! 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  -5.0265608440   1.5731614446  -0.3717017493
F   -0.0363475831  -1.1601199482   1.6404523605
F   -2.0287287085  -1.8564226542   2.0370872822
F   -0.8758930303  -2.7507020616   0.4622032400
O    2.3459749565   0.7907100563   1.0116823377
N    2.5743887324  -0.9245495297  -1.1762231511
N    0.3110695510  -0.7739869034  -1.2654865559
N    4.7190212185  -1.3133580749  -1.5197042967
C    1.3925427354  -0.2456836706  -0.8767387882
C    1.5439691427   1.0427792601  -0.1127730123
C    2.1141545604   1.6676357480   2.0999093638
C   -0.9251073073  -0.1875652835  -1.0080929360
C    2.5336143154   3.1047585566   1.8465167426
C   -1.7047296056  -0.5796682124   0.0861863393
C   -1.4428834648   0.7478746959  -1.8991603058
C   -2.9660622926  -0.0331406514   0.2810677984
C    2.6719308867  -2.2351147068  -1.5991845062
C    2.3616477110   3.9431026698   3.1050158985
C    3.8478659904  -0.4260806125  -1.1515159803
C   -1.1656285487  -1.5871666303   1.0546539437
C   -2.7000432341   1.2924157972  -1.7104938462
C   -3.4542809817   0.8977660269  -0.6183637635
C    3.9936116529  -2.4496287743  -1.7978355650
H    0.5499476422   1.4042684688   0.1697184532
H    1.9749871668   1.8041683458  -0.7761583683
H    2.6889148587   1.2549623451   2.9317515113
H    1.0548190567   1.6346172354   2.3892697111
H    3.5775081466   3.1283443900   1.5224001327
H    1.9388966147   3.5387859182   1.0376434853
H   -0.8536095975   1.0478114915  -2.7551086191
H   -3.5711761533  -0.3232565622   1.1281427223
H    1.8137577664  -2.8753820835  -1.6994971780
H    2.6321840026   4.9832804833   2.9238790513
H    1.3275460144   3.9294609833   3.4557263233
H    2.9910305880   3.5752676585   3.9176680627
H    4.0780530502   0.5892430482  -0.8755635469
H   -3.0806791713   2.0201254262  -2.4136715187
H    4.4694637954  -3.3616603805  -2.1199452546
*