! 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  -0.6130490998  -0.3006786803   2.4624347112
Cl   1.7498612261  -4.0880622893  -0.4422095978
O   -1.8472612707   1.5426744348   0.4278729199
O   -0.6715077489   1.9963959828  -1.4308395854
N    1.7276343216   2.1690790271   0.4801043177
N    2.3141252699   2.4754925330  -0.6795373205
N    3.6864565159   1.2320347561   0.5899353840
C   -0.5655085583   1.4946893123  -0.1252165727
C   -2.7941262022   1.5375245947  -0.6387231759
C   -2.0317490540   2.2971642244  -1.7128514707
C   -3.2144167211   0.1365279079  -1.0555297073
C    0.3319412065   2.4182900429   0.7207011461
C    0.0000217757   0.0738692692  -0.1795418390
C   -3.7848972114  -0.6972678179   0.0833183223
C    0.0094874424  -0.7842335620   0.9179106171
C    0.5809781149  -0.3968145336  -1.3537418848
C   -4.1228248486  -2.1139525026  -0.3536599152
C    0.5377070477  -2.0643765861   0.8478454298
C    1.1222730401  -1.6666659860  -1.4522569735
C    2.5495782577   1.4146059420   1.2125513505
C    1.0887944603  -2.4949246041  -0.3453655471
C    3.4809814736   1.8978963256  -0.5617619613
H   -3.6646483152   2.0972556532  -0.2908334717
H   -2.2704354112   1.9669856383  -2.7245289581
H   -2.2041717816   3.3750496430  -1.6477716777
H   -2.3751475349  -0.3919057095  -1.5195950871
H   -3.9693593324   0.2487995855  -1.8399612796
H    0.1483451756   2.2611384531   1.7810303433
H    0.0972040957   3.4583014542   0.4969333137
H   -4.6806954667  -0.2085731659   0.4782736085
H   -3.0697154433  -0.7380500216   0.9072262898
H    0.6084064894   0.2393187248  -2.2253926811
H   -4.5524568030  -2.6908355286   0.4660924921
H   -4.8425943955  -2.1214485901  -1.1742029462
H   -3.2306207049  -2.6432047078  -0.6941760355
H    0.5223998260  -2.7094075863   1.7151493466
H    1.5608227435  -1.9984856716  -2.3827572166
H    2.2904866919   1.0466605214   2.1932449142
H    4.2236890215   1.9663414838  -1.3408641683
*