! 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  -1.8390925663  -0.4991168048  -2.2367802927
Cl  -4.6750977139   3.3850669059   0.0818762634
F    4.0506615741   1.3731237492  -0.7063783802
F    4.0700059167   0.8983971004   1.3990829200
F    4.6456749981  -1.2604173924  -1.3055295426
F    4.6932395319  -1.7125722885   0.8321070330
O    2.6004769895  -0.1361282007   0.0711298622
N   -0.9269288918  -2.1652800007   0.8134645653
N   -2.1957659535  -1.9044898478   1.1304377410
N   -2.0479272553  -3.8481314190   0.0289542572
C    0.2326714104  -0.1242088345   0.0509640650
C    0.1387138674  -1.2366897056   1.1026293750
C    1.4744081177   0.7310494560   0.2675374463
C   -1.0040596518   0.7391539236   0.0405502198
C   -1.9794140332   0.6522688059  -0.9498806122
C   -1.2297781909   1.6571652523   1.0639578980
C    3.8311118376   0.3636882951   0.1739216010
C   -3.1084176208   1.4574856037  -0.9496268119
C   -2.3464989263   2.4732401174   1.0964301323
C   -0.8534628140  -3.3229867726   0.1523881787
C   -3.2769255516   2.3687986724   0.0768496761
C    4.8658347637  -0.7315605988  -0.0816419571
C   -2.8307713237  -2.9394008284   0.6425734946
H    0.3464018161  -0.5978223247  -0.9261495746
H    1.0658678540  -1.8074305665   1.1311557983
H   -0.0248271417  -0.8249143908   2.0988556286
H    1.4885105355   1.5456236823  -0.4587390558
H    1.5036874796   1.1583268421   1.2721462818
H   -0.5184267869   1.7454654038   1.8754062842
H   -3.8443646225   1.3691452176  -1.7366068159
H   -2.4839962376   3.1759047807   1.9063150873
H    0.0765757217  -3.7364401465  -0.2060499001
H    5.8878280094  -0.3534642891  -0.0249629552
H   -3.9000566899  -3.0472315528   0.7386089565
*