! 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   0.4266509190   0.8588731789  -1.8929283324
Cl   4.4608770380  -2.2190237658  -0.3218771268
O   -1.9219731484   0.0414425557  -0.4498132997
O   -1.8701829866  -1.2671418290   1.3435100984
N   -0.5072544844   2.1040620893   1.0643087496
N    0.8033963477   2.3128821906   1.2176562107
N   -0.1027856850   3.9104599776  -0.0716519258
C   -1.1725736743  -0.2480644536   0.6839122884
C   -2.6208105444  -1.1359960331  -0.8533244823
C   -2.3824245544  -2.1015967254   0.3164606352
C   -1.1712498018   0.9580960592   1.6245099860
C    0.2490838344  -0.7130190783   0.3537731798
C   -4.0768110196  -0.8021397498  -1.1243053919
C   -4.8364864103  -0.2312924644   0.0631662818
C    1.0040578594  -0.2911080649  -0.7380074848
C    0.8599595319  -1.5964792666   1.2424372361
C    2.2953524238  -0.7560129418  -0.9532071205
C    2.1472771510  -2.0666227294   1.0587003002
C   -1.0260870528   3.0534134801   0.2853717711
C    2.8542999378  -1.6425849934  -0.0526715239
C    0.9939732166   3.4002481313   0.5187091944
H   -2.1677570680  -1.5311741026  -1.7676710069
H   -3.2901230244  -2.5828286756   0.6793873970
H   -1.6647236415  -2.8833433288   0.0506760496
H   -0.6794522790   0.7014544596   2.5614860538
H   -2.2024254767   1.2319577230   1.8493601216
H   -4.5589702575  -1.7200837966  -1.4703136408
H   -4.1259172820  -0.1043338997  -1.9641443296
H   -4.8689298734  -0.9209310726   0.9081970602
H   -4.4026514103   0.7059008490   0.4123838851
H   -5.8696503817  -0.0242193252  -0.2160721002
H    0.3147214125  -1.9360568931   2.1120768037
H    2.8551541822  -0.4197907423  -1.8146027976
H    2.5840042995  -2.7513096747   1.7717269439
H   -2.0713538812   3.0916941327   0.0237950241
H    1.9690981749   3.8552711186   0.4431580180
*