! 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   2.3559877373   1.0154760304  -2.2131248425
Cl  -7.0308375378  -2.6286939515   0.9514272695
O    2.9832004091  -0.9625337916   1.7882509281
O    3.8740590797  -0.2771037517  -0.1283164444
O   -2.4411980213   0.3504566269  -1.1375793151
N    3.2507829094   2.4940586134   0.6318447460
N    2.1366040711   3.1977336205   0.4141162281
N    3.8196292034   3.9783692232  -0.8492189057
C    2.9027535866   0.0464774923   0.8150933733
C    3.4532401134  -2.1597657391   1.1561133423
C    3.2814467595   1.3557905647   1.5110059682
C    3.8159604360  -1.6855885220  -0.2560867232
C    1.4909754467   0.0991530373   0.2287460821
C    2.4225406817  -3.2637466958   1.1821026425
C    1.1657047772   0.5128976534  -1.0611045720
C    0.4255140952  -0.2276050969   1.0650555655
C   -0.1472901463   0.5572465665  -1.5040694016
C   -0.8956668540  -0.1668193158   0.6605677791
C   -1.1774229597   0.2208220966  -0.6414383976
C    4.2360082673   2.9630450922  -0.1346899156
C    2.5281628850   4.0666356110  -0.4798832469
C   -3.4762603417  -0.3733584567  -0.5996178889
C   -4.6373915995   0.3118491942  -0.2805211228
C   -3.4001973333  -1.7509498234  -0.4450176533
C   -5.7395449228  -0.3837486481   0.1923114520
C   -4.4964712494  -2.4455469203   0.0399460203
C   -5.6583901044  -1.7570679086   0.3542796227
H    4.3474133684  -2.4798402241   1.6968450744
H    4.2886755647   1.2634563161   1.9175301288
H    2.6000171373   1.5427066053   2.3390941713
H    4.7849442243  -2.0486163783  -0.5942111152
H    3.0582147074  -1.9863032951  -0.9896914058
H    2.8361963097  -4.1578335371   0.7131518918
H    1.5174829937  -2.9882929731   0.6391318902
H    2.1470914046  -3.5269121793   2.2032202160
H    0.6281345435  -0.5376325051   2.0806191930
H   -0.3732788196   0.8674697423  -2.5155281528
H   -1.6789989976  -0.4161460208   1.3631967988
H    5.2331151593   2.5529454708  -0.1248327997
H    1.8529027474   4.8099577200  -0.8736929204
H   -4.6889572530   1.3849615657  -0.4081934439
H   -2.5003774330  -2.2931601827  -0.7054287557
H   -6.6474739414   0.1499383341   0.4364042216
H   -4.4404542272  -3.5184798648   0.1601828359
*
