! 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  -0.7285874017  -1.9869825369  -2.2119731503
Cl  -4.4438298744  -2.0353993966   1.6450525659
O    3.1694849416  -0.3693372869  -0.0126531518
N    1.9716288525  -0.8514562555   0.4108553319
N    3.0179361014   3.7426576124  -0.5238374271
C    1.1036128659   0.6108755604  -1.3795013874
C    0.9905768115  -0.3967696446  -0.2636809073
C   -0.3455484939  -0.8281179516   0.2004457989
C    1.4227927688   1.9726215703  -0.8194558577
C   -1.2272724131  -1.5253275608  -0.6216282916
C   -0.7657234809  -0.5298629678   1.4938792286
C    0.4804362070   2.7002049116  -0.1018070686
C    2.6753564102   2.5492763298  -0.9934764139
C   -2.4887493421  -1.9021188780  -0.1936607292
C   -2.0204633159  -0.8952063433   1.9516255282
C   -2.8721909780  -1.5744543366   1.0968480054
C    0.8263409489   3.9439226248   0.4008675200
C    2.1049806941   4.4206567821   0.1634617145
C    4.2162967213  -0.8563883674   0.8073074697
H    1.8715337520   0.3085721942  -2.0934091305
H    0.1628814854   0.6604982204  -1.9267477809
H   -0.1010744647   0.0112723882   2.1535022987
H   -0.5170901764   2.3079186836   0.0570182332
H    3.4360476079   2.0185753882  -1.5548500618
H   -3.1517896455  -2.4494287245  -0.8489978297
H   -2.3252729868  -0.6478169367   2.9585593585
H    0.1173957775   4.5375644265   0.9609388724
H    2.4043075161   5.3907049499   0.5421546294
H    4.0996217598  -0.5365579253   1.8445311097
H    5.1346600980  -0.4305899212   0.4087309576
H    4.2864388922  -1.9454088402   0.7724378475
*