! 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   1.6783498715  -0.8905547238  -2.6197072468
Cl  -7.8045978968   1.4068204481   1.2782167693
O    3.4123573481   0.0551690037  -0.4136847278
O    2.6200219302   0.1167825236   1.6775427992
O   -2.6951659153   1.2442343379  -1.5798603898
N    3.7214340172  -2.4565301487   0.7522360101
N    4.2205512239  -2.6217585489   1.9796946583
N    5.7654404241  -3.1191319170   0.4281330417
C    2.3768385028  -0.4100824378   0.4084519512
C    4.1225116261   1.1039948811   0.2506707255
C    2.4031839557  -1.9410159419   0.5071514532
C    3.2537229368   1.3690116375   1.4738384356
C    1.0179973883   0.0343183504  -0.1291637322
C    5.5314347787   0.6704123396   0.5937364850
C    0.6297716663  -0.1472852153  -1.4562103322
C    0.0876360148   0.6248942219   0.7205521365
C   -0.6208868889   0.2312009415  -1.9125060085
C   -1.1609506769   1.0386046763   0.2869934454
C   -1.5131005056   0.8330914554  -1.0382565035
C    4.6560121146  -2.7400628167  -0.1560023852
C    5.4413911098  -3.0206013425   1.7317369314
C   -3.8502192060   1.2642277186  -0.8419382123
C   -4.7205808048   2.3184680238  -1.0772114870
C   -4.1910550278   0.2509078089   0.0441646267
C   -5.9441027836   2.3616941769  -0.4290355605
C   -5.4094371580   0.3013946591   0.7032464595
C   -6.2783339878   1.3538818049   0.4615523118
H    4.1490865272   1.9738352033  -0.4092396855
H    2.0378877575  -2.3887008279  -0.4142118075
H    1.7381735446  -2.2672399337   1.3049182653
H    3.8232208506   1.6230977458   2.3667878119
H    2.5203130694   2.1609932159   1.2897830437
H    6.0858193213   1.5173631093   1.0001164624
H    5.5389538965  -0.1230924425   1.3429041747
H    6.0652131502   0.3182516841  -0.2889590951
H    0.3427962584   0.7789774477   1.7595864134
H   -0.9032103997   0.0695395226  -2.9442658166
H   -1.8359423652   1.5177688891   0.9831978481
H    4.4806552629  -2.6781112790  -1.2182674943
H    6.1274637391  -3.2635824993   2.5277906953
H   -4.4490206303   3.0997935471  -1.7748058435
H   -3.5266894142  -0.5837787710   0.2257712488
H   -6.6243015898   3.1804996401  -0.6187275932
H   -5.6764152257  -0.4858689754   1.3945489257
*
