! 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  -0.0638646421  -1.9289012712  -2.2274181884
Cl  -4.3905786685  -1.0868948393   0.8097198916
O    3.5996967457  -1.1431186596   0.6092137964
N    2.2627300817  -1.3625526996   0.7635515512
N   -0.4215081717   3.3567987337  -0.8142639435
C    1.9876230086   0.4666152936  -0.9073101774
C    1.5316098096  -0.6186736204   0.0341441018
C    0.0698773166  -0.7855900580   0.2228645510
C    1.3583898842   1.7741560019  -0.5150575532
C   -0.7530557664  -1.3267204210  -0.7594405650
C   -0.5288250364  -0.3441807101   1.3991396219
C    1.8712754364   2.5408851107   0.5238330901
C    0.2071858457   2.2350143329  -1.1422678084
C   -2.1248829371  -1.4263805901  -0.5938272865
C   -1.8961430437  -0.4325458756   1.5954757514
C   -2.6814312721  -0.9713255610   0.5896536863
C    1.2279853126   3.7158604422   0.8755789646
C    0.0860442318   4.0785090592   0.1792506378
C    4.3332194486  -1.9757717635   1.4893733066
H    3.0722935494   0.5531290281  -0.9061739233
H    1.6949635884   0.2059185060  -1.9263089019
H    0.0888938315   0.0891674988   2.1745567051
H    2.7642728913   2.2232338397   1.0489783068
H   -0.2247599201   1.6664494283  -1.9599765887
H   -2.7432156585  -1.8561331296  -1.3695484722
H   -2.3386208409  -0.0803768978   2.5165627099
H    1.6017578613   4.3413497789   1.6744272302
H   -0.4400711737   4.9911809512   0.4320381667
H    5.3824958746  -1.7390969421   1.3245876780
H    4.1727503983  -3.0342914890   1.2767973386
H    4.0864237939  -1.7779515881   2.5343232636
*