87603488  -1.26031480 
C    4.00442351  -3.12619369  -2.03873677 
C    2.92293108  -2.26072077  -2.00840004 
P   -1.84357155  -0.39937950  -1.45593895 
C   -1.74872971   1.18404905  -0.55078204 
C   -1.69997619   1.29103374   0.84123393 
C   -1.59040754   2.53125919   1.44525269 
C   -1.53971218   3.68198374   0.66917737 
C   -1.58421365   3.58891853  -0.71220568 
C   -1.67824348   2.34428788  -1.31919832 
C   -3.20279242  -1.29316362  -0.61663184 
C   -3.27708530  -2.67777111  -0.79220460 
C   -4.32846128  -3.39528837  -0.24574778 
C   -5.33229190  -2.74428359   0.45676466 
C   -5.27847173  -1.36761793   0.61152013 
C   -4.22004341  -0.64477658   0.08126173 
H    1.57581427   2.81837253  -1.00374136 
H    1.85299237   4.37752798   0.88179103 
H    2.12715893   3.50590861   3.17939671 
H    2.13215397   1.06441158   3.57638946 
H    1.89638958  -0.49320718   1.69759642 
H    4.11915948  -0.02137933   0.24202150 
H    6.03328533  -1.54309010   0.15444049 
H    5.97113655  -3.54909108  -1.29246616 
H    3.97108646  -3.99839315  -2.67792366 
H    2.06139177  -2.46653346  -2.62858893 
H   -1.75524447   0.40216112   1.45787897 
H   -1.53954964   2.60190245   2.52338138 
H   -1.45903164   4.65073204   1.14465823 
H   -1.54297487   4.48286534  -1.32054973 
H   -1.70300952   2.27096836  -2.39956129 
H   -2.50661161  -3.20114801  -1.34515824 
H   -4.36386421  -4.46893912  -0.37508877 
H   -6.15562057  -3.30716663   0.87642692 
H   -6.06199338  -0.85014537   1.14960548 
H   -4.19404331   0.42894084   0.21337290 
*
