! 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   0.9389410150  -1.7109838994  -1.9573645252
Cl   4.8387000996   1.4480934228  -0.1701139531
O   -1.0646227183  -1.8155426673   0.2158461963
O   -1.4374880625  -0.0175445336   1.4794483378
N   -1.4326562501   1.6067165725  -0.9992802348
N   -0.5412784400   2.0588927564  -1.8852120963
N   -1.2110266899   3.7170330967  -0.5296854487
C   -0.8935478140  -0.4313573016   0.2613012176
C   -1.1886478111  -2.3223820358   1.5471637096
C   -1.1636384657  -1.0555596116   2.4072333577
C   -2.4453603725  -3.1655392689   1.6724483603
C   -1.7146020243   0.1992885062  -0.8685610009
C    0.5771886386  -0.0243232594   0.1635591786
C   -3.7549286715  -2.4490883743   1.3698134291
C    1.4474991288  -0.5280019493  -0.7996195251
C    1.0719619578   0.9630606946   1.0104096471
C   -4.9555997090  -3.3675772232   1.5418399228
C    2.7582656264  -0.0886761814  -0.9062274199
C    2.3742062244   1.4245832784   0.9268079900
C   -1.8084860434   2.6001526846  -0.1932062292
C    3.2089217348   0.8881749746  -0.0363953691
C   -0.4479636687   3.3215764136  -1.5655012658
H   -0.3188925398  -2.9463214443   1.7719081852
H   -1.9272725012  -1.0378112488   3.1841002840
H   -0.1883543836  -0.9132623032   2.8832744854
H   -2.4658272146  -3.5601496127   2.6930793970
H   -2.3467764079  -4.0374064754   1.0185871756
H   -2.7761255474   0.0589467764  -0.6646264716
H   -1.4884781465  -0.2745401261  -1.8199456469
H   -3.7417169373  -2.0658018475   0.3472282627
H   -3.8755609509  -1.5814662862   2.0238573030
H    0.4261332359   1.3966056722   1.7608952076
H   -5.0353826879  -3.7319645252   2.5673167075
H   -5.8863308678  -2.8514250761   1.3031441148
H   -4.8865526270  -4.2387302977   0.8878555432
H    3.4117225635  -0.4993908894  -1.6630737765
H    2.7218107907   2.1926178013   1.6028939770
H   -2.5246183271   2.4750189215   0.6026195658
H    0.1967163114   3.9929330934  -2.1103088745
*