! 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   0.8166749977   0.6147205805  -2.2145632832
Cl  -2.8528097869   3.4830517665   0.3313776606
O    1.1484209617  -1.5895341889   1.8326277915
N   -0.7701581820  -2.5209308073  -0.1193169374
N   -1.7115179761  -2.0166348167  -0.9234991452
N   -2.6505003299  -2.9802495591   0.8716317056
C    1.1432907626  -1.0871059775   0.5124210822
C    2.5857426713  -0.7576850704   0.0985969166
C    0.6284761123  -2.2523809035  -0.3472580441
C    3.1773305457   0.4644812822   0.7921979914
C    0.1697055182   0.0957936964   0.4116355686
C    4.5873681659   0.7945007804   0.3086325063
C   -0.0347976902   0.8806617247  -0.7251465828
C   -0.6350366639   0.3964275658   1.5102179879
C    4.6425033541   1.2589885360  -1.1404155797
C   -0.9527341400   1.9199490960  -0.7573099036
C   -1.5635695224   1.4231969255   1.5088967800
C   -1.3449504221  -3.0757933348   0.9490236049
C   -1.7104141970   2.1866481802   0.3675420532
C   -2.8136284156  -2.3206862043  -0.2909476291
H    2.6476815158  -0.6392655545  -0.9801206323
H    3.1919436446  -1.6372816610   0.3364469356
H    1.2076742524  -3.1478779304  -0.1207823795
H    0.7509946809  -2.0433366922  -1.4060997788
H    2.5374597066   1.3375485171   0.6314960182
H    3.2095918879   0.3028762211   1.8742557760
H    5.2350917637  -0.0769246220   0.4433171819
H    4.9995488396   1.5787005396   0.9480487337
H    1.5591433918  -0.9423547172   2.4180672466
H   -0.5486149121  -0.1945164965   2.4094550229
H    3.9900418361   2.1191806394  -1.3017943417
H    5.6544284812   1.5562805044  -1.4179731712
H    4.3353438584   0.4800984314  -1.8391363716
H   -1.0757604319   2.5077632483  -1.6560835180
H   -2.1591690106   1.6143773118   2.3903860154
H   -0.7877883063  -3.5532437626   1.7380137139
H   -3.7815796675  -2.0626953327  -0.6912359087
*