! 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   0.7132959450  -0.9201229105  -2.1247794152
Cl   5.6118567601  -0.6150684227  -0.0567987412
O   -1.0981388240  -0.5463136487   0.1460846677
O   -0.6100147981   0.8493309999   1.8050104480
N   -2.0814261261   1.9674855374  -0.4363834567
N   -2.7275866718   2.6659582722   0.5011658940
N   -4.1831246928   1.7481451634  -0.9413084821
C   -0.3008100814   0.5392854014   0.4796891440
C   -1.3747726082  -1.3043259671   1.3195545886
C   -0.9229798765  -0.3704550020   2.4547894522
C   -2.8424293623  -1.6812469062   1.3855319922
C   -0.6629589201   1.7412118267  -0.3970434191
C    1.1861681786   0.2207966368   0.3204355602
C   -3.2950378173  -2.7436098317   0.3876150386
C    1.7114815571  -0.4264719927  -0.7973380262
C    2.0844651506   0.6175256523   1.3062727521
C   -3.3118951219  -2.3178641514  -1.0741124053
C    3.0676487154  -0.6893278164  -0.9200590492
C    3.4432929395   0.3690956038   1.2105584673
C   -2.9607012017   1.4138120159  -1.2708923889
C    3.9218341025  -0.2903622919   0.0928058942
C   -3.9764754009   2.5086562620   0.1507272121
H   -0.7650504915  -2.2148317391   1.3163646507
H   -1.7078922878  -0.1769461259   3.1866347826
H   -0.0532711989  -0.7731814652   2.9813649650
H   -3.4507543450  -0.7751992750   1.2895238602
H   -3.0223622542  -2.0662107233   2.3933142895
H   -0.3169098050   1.5895514460  -1.4177532452
H   -0.1675187579   2.6337830648  -0.0191436663
H   -4.3029470782  -3.0580569883   0.6711077179
H   -2.6638732098  -3.6305082450   0.5044384111
H    1.7194516163   1.1392932848   2.1796475807
H   -3.9190693847  -1.4222558875  -1.2174831273
H   -2.3148892643  -2.1054001728  -1.4573749416
H   -3.7416749978  -3.1053506007  -1.6953368195
H    3.4477053268  -1.1967618144  -1.7956387488
H    4.1109677294   0.6884315044   1.9981958583
H   -2.6659247782   0.8032042714  -2.1087072092
H   -4.7787397249   2.9710063209   0.7040572800
*