! 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  -1.5293460137   0.7338986543  -2.9983224222
Cl  -4.9941344390   2.6659992370   0.5826573673
F    3.7407295188   1.4258960105   0.4604160264
F    3.7196555763  -0.2898537102   1.7666717215
F    4.7965029266  -1.8439290396  -0.2245226960
F    5.9659550557  -0.0606859941   0.2442545951
O    2.5005619419  -0.3468466896  -0.1043193528
N   -0.9500266592  -2.2330494888   0.1245138095
N   -0.5569506291  -2.5300119817   1.3668698669
N   -2.7800631798  -2.7724886643   1.1688994039
C    0.1987473986  -0.1580702590  -0.6181047332
C   -0.0609605598  -1.6575185133  -0.8544666699
C    1.2539527015   0.1095105839   0.4461532017
C   -1.0901332038   0.5640900425  -0.3211165314
C   -1.9415483839   0.9987030696  -1.3354481686
C   -1.5144624930   0.7804064478   0.9885756558
C    3.6354308667   0.0727480081   0.4631213034
C   -3.1399889140   1.6442582181  -1.0749575174
C   -2.7073330094   1.4175288799   1.2836148787
C   -2.2733797238  -2.3647989363   0.0314437831
C   -3.5086083296   1.8513804503   0.2424203905
C    4.8180824636  -0.4965098656  -0.3199588372
C   -1.6857953375  -2.8502061663   1.9470471545
H    0.6060852557   0.2301663887  -1.5545432254
H   -0.5221974433  -1.8035904559  -1.8296069314
H    0.8712302771  -2.2197190939  -0.8589078462
H    1.2960318836   1.1793125879   0.6548560093
H    1.0537995719  -0.4223012612   1.3769985055
H   -0.9055179696   0.4462961991   1.8178988535
H   -3.7700957949   1.9791919136  -1.8867841137
H   -3.0004013099   1.5696045996   2.3126941841
H   -2.8168843714  -2.1738403628  -0.8807200049
H    4.7902043634  -0.2018577213  -1.3690247918
H   -1.7198936151  -3.1635823087   2.9786323393
*
