! 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  -0.3995452342  -0.2535615755   2.6095889467
Cl   1.9078278702  -4.0486497749  -0.3293678207
O   -1.7543122255   1.5190540618   0.6577718086
O   -0.8192903519   1.9349239782  -1.3103732402
N    1.7922164014   2.2245494448   0.3197144190
N    2.2772543355   2.5017925984  -0.8930408453
N    3.7778726567   1.3411217504   0.3089476852
C   -0.5342305594   1.4790046102  -0.0201326556
C   -2.7936586202   1.2355268876  -0.2781608546
C   -2.1033244366   1.4253595592  -1.6397702300
C   -3.3821667218  -0.1495003928  -0.0795589711
C    0.4184854723   2.4656501719   0.6688841171
C    0.0595025612   0.0687485188  -0.0670341113
C   -4.5867294914  -0.3896419171  -0.9822600771
C    0.1499451586  -0.7616313946   1.0479909646
C    0.5948086850  -0.4111607756  -1.2589294387
C   -5.1830543495  -1.7750699685  -0.7905767064
C    0.7117100302  -2.0272093924   0.9780361052
C    1.1640265330  -1.6689266315  -1.3591641267
C    2.6885099335   1.5201962619   1.0121225815
C    1.2101470930  -2.4711785821  -0.2336523716
C    3.4661980280   1.9602440050  -0.8448680732
H   -3.5734525624   1.9867796456  -0.1257530623
H   -2.0203913868   0.4799248223  -2.1877685117
H   -2.6063698754   2.1489261101  -2.2794189884
H   -3.6842041012  -0.2625976823   0.9651284553
H   -2.6180945517  -0.9098888153  -0.2725984273
H    0.3311494058   2.3685718777   1.7491452307
H    0.1446498416   3.4864373705   0.4055075260
H   -4.3026802495  -0.2623363840  -2.0314388368
H   -5.3480261749   0.3693054136  -0.7799854312
H    0.5685444916   0.2084067015  -2.1435639831
H   -4.4548073712  -2.5549096627  -1.0203132127
H   -5.5123808019  -1.9254610645   0.2391098503
H   -6.0465411050  -1.9296360113  -1.4383115245
H    0.7611364487  -2.6515885665   1.8589836086
H    1.5631944009  -2.0101935308  -2.3037378877
H    2.5146390508   1.1814949648   2.0217796314
H    4.1450662683   2.0188500276  -1.6811310515
*