! 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  -0.2856221365   1.1919344162   1.7221962251
Cl   4.0878632279   2.3012222768   1.8676451359
Cl  -1.3322297506   4.0996707822  -2.6620833650
S    0.4341524085  -2.7072390921  -1.5118869081
N   -2.0384407288  -3.2265452499   1.5245712625
N   -1.1358580861  -1.0895964785   0.1168769318
N   -3.2105228902  -3.7510049010   1.1532498863
N   -3.4630870501  -2.4549977193   2.9692958329
C   -0.8597571975  -3.3793836620   0.7238199355
C    1.3327802923  -1.2526181157  -2.1166990494
C   -0.6240565053  -2.1966964909  -0.1955267369
C    1.9859852114  -0.3924248025  -1.0748352612
C    2.0754164971   0.9765553022  -1.3034945225
C    2.5544198121  -0.9141572752   0.0819144673
C   -1.1204616728   0.0946585268  -0.5914053840
C    2.7208987609   1.8126284072  -0.4071392016
C    3.2038296890  -0.0923130486   0.9892312358
C   -2.2105291826  -2.4427775380   2.5881710052
C   -0.8069318660   1.2775301646   0.0835088567
C   -1.5283441231   0.1906522642  -1.9205166631
C    3.2813443069   1.2668864025   0.7352803871
C   -0.8649922936   2.5083987581  -0.5422104573
C   -1.5981671659   1.4148079452  -2.5642303704
C   -1.2610151532   2.5641482517  -1.8688501349
C   -4.0238227114  -3.2669032201   2.0527146462
H   -0.9453290893  -4.3092580587   0.1630381853
H    0.0101310976  -3.4823974095   1.3746355727
H    0.6971477187  -0.6602442658  -2.7721424095
H    2.0937467342  -1.7112543270  -2.7541047712
H    1.6339134030   1.4047532960  -2.1950158152
H    2.5000112283  -1.9756112377   0.2886464514
H    2.7766451545   2.8753854855  -0.5984011424
H    3.6408946389  -0.5129903841   1.8842493070
H   -1.4038471886  -1.9019693364   3.0557831631
H   -1.8111013630  -0.7063381718  -2.4566435377
H   -0.5955079103   3.4066550321  -0.0048367653
H   -1.9148977570   1.4632955736  -3.5965495954
H   -5.0730059064  -3.5165287079   2.0539368796
*