! 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  -6.5428522515   4.5300430646   0.9704650736
O    1.7272325751   0.7762870386   0.9557491740
O    1.0019231325  -3.1477795631  -0.1333550980
N    2.2356008900  -1.2599747633   0.1327300164
N    3.2210218928  -3.2593899268  -0.5929223117
N    5.0657757103  -4.4526478109  -0.4583080552
C    1.1082998616  -0.4632974047   0.7033351613
C    3.3955788396  -0.3781500329  -0.1712675083
C    2.6889019847   0.9739757526  -0.0532870491
C   -0.0263315119  -0.2955952463  -0.3172350964
C    0.6348154356  -1.0200365272   2.0339647832
C    4.4948985613  -0.4663292278   0.8834074751
C    3.9642761796  -0.5441223963  -1.5725599589
C   -1.1278616177   0.6509028118   0.1459062633
C    2.0560352815  -2.5437937196  -0.1801555552
C   -2.1782228300   0.8526108097  -0.9474761460
C   -3.2815509412   1.7663845489  -0.4987031902
C    3.3897515192  -3.8479241167  -1.8219856012
C    4.2496797994  -3.6722068331   0.1912246162
C   -4.4220332096   1.2618185229   0.1205753025
C   -3.1699484712   3.1468365904  -0.6453271290
C    4.5439929619  -4.5587502135  -1.7209896649
C   -5.4279660770   2.1012210004   0.5765773347
C   -4.1637885161   4.0038558765  -0.1964152989
C   -5.2884781546   3.4698133548   0.4119851093
H    3.3676664572   1.7692195278   0.2520368049
H    2.2286593323   1.2668677051  -1.0049058516
H   -0.4628129326  -1.2698649435  -0.5336552600
H    0.3875757357   0.0695532379  -1.2622026086
H    1.4806216399  -1.2690219045   2.6749116664
H    0.0230812015  -1.9089750024   1.9033922731
H    0.0304498367  -0.2773003283   2.5539029991
H    4.0981901879  -0.3615486599   1.8931835169
H    5.2134989906   0.3374634631   0.7203954409
H    5.0494849218  -1.3999219409   0.8279741521
H    3.1773166428  -0.6376481105  -2.3215837880
H    4.5455583118   0.3465963796  -1.8165489463
H    4.6375932671  -1.3942212908  -1.6633323062
H   -1.6203394656   0.2537425942   1.0373873543
H   -0.7094883367   1.6213035170   0.4233677144
H   -2.5941618543  -0.1167541771  -1.2334037547
H   -1.6969092378   1.2633401367  -1.8386728666
H    2.7068509250  -3.6854120794  -2.6384471828
H    4.3178390230  -3.4137007263   1.2355327279
H   -4.5357768217   0.1921031541   0.2484240526
H   -2.2937127637   3.5674834055  -1.1238736083
H    5.0266852934  -5.1407665505  -2.4892266951
H   -6.3083874058   1.6889091486   1.0504201866
H   -4.0600952161   5.0727522716  -0.3244513663
*