! 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   2.4974529045  -3.4557480986  -0.3776095701
Cl   0.8375309401   1.4389936441   1.0977546127
Cl   5.8058327613   0.7377979723  -0.7776830884
O    0.5402543329  -1.4211185749   0.6070846959
O   -3.0822790557  -0.4577574170  -1.8927903441
N   -2.3244150188  -0.4633455973   0.2469290593
N   -3.3466172643   1.4401808766  -0.6735715308
N   -3.2819057182   3.6277218881  -0.4291627352
C   -2.4362295537   0.0127719070   1.6265298375
C   -1.7628791603  -1.7968985600   0.0644881998
C   -3.5935776692  -0.6218244019   2.3859791144
C   -0.3456072748  -1.7928223526  -0.4602216213
C   -2.9125570730   0.0926324735  -0.8208639477
C   -4.9670775836  -0.2665562168   1.8397666770
C    1.7509469064  -0.9463685894   0.2614015709
C   -4.5886659353   1.9061797961  -1.0318838774
C   -2.6003584987   2.5246937289  -0.3300182878
C    2.7707409741  -1.7613181766  -0.2278026557
C    2.0426720035   0.4058729672   0.4331888322
C   -4.5301695787   3.2514731857  -0.8553448832
C    4.0184724283  -1.2575058092  -0.5538308059
C    3.2830787801   0.9380011100   0.1276776125
C    4.2559271705   0.0944164751  -0.3782831794
H   -1.4948299976  -0.2122564448   2.1246255474
H   -2.5393872394   1.0946550396   1.6505669873
H   -2.3775923346  -2.3750875941  -0.6232698628
H   -1.7997104021  -2.3235178942   1.0178809820
H   -3.5107041935  -0.2828930919   3.4210654202
H   -3.4734427660  -1.7080056817   2.4145777795
H   -0.1086091760  -2.7971525170  -0.8145856070
H   -0.2370174269  -1.1028985684  -1.3006797948
H   -5.1177091877   0.8138327802   1.8025041935
H   -5.1310020133  -0.6638126879   0.8365006435
H   -5.7499333841  -0.6839268895   2.4733748428
H   -5.3844808392   1.2536665506  -1.3483009681
H   -1.5589343325   2.4502478924  -0.0604758155
H   -5.3187532497   3.9698212866  -1.0106933347
H    4.7899174706  -1.9130126119  -0.9320239910
H    3.4787411931   1.9904678853   0.2767564406
*