! 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  -2.3408999665  -1.5400307211  -2.4535457504
Cl   4.7996017135   2.6952011629   1.9350015679
Cl  -4.2328006628   3.2158755361  -0.8412767625
S    1.5807037820  -2.9280965484  -0.4907839515
N   -1.6704105615  -1.7283138788   1.3496781736
N    0.0929551489  -0.7970666962  -0.8303075002
N   -2.9588115730  -1.4803150894   1.1023651079
N   -2.2260589353  -0.2199930819   2.8085980428
C   -0.8944733049  -2.6374881285   0.5495145923
C    2.6775459494  -1.8176093263  -1.4199016886
C    0.1507729013  -1.9367047689  -0.2948279799
C    3.2025037073  -0.6888748641  -0.5847859865
C    4.0514106319  -0.9417246468   0.4894769570
C    2.8619171180   0.6286045026  -0.8693292993
C   -0.9749767154   0.0864299814  -0.7820696056
C    4.5475267393   0.0909140339   1.2681797594
C    3.3504658796   1.6760366623  -0.1015744772
C   -1.2474651090  -0.9637696469   2.3589016376
C   -2.1371930622  -0.0920885617  -1.5332447024
C   -0.8445563265   1.2738510046  -0.0622440812
C    4.1875978238   1.3954786743   0.9649813586
C   -3.1390796787   0.8634524436  -1.5631247458
C   -1.8418199501   2.2305983610  -0.0611489765
C   -2.9836314175   2.0176133395  -0.8171136130
C   -3.2429372787  -0.5713343018   1.9964366849
H   -1.5775077731  -3.1854136343  -0.0996803038
H   -0.4187311966  -3.3700187547   1.2024895144
H    2.1536996926  -1.4608264243  -2.3050270794
H    3.4873262073  -2.4677118601  -1.7555865198
H    4.3336071680  -1.9594084491   0.7304125730
H    2.2048075631   0.8487394554  -1.6994097550
H    5.2065465907  -0.1218252872   2.0986399889
H    3.0750389573   2.6950679134  -0.3360102814
H   -0.2369120725  -0.9935601422   2.7356798506
H    0.0582375764   1.4392214564   0.5108806945
H   -4.0289223550   0.6996826402  -2.1547663325
H   -1.7198232408   3.1352616109   0.5177551486
H   -4.2313354483  -0.1474805728   2.0737011941
*