! 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  -3.0781422825  -2.6543852468   1.6315278715
Cl  -5.5019667651  -1.0708849928   1.6068915150
F    5.3848139184   0.9037794421  -2.0948492465
F    6.5083761848   0.7508783139  -0.2316170035
O    2.4990185908   2.1384059048  -0.0671190930
N    0.7574613582   0.6753389446  -0.1654466308
N    3.8349820821  -2.1563329809   0.1984174026
N    4.8632756968  -1.3905970764  -0.1404985673
C   -2.0207451320  -0.5043938507  -0.5707019538
C   -3.9188572668   0.7481664447  -0.5865747390
C   -2.4769821937  -0.5632698324  -2.0530977469
C   -3.7695842911   0.2933325829  -2.0641116751
C   -3.3704330680  -0.4757153840   0.1025905674
C   -1.6081631674   0.9278807189  -0.3063456740
C   -2.7735551837   1.6931563294  -0.3149663341
C   -0.3599820647   1.5160161393  -0.1474320779
C   -2.7368046806   3.0626974305  -0.1526212075
C   -3.9088191316  -1.2880960304   0.9879702570
C   -0.3172822759   2.9040218745   0.0415463143
C   -1.4886522827   3.6489708698   0.0373011351
C    2.0750686086   0.9920881305  -0.0958391113
C    2.9799710818  -0.1643979947  -0.0588027939
C    4.3707402823  -0.1795242209  -0.2930918128
C    2.6877247987  -1.4768352669   0.2622847825
C    5.2584413926   0.9312569520  -0.7339203574
C    4.0141092650  -3.5661017397   0.4762189015
H   -1.3363082083  -1.2960037421  -0.2728378319
H   -4.9085638809   1.0968147312  -0.3051979178
H   -2.6849782875  -1.5945200937  -2.3380429838
H   -1.7050505662  -0.1846166017  -2.7220170629
H   -3.7107670580   1.1473495959  -2.7377873470
H   -4.6329236745  -0.3025348475  -2.3597714662
H   -3.6384270231   3.6607812770  -0.1632538130
H    0.6192748831   3.4131740520   0.1941091117
H   -1.4176180232   4.7180447163   0.1888057806
H    0.5434178944  -0.3008621929  -0.2892460601
H    1.7700256744  -1.9622685408   0.5550121807
H    4.9036569467   1.9161359572  -0.4432763639
H    5.0621970597  -3.8128360608   0.3470682617
H    3.4192009693  -4.1631849939  -0.2103320516
H    3.7174175243  -3.7895299972   1.4979448374
*