! 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  -0.0054698997  -1.0792336739   2.3977341791
Cl   0.7536470742  -5.2932947437  -0.7676953529
O   -0.6541578811   1.1400669565   0.6011339858
O    0.2302811557   1.2961875155  -1.4276485889
N    1.7346117382   2.6886511893   0.4948294766
N    2.2641152898   3.4418836687  -0.4734116471
N    1.2872181363   4.7324894509   1.0816501044
C    0.4247605393   0.7178032377  -0.1728027942
C   -1.7846389004   1.3173002569  -0.2505770192
C   -1.1686632988   1.3059163737  -1.6594158813
C   -2.8276821151   0.2332461633  -0.0349316601
C    1.7265306771   1.2520396748   0.4237918058
C    0.5003278529  -0.8069571073  -0.2788440023
C   -4.0943430629   0.4492443382  -0.8607969086
C    0.3125600239  -1.6674156140   0.8012454004
C    0.8044177048  -1.3863988032  -1.5075209789
C   -4.9153832998   1.6582978465  -0.4333424799
C    0.3860369741  -3.0454622395   0.6595750258
C    0.8882704992  -2.7575215701  -1.6776711576
C    1.1491825406   3.4695058924   1.4028723167
C    0.6682054689  -3.5776909943  -0.5856892224
C    1.9751919192   4.6512919015  -0.0731090566
H   -2.2036699185   2.2984132665  -0.0141707930
H   -1.4768190800   0.4212703994  -2.2286865154
H   -1.4154875819   2.1914473519  -2.2435944098
H   -3.0906832572   0.1951252173   1.0256911549
H   -2.3925342310  -0.7383649784  -0.2868248525
H    2.5721799727   0.9340639557  -0.1825873094
H    1.8732007421   0.8474075766   1.4242506675
H   -4.7114699718  -0.4476043937  -0.7753723775
H   -3.8422773089   0.5322180649  -1.9227755958
H    0.9787856340  -0.7534046968  -2.3661131896
H   -4.3890481835   2.6000479766  -0.5948760777
H   -5.8477547477   1.7131487316  -0.9961527419
H   -5.1741431343   1.6031730491   0.6258136595
H    0.2262335489  -3.6899330929   1.5126337422
H    1.1202548431  -3.1716194387  -2.6486318798
H    0.6587133742   3.0852372913   2.2824046626
H    2.2795815313   5.5178807226  -0.6386478881
*