! 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  -2.2452317280   0.5929397826  -2.5794161277
Cl  -2.2376934566   5.0137300464   0.4228168325
F    2.8971292948  -1.9504873939   0.2660421014
F    3.2056407767  -0.6683919747  -1.4439047294
F    3.1292509924   0.2314124337   1.9463509425
F    3.4916703945   1.5051567812   0.2086520296
O    1.4528818968  -0.2912551527  -0.1149875971
N   -0.8685648510  -3.0205614499   0.8746144980
N   -1.9129759391  -3.6669613399   0.3528006099
N   -0.2090334540  -5.0843606582   0.7027626501
C   -0.8631512823  -0.8248803785  -0.2303057218
C   -0.9019265493  -1.5932687309   1.0939008771
C    0.4814588934  -0.9597570862  -0.9316205448
C   -1.2283659275   0.6285120981  -0.0573078410
C   -1.8475007491   1.3551134817  -1.0734739391
C   -0.9242166871   1.3212134106   1.1119867863
C    2.7260819251  -0.6742030693  -0.1756769851
C   -2.1653088075   2.6976918181  -0.9416515327
C   -1.2289706773   2.6616479006   1.2774208468
C    0.1369610520  -3.8735730454   1.0675940884
C   -1.8493564039   3.3393337453   0.2427346481
C    3.5986034473   0.2429476817   0.6791426772
C   -1.4693257558  -4.8943807030   0.2738849363
H   -1.5969769599  -1.2923525580  -0.8910437250
H   -0.0619507114  -1.3489099390   1.7422543990
H   -1.8132790251  -1.3555876047   1.6408554116
H    0.7328550781  -2.0127408161  -1.0790433895
H    0.4487063112  -0.4880885608  -1.9147339254
H   -0.4376585374   0.8110271986   1.9317937847
H   -2.6483866360   3.2290648004  -1.7496350446
H   -0.9784847266   3.1649020631   2.2004906197
H    1.0832666456  -3.5811268505   1.4936812656
H    4.6451298901  -0.0634626404   0.6721535572
H   -2.0862722859  -5.6912979722  -0.1104907358
*
