! 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   3.3413567978   0.8154464712   1.2071748412
Cl  -5.4329399003  -0.5033285607  -0.9512209710
O    0.3391171375   0.5461580701   2.0491384886
N    2.3161936773  -2.6473833215  -0.8525721241
N    1.5322516669  -3.3216291644   1.2724264819
C    0.3397446514   0.2010421914   0.6834962557
C   -1.1231382812   0.0128089735   0.2870263413
C    1.0044736404   1.3211636489  -0.1311197255
C    1.0440676041  -1.1334581295   0.4722547681
C   -1.4529300598  -0.6148491571  -0.9120961863
C   -2.1530932813   0.4793905091   1.0947805696
C    2.3464202960   1.6650727146   0.0562030262
C    0.2928231696   2.0808670751  -1.0556930715
C    1.7491897213  -1.4603021916  -0.6749408025
C    0.9639178850  -2.1335729808   1.4307258829
C   -2.7709324087  -0.7714361232  -1.3040524667
C   -3.4808127649   0.3188852022   0.7209705808
C    2.9563199654   2.6866990038  -0.6518529777
C    0.8844697430   3.1116900264  -1.7710332543
C   -3.7800615144  -0.3039104133  -0.4770088257
C    2.2204784304   3.4135112727  -1.5743942799
C    2.1810470818  -3.5170913650   0.1348163572
H   -0.6835282082  -0.9891420891  -1.5745125808
H   -1.9472995818   0.9786960684   2.0296424822
H   -0.7520810241   1.8710248522  -1.2315207217
H    1.2473267963   0.5607594184   2.3773691663
H    1.8678057246  -0.7489886475  -1.4850578966
H    0.4297807812  -1.9768586372   2.3600086796
H   -3.0016785287  -1.2566055926  -2.2420387670
H   -4.2683608426   0.6826894540   1.3662018404
H    3.9986463613   2.9171915303  -0.4806233793
H    0.2942108911   3.6745740544  -2.4807593045
H    2.6954248735   4.2116989825  -2.1280080080
H    2.6423440031  -4.4869275175  -0.0024681654
*