! 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   0.7756262882  -1.2049707599  -2.0935758496
Cl   5.2495584091  -0.7640200324   0.8072797302
O   -1.0663291456   1.4337120922   0.8950810454
N   -2.8381289834  -0.8071811573   0.4247755870
N   -4.7071328693  -0.8304907672  -0.7475407246
C   -0.6507402001   0.3053662665   0.1698717273
C   -1.4233600796  -0.9012128329   0.6950089083
C    0.8331607543   0.0436621019   0.3162362147
C    1.5616167341  -0.6345865221  -0.6557700719
C    1.5148761586   0.4452670226   1.4606044194
C   -3.7908032575  -0.2136975075   1.2051748083
C   -3.4362677872  -1.1394400535  -0.7398847161
C   -0.7084000288   2.6644626738   0.3017385686
C    2.9168286467  -0.8909844872  -0.5218481370
C    2.8679300001   0.2036922010   1.6269862168
C    3.5579298302  -0.4604670359   0.6266390765
C   -4.9381466344  -0.2477257996   0.4686277958
C   -1.5977598720   3.0964594746  -0.8208751000
C   -2.7668278049   2.5649417246  -1.1537239605
H   -0.8882128302   0.4318571668  -0.8943402410
H   -1.0449101616  -1.8122601869   0.2319080910
H   -1.2737740837  -1.0050708421   1.7698565055
H    0.9815402091   0.9677223675   2.2433263828
H   -3.5793440694   0.1559364291   2.1941544099
H   -2.8986428738  -1.6226267973  -1.5419404632
H   -0.7401931617   3.4160903800   1.0954718551
H    0.3310792662   2.6505629732  -0.0498954246
H    3.4571216097  -1.4153047648  -1.2976420903
H    3.3720190215   0.5316968416   2.5249988502
H   -5.9141929039   0.1122371759   0.7529649377
H   -1.2151400992   3.9419485873  -1.3842758080
H   -3.3374427306   2.9598540447  -1.9837054625
H   -3.2083910178   1.7349082201  -0.6172700229
*