! 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  -5.0387003791   1.5270734644  -0.3068928197
F   -0.1330839417  -1.5118864772   1.5863868709
F   -2.1588608424  -2.1894157937   1.7894521121
F   -0.9658285551  -2.8673889573   0.1400218922
O    2.6588068816   1.6704758366   0.4355829562
N    2.6585013771  -0.6800330617  -1.1402929789
N    0.3968531353  -0.6195426040  -1.0745848913
N    4.7707549532  -1.1140071059  -1.6047660195
C    1.4739668409   0.0250216889  -0.9129618930
C    1.6170027576   1.4672405888  -0.4710591181
C    2.4863419048   1.0719922185   1.7170108526
C   -0.8568261088  -0.0619771419  -0.8664715607
C    2.6139068237   2.1127660968   2.8092321277
C   -1.7182451392  -0.6375975452   0.0763758646
C   -1.3253377411   0.9953765436  -1.6419802384
C   -3.0006399948  -0.1407026052   0.2531400382
C    2.7818906272  -2.0552818666  -1.1556050141
C    1.5004992532   3.1478929033   2.7873602406
C    3.8972964006  -0.1727887921  -1.4188069913
C   -1.2456272452  -1.7996114496   0.8959437263
C   -2.6076782876   1.4875599774  -1.4770210776
C   -3.4355455704   0.9183141326  -0.5253942912
C    4.0843932619  -2.2948335542  -1.4349174796
H    0.6557432739   1.8000426363  -0.0651506153
H    1.8183286689   2.0868462234  -1.3488991929
H    3.2447295069   0.2943943208   1.8433141927
H    1.5091625531   0.5827251107   1.7930643203
H    2.6097768716   1.5833393014   3.7649407974
H    3.5892706381   2.6004024512   2.7349490350
H   -0.6833913154   1.4291780384  -2.3973755668
H   -3.6667568094  -0.5707928292   0.9872554988
H    1.9526197703  -2.7085357499  -0.9497873346
H    1.6173945720   3.8663204606   3.5989110366
H    1.4886672760   3.7130807547   1.8547769518
H    0.5221517516   2.6779507912   2.9043182614
H    4.0978311884   0.8817456864  -1.5030985343
H   -2.9501180744   2.3101108348  -2.0890595435
H    4.5732935284  -3.2518495811  -1.5174818999
*