! 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  -1.0786724635  -0.4371052215   2.5501891630
Cl  -3.9776443297   1.2345780159  -1.6559160428
O    0.5678007756  -1.6978992721   0.5897526456
O    3.3817723342   1.9430010860  -0.4935602031
O    5.1185168870   1.1270073756   0.6427616304
C    2.5639491882  -0.8709771205  -0.5641697976
C    1.7115195014  -2.0642821102  -0.1766521031
C    3.0361570999  -0.0803613189   0.6584694313
C   -0.4356757767  -1.0282264342   0.0013496644
C    3.9659258536   1.0375847978   0.2883226107
C   -1.3399606411  -0.3776483959   0.8456279090
C   -0.6529037592  -0.9533418121  -1.3712392349
C   -2.4307094459   0.3116328695   0.3490053879
C   -1.7391423567  -0.2608290704  -1.8837982796
C   -2.6210184502   0.3661760810  -1.0224977221
H    2.0280437654  -0.2199165181  -1.2572656795
H    3.4251363719  -1.2620219489  -1.1108530918
H    2.2741487009  -2.7341925623   0.4729338704
H    1.4264818740  -2.6420664268  -1.0599488830
H    3.5556801773  -0.7386131114   1.3547793514
H    2.1794018739   0.3465501613   1.1870036377
H    0.0165043811  -1.4391850496  -2.0672025457
H   -3.1146247567   0.8042768231   1.0261029886
H   -1.8852235854  -0.2181788537  -2.9540317442
H    4.0134488549   2.6422747467  -0.7216376177
*
