! 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  -0.4984667081   0.4793813600  -2.6267296380
Cl  -1.6414284154   4.8366473670   0.2402637909
F    1.8399955455   0.9516326204   1.2363263393
F    3.1345736786  -0.7424624544   1.5630407671
F    4.2924117253   1.2857398174   0.1700914469
F    2.7478810791   1.1486345924  -1.3703669584
O    1.5627217988  -0.8802307787  -0.0163526303
N   -1.8693350403  -3.3038065576   0.5436875069
N   -1.6199780066  -3.8965368780  -0.6242642732
N   -1.8525063607  -5.4246187221   0.9944082518
C   -0.8092928991  -1.1349959414   0.0269645924
C   -2.0018323908  -1.8665465337   0.6464345404
C    0.4972866604  -1.4826539815   0.7301833389
C   -1.0371903187   0.3562849505   0.0416566223
C   -0.9009125744   1.1612436970  -1.0860696032
C   -1.3557564665   0.9983801799   1.2366696561
C    2.4369113918  -0.0842756332   0.5987808046
C   -1.0860023326   2.5361352230  -1.0382716731
C   -1.5466747218   2.3650300931   1.3196132011
C   -2.0075292897  -4.2235420035   1.4994396621
C   -1.4088425296   3.1248807932   0.1702065612
C    3.4264281285   0.4441005711  -0.4392847705
C   -1.6171648888  -5.1662919703  -0.3054615596
H   -0.7279300454  -1.4801977106  -1.0048716383
H   -2.1211708673  -1.6374018114   1.7051429571
H   -2.9176527455  -1.5587266937   0.1400552825
H    0.4844374656  -1.1530327355   1.7718030266
H    0.6727547768  -2.5593539618   0.7259891199
H   -1.4511497900   0.4199930484   2.1472737522
H   -0.9764700158   3.1342894090  -1.9320901662
H   -1.7934059991   2.8245075029   2.2664942767
H   -2.2184500729  -3.9744837337   2.5277642565
H    3.9816075836  -0.3605318492  -0.9226331588
H   -1.4362749462  -5.9356767577  -1.0400943755
*