! 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 4
end
%cpcm
    smd    true
    smdsolvent "WATER"
end
*xyz 0 1
Br  -3.4648517109  -0.8138884900  -0.0720290065
Cl   1.6027249247   1.2165829429   2.2187143856
Cl   4.9649486026   3.3192196532  -1.3419964748
O   -0.4188279217  -0.5715351475  -1.4454248704
N   -0.3942035712  -2.4167399148   0.7634286448
N   -0.9739125311  -2.4586338957   1.9675587228
N   -1.8646807561  -4.0102095453   0.6135482473
C    0.1550101670  -0.1869497519  -0.2134080162
C   -0.9773393910   0.5752116254   0.5357776112
C   -2.1436300034   0.5949518734  -0.4450996899
C    0.6516331236  -1.4771519364   0.4518491083
C   -1.4486915709   0.3407825264  -1.7627518222
C    1.3741681507   0.7031146176  -0.4605729514
C    2.0719937995   1.3605889582   0.5528061072
C    1.8572808823   0.8678564833  -1.7562178866
C    3.1746825464   2.1611535178   0.2969722989
C    2.9516712325   1.6652147660  -2.0453854876
C   -0.9441713907  -3.3355880690  -0.0299575736
C    3.6016943151   2.3112619809  -1.0099928603
C   -1.8470065625  -3.4204411425   1.8222844483
H   -0.6930600539   1.6102314675   0.7239824413
H   -1.2215842844   0.1338883095   1.4991700634
H   -2.6912200467   1.5349690593  -0.4290404388
H    1.1823351486  -1.2625450629   1.3750104038
H    1.3587536798  -1.9657936491  -0.2191778943
H   -2.0708649116  -0.0837275047  -2.5483596898
H   -1.0417180484   1.2933362029  -2.1294286875
H    1.3660715983   0.3641495796  -2.5758809615
H    3.6873382438   2.6586605792   1.1080959580
H    3.2864593718   1.7733909128  -3.0672543630
H   -0.6296232673  -3.4954424145  -1.0483310867
H   -2.4928874673  -3.7196668486   2.6325975295
*