! 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 "1-OCTANOL"
end
*xyz 0 1
Cl  -2.0683417770   0.5845984244  -2.7353975689
Cl  -2.4726931020   4.9855494531   0.2689672835
F    2.6787721345  -1.7744155775   0.9525846272
F    3.2995719602  -0.8838456782  -0.9133759824
F    3.4902072177   1.5740939831   0.3001461177
F    4.6843129077   0.0098914124   1.2487316379
O    1.4126213160  -0.1739808499   0.0464161174
N   -1.0691683240  -3.0148560698   0.8406513127
N    0.0472632888  -3.7182528346   0.6381421854
N   -1.7481078478  -5.0495081810   0.5146835423
C   -0.8723123593  -0.8113578630  -0.2646676356
C   -1.0517736154  -1.5855914540   1.0485303604
C    0.5415231642  -0.9092618630  -0.8257914740
C   -1.2877017112   0.6341841288  -0.1290133174
C   -1.8306919072   1.3484143267  -1.1964363315
C   -1.1113205547   1.3315964887   1.0639341479
C    2.6542332087  -0.6144806338   0.2482767970
C   -2.1978912505   2.6811007448  -1.0908337618
C   -1.4701738391   2.6612862226   1.2042073898
C   -2.1311936966  -3.8204633282   0.7620074873
C   -2.0131384521   3.3264106139   0.1188950609
C    3.4223215311   0.4445409476   1.0394820371
C   -0.4082437129  -4.9305292939   0.4470509125
H   -1.5204421011  -1.2903423806  -1.0031410308
H   -0.2722929467  -1.3615717439   1.7755438825
H   -2.0059057894  -1.3210517789   1.5025386283
H    0.8396910430  -1.9544956695  -0.9138102309
H    0.5853731624  -0.4601244991  -1.8192465891
H   -0.6857120419   0.8322246246   1.9236095201
H   -2.6202784250   3.2021199716  -1.9388561385
H   -1.3221126875   3.1669177103   2.1482008640
H   -3.1436618667  -3.4722176642   0.8964581769
H    2.9491369398   0.6638438908   1.9977928462
H    0.2527830490  -5.7619482932   0.2557560615
*