! 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   0.2525322053  -0.1571332114   1.9799300604
Cl   1.7302799969  -4.3688346761  -0.8978772873
O   -1.1805899163   1.6309147363   0.2122293707
O   -1.0102969102   1.5616558518  -2.0015073094
N    1.7247194549   2.2558039169   0.3089106780
N    2.7694355385   1.4245635285   0.3525382663
N    2.5630361870   2.5322329727   2.2934254094
C   -0.2923798339   1.3348042050  -0.8203862464
C   -2.5081951688   1.3425335718  -0.2325587097
C   -2.3342207032   1.1258158978  -1.7435768785
C   -3.1204169790   0.1502357100   0.4790928295
C    0.8599154383   2.3440569597  -0.8354727966
C    0.2066659990  -0.1113709840  -0.7675463705
C   -4.5701396768  -0.0658763484   0.0577883275
C    0.4625577294  -0.8281024276   0.4003004386
C    0.4681790285  -0.7554420060  -1.9749532538
C   -5.1965486571  -1.2760400165   0.7323372159
C    0.9244473764  -2.1366352802   0.3651088108
C    0.9368182134  -2.0554848421  -2.0390975177
C    1.6105491531   2.8972591496   1.4724902609
C    1.1553419453  -2.7396654106  -0.8570017614
C    3.2321789985   1.6241629952   1.5583100613
H   -3.1119098011   2.2326189298  -0.0327487206
H   -2.4572297006   0.0715006491  -2.0180506571
H   -3.0185721199   1.7200158637  -2.3466660362
H   -3.0761343251   0.3091305100   1.5594319119
H   -2.5347642917  -0.7497850549   0.2653035752
H    0.4422917371   3.3502299811  -0.8712719297
H    1.4606295122   2.1986554467  -1.7318964148
H   -4.6324302007  -0.1907363797  -1.0275841236
H   -5.1529492912   0.8291678920   0.2936016744
H    0.2981019330  -0.2305000811  -2.9044694975
H   -6.2374852462  -1.4018190280   0.4327821334
H   -4.6661171535  -2.1933632492   0.4712411313
H   -5.1753689249  -1.1811839456   1.8193741347
H    1.1057747007  -2.6722539716   1.2862719693
H    1.1236031040  -2.5202852958  -2.9966534910
H    0.8409988035   3.6271706540   1.6665275908
H    4.1033406076   1.1001957766   1.9190536139
*