! 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  -2.2000918283   0.5247259321  -2.6372916591
Cl  -2.2716236642   5.0326690435   0.2300688917
F    3.0496306420  -1.9341958257  -0.0725707975
F    3.1327759005  -0.2750302759  -1.4521248561
F    3.2046124786  -0.1899083186   2.0534303515
F    3.3126084963   1.4858520389   0.6561509492
O    1.4418996805  -0.3863675398   0.0008079505
N   -0.8441894543  -2.9796396639   0.9685266108
N   -1.8495204534  -3.7098211778   0.4831205535
N   -0.0453634852  -4.9963877081   0.8338924090
C   -0.8802800259  -0.8227922738  -0.2143571076
C   -0.9586991840  -1.5495778857   1.1317080999
C    0.4802054979  -0.9833584659  -0.8781329665
C   -1.2436221488   0.6368794431  -0.0933611376
C   -1.8393155869   1.3319011705  -1.1455034020
C   -0.9642169611   1.3668498501   1.0592072386
C    2.7380116548  -0.6165637468  -0.2005755852
C   -2.1608332662   2.6773459982  -1.0625575653
C   -1.2737373938   2.7114385222   1.1762977619
C    0.2208539808  -3.7560315868   1.1632369593
C   -1.8731879697   3.3554118128   0.1086210910
C    3.5771044935   0.1694286211   0.8050380442
C   -1.3237086205  -4.9056542049   0.4279600526
H   -1.5986909372  -1.3070601803  -0.8799077474
H   -0.1705287373  -1.2445099298   1.8171973631
H   -1.9098585945  -1.3389570434   1.6171014917
H    0.7026720229  -2.0385242753  -1.0516215871
H    0.4911670344  -0.4793996552  -1.8458638088
H   -0.4957555942   0.8847864953   1.9057641630
H   -2.6261462435   3.1828331276  -1.8971399246
H   -1.0436954363   3.2431864540   2.0886598482
H    1.1522539186  -3.3867785352   1.5611938604
H    4.6450801052  -0.0066436551   0.6756439556
H   -1.8907099888  -5.7531495177   0.0776838058
*
