! 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   0.8344516694   0.6806680759  -2.2648940205
Cl  -2.8340933662   3.6610861610   0.1529036667
O    0.9827913774  -1.5105653204   1.7966878805
N   -0.7948974941  -2.6146815262  -0.0441465812
N   -0.9957732145  -3.6011532991   0.8328581471
N   -2.9551069949  -2.7180564417   0.1866349889
C    1.0311539527  -1.0132231574   0.4788214144
C    2.4926474848  -0.7102442790   0.1069182708
C    0.5270542587  -2.1645667384  -0.4054547200
C    3.0545303725   0.5556606091   0.7436832293
C    0.0928070921   0.1952590401   0.3440622803
C    4.5472137570   0.7372378531   0.4853397450
C   -0.0618597618   0.9744749382  -0.8058063185
C   -0.7205023487   0.5382503010   1.4240329742
C    4.8964304212   0.9134753267  -0.9857214441
C   -0.9541675367   2.0348821015  -0.8736995986
C   -1.6163323854   1.5929964883   1.3899412661
C   -1.9682630604  -2.0961331286  -0.4100000522
C   -1.7254658215   2.3390517257   0.2322706176
C   -2.2985063454  -3.6260135299   0.9329517578
H    2.6093562238  -0.6660837402  -0.9737707671
H    3.0795635114  -1.5745454349   0.4334985994
H    1.2038420170  -3.0135543607  -0.3205915076
H    0.5128509230  -1.8688523295  -1.4522343523
H    2.5200037571   1.4336550611   0.3693171427
H    2.8913007837   0.5417741724   1.8267170614
H    5.0942669229  -0.1174703128   0.8940466621
H    4.8913408451   1.6121874790   1.0419699980
H    1.4701329357  -0.9115831588   2.3746308073
H   -0.6622999156  -0.0403479767   2.3335560687
H    5.9553724030   1.1417095935  -1.1123349882
H    4.6905832522   0.0158292047  -1.5701274267
H    4.3272303280   1.7320275344  -1.4311420090
H   -1.0420578036   2.6125539911  -1.7831473894
H   -2.2194678577   1.8180093938   2.2581794630
H   -2.0620090842  -1.2917653692  -1.1227069095
H   -2.8006754917  -4.3373099521   1.5696592862
*