! 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  -0.5351441276   0.8577312784  -2.4604904335
Cl   3.6409054608   2.6017463019   0.3475961676
O   -2.5030129018  -0.0387987315  -0.4204796949
O   -1.7861689658  -1.0927954552   1.4158872771
N    0.1084642399  -2.5862114002  -0.4377254086
N    0.3780120285  -3.2088527134   0.7117688739
N    2.2497649441  -2.9524548027  -0.5008342942
C   -1.4088533312  -0.7247138849   0.1218821776
C   -3.3682168172   0.3927920705   0.6340157399
C   -2.6339530298  -0.0594349538   1.8913895746
C   -1.1760142799  -1.9973307040  -0.7063051819
C   -0.1515780872   0.1466366027   0.1529248659
C   -3.6664378568   1.8799227556   0.5599595582
C   -2.4553383204   2.7974216921   0.4917826558
C    0.3038348295   0.8739815245  -0.9441250599
C    0.6306702335   0.1828657557   1.3033955565
C    1.4632472359   1.6321922174  -0.8955251207
C    1.7930521259   0.9305770416   1.3830487347
C    1.2331329096  -2.4269899949  -1.1358853542
C    2.1968409642   1.6556949625   0.2770136102
C    1.6656296084  -3.4126587822   0.6203457649
H   -4.3098283413  -0.1567878046   0.5382566780
H   -2.0545262943   0.7471979227   2.3532905569
H   -3.3023753500  -0.4752443797   2.6430786660
H   -1.2162855833  -1.7627196435  -1.7674033535
H   -1.9628928705  -2.7204522798  -0.4971671918
H   -4.3094059929   2.0662995442  -0.3031096115
H   -4.2722443542   2.1229016838   1.4378689679
H   -2.7761491422   3.8389551755   0.5179481999
H   -1.7683541974   2.6545631720   1.3268421774
H   -1.8945689542   2.6548088535  -0.4308000519
H    0.3299443758  -0.3847909564   2.1719250122
H    1.7872725680   2.1900482207  -1.7628431378
H    2.3705027496   0.9390384040   2.2965242432
H    1.2607679163  -1.9478021307  -2.1016630782
H    2.2111183189  -3.9212223996   1.3992936508
*
