! 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   2.9588933539  -1.9226002473   0.1388585500
Cl   3.8884735745   1.0835081402  -0.0672808020
O   -2.9814443585   1.5830557739   0.1024551974
N   -1.8349451734  -0.3806719131   0.0015279376
C   -0.5070959636   0.0413556163  -0.0159747757
C    0.4589217556  -0.9623168890   0.0605356026
C   -0.0941527760   1.3703711446  -0.1125746414
C   -2.9693547764   0.3640494614   0.0274371490
C    1.8044777775  -0.6496941795   0.0439862373
C    1.2576814399   1.6695780501  -0.1268201069
C    2.2166892064   0.6743901888  -0.0482213361
C   -4.2430926804  -0.4141139438  -0.0252233503
C   -5.3925391968   0.1904699062   0.7169457698
C   -4.3456986021  -1.5246659021  -0.7530845562
H   -1.9616070518  -1.3813381687   0.0361829904
H    0.1578577614  -1.9996339383   0.1334711238
H   -0.8012961709   2.1790063907  -0.1779053380
H    1.5655883556   2.7032826116  -0.2024232277
H   -5.6385524899   1.1800894340   0.3307477134
H   -6.2793067761  -0.4346819324   0.6309667429
H   -5.1610341341   0.3089325907   1.7769168975
H   -5.2843590103  -2.0590798306  -0.8201975787
H   -3.5251284354  -1.9365167002  -1.3265345783
*
