! 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   1.1678997662   0.3483989739  -2.2231193156
Cl   4.0835065709  -3.7045193412  -0.3670668482
O   -1.2723887406   0.3202319705  -0.5511757377
O   -1.1385703054  -0.1161268006   1.6326085396
N   -0.8449503386   2.6610758769   0.9158442785
N   -1.4688611259   2.8980672312   2.0726790781
N   -2.3647568389   4.1351846946   0.4266724400
C   -0.3862914646   0.2758350077   0.5167066028
C   -2.2129366173  -0.7249799702  -0.3442214342
C   -2.3112575094  -0.7786121770   1.1810831421
C    0.1873164568   1.6689819585   0.7803886279
C    0.7498179157  -0.7171356768   0.2648009673
C   -3.5131524992  -0.4305873012  -1.0659577987
C   -4.0809158303   0.9596005523  -0.8206095859
C    1.4795154085  -0.7532445034  -0.9231499574
C    1.1036446299  -1.6284129598   1.2549671237
C    2.5034462337  -1.6663757509  -1.1258843339
C    2.1216791611  -2.5506774479   1.0808706244
C   -1.3997258589   3.3904170437  -0.0523964406
C    2.8120424938  -2.5620826707  -0.1174322119
C   -2.3642819976   3.7850440348   1.7268654270
H   -1.8015720438  -1.6701736412  -0.7209284434
H   -3.1865639947  -0.2491500955   1.5675095026
H   -2.3423900686  -1.8066808322   1.5482605402
H    0.8464412536   1.9747219081  -0.0299168093
H    0.7838245726   1.6514622429   1.6908842634
H   -4.2297153163  -1.1942217080  -0.7511394440
H   -3.3688370624  -0.5830854041  -2.1379286894
H   -4.1640141060   1.1993372098   0.2421368350
H   -3.4676442448   1.7328519821  -1.2821317821
H   -5.0818064332   1.0373392628  -1.2475886626
H    0.5705733912  -1.6266993836   2.1946066826
H    3.0490319054  -1.6751143311  -2.0590060327
H    2.3649936958  -3.2466987618   1.8711079421
H   -1.0567051454   3.3649876416  -1.0743573157
H   -3.0441582529   4.2087347523   2.4493560789
*
