! 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   0.6100373348  -1.3174114636   2.5125300028
Cl   4.3708921106  -1.4675223835  -1.2574551144
O   -2.0059790762   0.3146346216  -0.7812716739
O   -1.9571316775  -0.9768355506   1.0392515597
N   -0.3829370451   2.2902624178   0.6888911470
N    0.8946612901   2.4233721661   1.0595874950
N    0.4532912955   3.7222157081  -0.7161594276
C   -1.2584887861   0.0254358322   0.3690126522
C   -2.9055744454  -0.7652751731  -1.0507948689
C   -2.5290138302  -1.7835424300   0.0236795339
C   -1.2275504910   1.2731734903   1.2605479153
C    0.1525032290  -0.4094462888  -0.0264277975
C   -4.3391857577  -0.2691925382  -0.9725003268
C   -5.3405615045  -1.3250178106  -1.4141026353
C    1.0468089078  -0.9922805923   0.8687684515
C    0.6159952354  -0.1567935027  -1.3135390977
C    2.3403758413  -1.3265780194   0.4995410201
C    1.9044655459  -0.4733348778  -1.7095524245
C   -0.6234141031   3.0572279225  -0.3770793896
C    2.7567975096  -1.0603096615  -0.7928769390
C    1.3475213009   3.2909181053   0.1944187368
H   -2.7009590935  -1.1564155993  -2.0519026745
H   -3.3795408221  -2.3186167456   0.4438360614
H   -1.8086963807  -2.5194071063  -0.3484763436
H   -0.8440978714   1.0379982175   2.2499613561
H   -2.2401325286   1.6601266792   1.3733201529
H   -4.4384057437   0.6118148987  -1.6112351460
H   -4.5580714319   0.0546303965   0.0493309493
H   -5.1633562343  -1.6363845523  -2.4448657614
H   -5.3005189128  -2.2182084368  -0.7883702498
H   -6.3579784242  -0.9387743193  -1.3580186420
H   -0.0426509130   0.3039403567  -2.0353056220
H    3.0119178618  -1.7820071962   1.2138615580
H    2.2301041427  -0.2625765506  -2.7183636118
H   -1.5878077963   3.1162156896  -0.8549147171
H    2.3692374877   3.6351531266   0.2255090729
*