! 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  -1.2141891866   0.5201246702  -2.8890075612
Cl  -3.5287593370   3.1990566197   1.1153209026
F    4.1957183616  -0.9860852291   0.1179824382
F    3.1085472439   0.0377302645  -1.4375325634
F    4.9862182858   1.5695079383  -0.2276416503
F    4.0364447285   1.2656170296   1.7144196454
O    2.1242695088  -0.2723644533   0.5504326164
N   -1.6050843870  -2.6431428009  -0.0637798228
N   -1.3235712828  -3.1152143661   1.1537270709
N   -3.4806461084  -2.5073259769   1.0281415957
C    0.2439543001  -1.1245126444  -0.7495157756
C   -0.5834023984  -2.3899881107  -1.0489243786
C    1.3801401456  -1.4527065691   0.2099992715
C   -0.6548934052  -0.0072779354  -0.2817112414
C   -1.3775282599   0.7744974459  -1.1807470711
C   -0.8725692148   0.2372084451   1.0726764486
C    3.2671454990  -0.0185854865  -0.0887442537
C   -2.2598277173   1.7624543134  -0.7712625679
C   -1.7498944922   1.2107475497   1.5162624159
C   -2.8834234349  -2.2685970356  -0.1136205681
C   -2.4346656396   1.9711277565   0.5846511241
C    3.8059839826   1.3306065325   0.3851016393
C   -2.4771317826  -3.0175126554   1.7645091914
H    0.6945316404  -0.8453026278  -1.7033949064
H   -1.0841480460  -2.2843384570  -2.0088723819
H    0.0624712320  -3.2642886256  -1.1235611643
H    1.0225159961  -1.8610439208   1.1535434371
H    2.0189578725  -2.2141042786  -0.2407125032
H   -0.3540419558  -0.3458795844   1.8209610014
H   -2.8002682212   2.3518016627  -1.4985194585
H   -1.8918297367   1.3694631018   2.5759303977
H   -3.3379971399  -1.8521207383  -0.9991012889
H    3.1126119749   2.1445371646   0.1727136533
H   -2.6024729351  -3.3375065857   2.7869659735
*