! 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   5.0600274408   2.9105291049  -1.0036869609
O   -2.5150561896  -0.6181721760   1.7020850274
N   -1.3079835405  -2.6248557872  -0.1472805927
N   -0.2197868318  -2.6514440351  -0.9208481156
N    0.0407713454  -4.0215345684   0.8359425676
C   -2.3583458429  -0.3938548011   0.3129207831
C   -3.5787620586   0.4836018111  -0.1230608709
C   -1.0227286977   0.3251866228  -0.0009092645
C   -2.4307702002  -1.7521841812  -0.4171474524
C   -3.6830985688   1.7292341215   0.7650484926
C   -3.4349158290   0.9399477526  -1.5786568548
C   -4.8995189967  -0.2872576685   0.0082010165
C    0.1294309178   0.0823408049   0.9821007878
C    1.3738148721   0.7782345022   0.5074741978
C   -1.1359912111  -3.4421013881   0.8925204034
C    1.6806750111   2.0657106973   0.9375359244
C    2.2271869322   0.1683046843  -0.4086726654
C    0.5565185468  -3.4967450200  -0.2899009589
C    2.8088868064   2.7303636842   0.4782438399
C    3.3599488951   0.8145544797  -0.8793755886
C    3.6413079926   2.0946767585  -0.4281707648
H   -1.1806062084   1.4044704653  -0.0268456463
H   -0.6968329162   0.0546773411  -1.0076178125
H   -3.3248365450  -2.2925320612  -0.1117652946
H   -2.4760055270  -1.6227667010  -1.4958680331
H   -3.8931884064   1.4804754546   1.8049071527
H   -4.5023533131   2.3585261072   0.4114174381
H   -2.7823757215   2.3449126912   0.7455184252
H   -3.3561769123   0.1065533139  -2.2793514048
H   -2.5701169593   1.5864608015  -1.7337915017
H   -4.3171974005   1.5129096096  -1.8704693714
H   -5.0267792116  -0.7311009131   0.9960527814
H   -5.7365162469   0.3951071148  -0.1483763735
H   -5.0033011299  -1.0804158264  -0.7333219322
H    0.3508884188  -0.9792953801   1.1126475866
H   -0.1369643695   0.4729920019   1.9664847663
H   -1.7258997612  -1.0383178659   2.0586716079
H   -1.8923503443  -3.6090072602   1.6436643362
H    1.0331872703   2.5640869474   1.6488621843
H    2.0074625353  -0.8314881954  -0.7633944890
H    1.5331088062  -3.7553869199  -0.6683832513
H    3.0333692476   3.7285612234   0.8288587162
H    4.0134457009   0.3221880295  -1.5866243523
*
