! 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  -4.4211785282   1.9982399344   0.8728550696
F   -0.7708073498  -2.6960540242  -0.1529853031
F   -2.2519570423  -1.9869704698  -1.5356269216
F   -0.1972156873  -1.4261702689  -1.7864574995
O    1.1013655796   1.2800948191  -1.2771745729
N    2.9775939604  -1.3171460788   0.5168657574
N    0.8677621252  -0.6016158519   0.9265639672
N    4.1673205752  -2.8233647019   1.6066491980
C    1.8868489646  -0.4951312346   0.1945134445
C    2.1234376290   0.3800075476  -1.0142597215
C    1.2974297475   2.5895143476  -0.7629861699
C   -0.3446474740   0.0562164589   0.8098162562
C    0.4555132833   3.5678445124  -1.5534224728
C   -1.3802552622  -0.4298081665  -0.0002032253
C   -0.6202557347   1.1172946693   1.6716571053
C   -2.6315811063   0.1719157005   0.0217950068
C    4.1751504471  -1.4425283676  -0.1620270545
C   -1.0443001887   3.3417710783  -1.4416326524
C    3.0407380849  -2.1812442893   1.5743109867
C   -1.1526464476  -1.6284964711  -0.8665323480
C   -1.8650586272   1.7155320039   1.6975666430
C   -2.8635687878   1.2432843593   0.8633570451
C    4.8834460563  -2.3709329922   0.5234617308
H    2.2453478516  -0.2790665232  -1.8800905636
H    3.0847220031   0.8904475720  -0.8780049854
H    2.3546215219   2.8673974434  -0.8467924225
H    1.0362175757   2.6306043832   0.3014459026
H    0.7022498036   4.5684767548  -1.1900366794
H    0.7670033348   3.5389040326  -2.6012210761
H    0.1538933351   1.4699974430   2.3395282717
H   -3.4305484298  -0.1903140021  -0.6095585128
H    4.4185907619  -0.8869305715  -1.0502765044
H   -1.3860144035   3.4695011190  -0.4146182576
H   -1.5896510183   4.0556496372  -2.0598815153
H   -1.3333668332   2.3408241794  -1.7622116457
H    2.2332734052  -2.2858181605   2.2786862684
H   -2.0489035130   2.5438505938   2.3679264495
H    5.8709507438  -2.7397586323   0.2987714118
*