! 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  -5.0676920623  -2.1055729888  -0.3328463585
O    1.6569323865  -1.5715376691  -0.5158990219
N    1.8525514409  -0.2054840784  -0.8823148523
N    0.4400596454   3.6425451213  -0.5997997025
C    2.1933745280   0.4565966939   0.3923407681
C    1.1583483550  -0.2006356727   1.3274776304
C    0.8472320679  -1.5468218684   0.6410674551
C    1.9256349788   1.9396339505   0.2289775044
C    3.6096404675   0.1601215563   0.8843962753
C   -0.6222830879  -1.7114462460   0.3438532555
C    2.8755777632  -0.1883997244  -1.9006697475
C    2.7588326275   2.9243936079   0.7409889407
C    0.7747149537   2.3713138019  -0.4315225338
C   -1.1968268003  -1.2890896647  -0.8505848550
C   -1.4438250299  -2.2700471307   1.3176425929
C    2.4170886943   4.2598397011   0.5783596018
C   -2.5622715360  -1.4108005424  -1.0635799823
C   -2.8107430236  -2.3953657112   1.1224821556
C    1.2530382634   4.5686967549  -0.0989827429
C   -3.3596248995  -1.9598762211  -0.0724800742
H    1.5627088390  -0.3383299252   2.3290964569
H    0.2593874543   0.4073697937   1.4200158635
H    1.1743814508  -2.3839315036   1.2623214853
H    3.7908381236  -0.9143226631   0.9135857655
H    3.7506987851   0.5333487332   1.8979511327
H    4.3761886625   0.6130808251   0.2548935143
H    3.8032196851  -0.6971060556  -1.6195058271
H    3.1069502071   0.8502672480  -2.1339597363
H    2.4925741154  -0.6489109953  -2.8109786373
H    3.6691461656   2.6722138786   1.2671023949
H    0.0888394579   1.6427177159  -0.8467937798
H   -0.5906238541  -0.8469992933  -1.6284926653
H   -1.0155223421  -2.6172599500   2.2503104512
H    3.0466066831   5.0461107065   0.9710574764
H   -2.9959824861  -1.0764856445  -1.9961021279
H   -3.4326104241  -2.8323871227   1.8914700206
H    0.9607772588   5.6015208391  -0.2453572130
*