! 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  -5.0495151668   1.6123442379  -0.1666458141
F   -2.5066942666  -2.5520727578   1.4938431153
F   -1.1513213801  -3.0098262734  -0.1056425665
F   -0.4644132211  -1.8965517769   1.6010495794
O    2.2351309665   1.6752443192   0.5301907937
N    2.5657019770  -0.9476452691  -0.6195027188
N    0.3306690761  -0.6749184497  -0.9410355115
N    3.9738805432  -2.2555482380  -1.7055233816
C    1.3529349212  -0.3497172115  -0.2716294220
C    1.4005700806   0.6084151012   0.8875469749
C    2.4783653557   2.5539213881   1.6148168008
C   -0.9186453494  -0.1124736173  -0.6962908300
C    3.4440049392   3.6345207851   1.1834013939
C   -1.8706701336  -0.7751084137   0.0866407034
C   -1.2692868863   1.0881997460  -1.3068219592
C   -3.1407617110  -0.2398922485   0.2509369257
C    3.7926669765  -0.8105462269   0.0034275639
C    2.9344836574   4.4959769690   0.0377921616
C    2.7491214948  -1.8358820389  -1.6446626844
C   -1.5038490425  -2.0586910611   0.7648877266
C   -2.5338734980   1.6247875196  -1.1458729651
C   -3.4629520792   0.9544688571  -0.3680140098
C    4.6348426818  -1.6210238565  -0.6783416722
H    1.7727226795   0.0762720434   1.7742011767
H    0.3881985517   0.9502361075   1.1267129105
H    2.8939046585   1.9951352381   2.4634431736
H    1.5349430937   3.0020003221   1.9551192182
H    3.6317294630   4.2592389090   2.0597851809
H    4.4036959562   3.1820501532   0.9198012616
H   -0.5442171060   1.6027231590  -1.9227470001
H   -3.8797872421  -0.7425042587   0.8585000465
H    3.9638693316  -0.1740380700   0.8523906618
H    2.8070906484   3.9217363818  -0.8796939342
H    1.9723694171   4.9503088162   0.2820413108
H    3.6329374655   5.3044804866  -0.1789251474
H    1.9475921068  -2.1276908603  -2.3018783365
H   -2.7862280545   2.5598688713  -1.6264407730
H    5.6831938119  -1.7846415101  -0.4892416175
*