! 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  -5.2721598568   1.3656550186  -0.4508174503
F   -2.1941326815  -1.8785875153   2.1068609632
F   -0.9484909413  -2.7181013425   0.5747931266
F   -0.2200851749  -1.0978433197   1.7879291684
O    2.4037688808   1.8270886474   0.3252367101
N    2.5005715246  -0.6028667216  -1.1518999828
N    0.2379542581  -0.6473020438  -1.0427747995
N    4.6288898918  -0.9512459403  -1.6232300875
C    1.2881826573   0.0477633573  -0.9154904812
C    1.3514183038   1.5140438854  -0.5357922975
C    2.2716253507   1.2809922253   1.6272924045
C   -1.0338080289  -0.1190114886  -0.8647678891
C    3.4715973653   1.6871348953   2.4526687162
C   -1.8519149708  -0.5799943058   0.1742063114
C   -1.5602298866   0.7953067974  -1.7740581374
C   -3.1525994404  -0.1153382822   0.3042795266
C    2.6618834728  -1.9715541149  -1.2605620928
C    3.6135789436   3.1908751371   2.6348726268
C    3.7317320664  -0.0467506527  -1.3816372057
C   -1.3065773491  -1.5689662926   1.1580841051
C   -2.8586809853   1.2556575681  -1.6534339805
C   -3.6465400327   0.7971221998  -0.6118475295
C    3.9720206177  -2.1582143328  -1.5403137329
H    0.3839410782   1.7993856791  -0.1067985802
H    1.4842378219   2.1042467092  -1.4466320240
H    2.2132563262   0.1865793441   1.5873667434
H    1.3438793220   1.6407693453   2.0918096082
H    3.3686910469   1.2044386363   3.4270419296
H    4.3759455342   1.2721915687   1.9987467655
H   -0.9480388401   1.1402567207  -2.5969946013
H   -3.7860200558  -0.4569748666   1.1104319632
H    1.8487293847  -2.6599418413  -1.1144016629
H    2.7131177808   3.6222506572   3.0762648632
H    4.4469390200   3.4233522235   3.2981367727
H    3.7980718148   3.7020442219   1.6902532288
H    3.9101098785   1.0140471460  -1.3857345016
H   -3.2456618450   1.9665518580  -2.3700728984
H    4.4857373588  -3.0942041668  -1.6882670571
*