! wb97x-d3
! def2-TZVPP
! def2/J RIJCOSX GRIDX6 NOFINALGRIDX
! grid4 nofinalgrid
! scfconv7
! smallprint printgap noloewdin
! NOSOSCF
%MaxCore 8000
%output
       print[P_BondOrder_M] 1
       print[P_Mayer] 1
       print[P_basis] 2
end
%pal
    nprocs 8
end
%cpcm
    smd    true
    smdsolvent "WATER"
end
*xyz 0 1
Cl  -5.2884673904   1.2659581984  -0.4877331398
F   -0.9051537894  -2.7766941285   0.4680934701
F   -0.1655995398  -1.1370573886   1.6473716839
F   -2.1218770977  -1.9398071478   2.0256945446
O    2.2093844116   1.2217857696   0.8573537579
N    2.4877170956  -0.7197366362  -1.1185762620
N    0.2206498437  -0.7093287632  -1.1955759147
N    4.6406110174  -1.0134964891  -1.5014833958
C    1.2702604881  -0.0846074806  -0.8692768720
C    1.3472270390   1.2810151972  -0.2434657902
C    2.4351139621   2.4942202310   1.4356963628
C   -1.0501177595  -0.1868355489  -0.9805632629
C    3.4914677486   2.3772605922   2.5125391985
C   -1.8426319993  -0.6515464428   0.0749438043
C   -1.5904557089   0.7388914193  -1.8684471537
C   -3.1452096253  -0.1990381842   0.2278602897
C    2.6542912653  -2.0586524379  -1.4121053095
C    3.7265991825   3.7165731945   3.1939855751
C    3.7285055851  -0.1476624982  -1.1856300878
C   -1.2633455277  -1.6276792673   1.0519054721
C   -2.8884987843   1.1932894865  -1.7200032465
C   -3.6592806084   0.7164635744  -0.6734630342
C    3.9804772129  -2.2146712920  -1.6323104601
H    0.3411130507   1.6045358067   0.0454601600
H    1.6974612143   1.9956159674  -1.0037160865
H    1.5008904151   2.8877279873   1.8584358582
H    2.7627349534   3.2062216406   0.6656028507
H    3.1815556885   1.6354406803   3.2526716929
H    4.4230187268   2.0172451865   2.0692440640
H   -0.9898962806   1.0981895100  -2.6932884084
H   -3.7620755916  -0.5495046111   1.0428721128
H    1.8337397643  -2.7538444726  -1.4167166643
H    4.5084040903   3.6404126300   3.9493242026
H    4.0354226001   4.4804236537   2.4782798758
H    2.8238489910   4.0751873708   3.6905969129
H    3.9031937780   0.9026697254  -1.0263288911
H   -3.2894761015   1.9127967926  -2.4204062077
H    4.5030667822  -3.1248783942  -1.8772810913
*