! 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  -2.2923053254  -0.8417803964  -2.5319361669
Cl   4.1507367184   3.0189267055   1.1939855443
Cl  -3.1778350535   3.7274402526   0.1411738276
S    1.5374373930  -3.2081146079  -0.1254245038
N   -1.9003082854  -1.9484030460   1.3219717302
N    0.0577861844  -1.1281861983  -0.7222871554
N   -2.7179233434  -2.4987462391   0.4215604129
N   -3.7829483213  -0.9027905781   1.5863837565
C   -0.5182804788  -2.3298585174   1.3950831702
C    2.6322391024  -2.2652468644  -1.2327610281
C    0.2368631408  -2.0590101878   0.1105144096
C    3.0453448602  -0.9503482567  -0.6416041241
C    2.7319234764   0.2408091087  -1.2857418686
C    3.7230092552  -0.8944598064   0.5729537497
C   -0.7457989581  -0.0260660139  -0.4776573498
C    3.0740466970   1.4662572337  -0.7334463050
C    4.0715406346   0.3204319899   1.1407729789
C   -2.5439294195  -0.9937916823   1.9977998889
C   -1.8518318966   0.2571215219  -1.2784977832
C   -0.3874469286   0.9075539398   0.4954781530
C    3.7361401133   1.4937478423   0.4819878182
C   -2.6095936633   1.4001960887  -1.0873949794
C   -1.1243459495   2.0609921715   0.6932750889
C   -2.2379828894   2.2933847186  -0.0971961065
C   -3.8271048768  -1.8361447348   0.6148963791
H   -0.4500905883  -3.3896977094   1.6459597658
H   -0.0461117483  -1.7886565276   2.2161850890
H    2.1472215782  -2.1367593958  -2.1986148402
H    3.4886494783  -2.9262433280  -1.3792016020
H    2.2012315509   0.2199817708  -2.2282342481
H    3.9770049277  -1.8080714986   1.0960858371
H    2.8133640906   2.3835872775  -1.2429710660
H    4.5949207064   0.3486247521   2.0866304430
H   -2.0804694410  -0.4156406519   2.7810196128
H    0.4954771947   0.7280290233   1.0964385449
H   -3.4748602512   1.5876837934  -1.7077900147
H   -0.8286053651   2.7672260519   1.4564540003
H   -4.7138118391  -2.0401528676   0.0360645512
*