! 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   0.0669401148  -1.9279835143   0.2117589804
Cl  -7.4814313081   0.1673337136  -1.8221847701
O    2.7280342712  -0.9681495995  -0.6343391443
O    3.5616589594   0.9231625265   0.2196886425
O   -2.5545688634   2.4060597206   0.4183914377
N    4.0345569185  -1.5245070560   1.7600790891
N    5.2405134004  -1.0291750277   2.0517974156
N    5.4058862329  -3.1719522509   1.4025322025
C    2.5816648506  -0.0513784701   0.4140598961
C    3.5660938783  -0.4126000318  -1.6507208697
C    2.8394644258  -0.7264908143   1.7668834500
C    3.7517633920   1.0259967264  -1.1812586228
C    1.1826635864   0.5606524158   0.4061687498
C    4.8624355294  -1.1855376290  -1.7627080940
C    0.0181246265  -0.1971141527   0.3065323054
C    1.0238168869   1.9388800861   0.5275906037
C   -1.2434390094   0.3780349764   0.3051114568
C   -0.2191876408   2.5430557239   0.5099440630
C   -1.3562541122   1.7579154564   0.3905971352
C    4.1534479995  -2.7907422782   1.3588933500
C    6.0234756522  -2.0519679777   1.8251271846
C   -3.6772668233   1.8284827405  -0.1223323695
C   -3.6863818396   1.3195273724  -1.4142069516
C   -4.8308820972   1.8335537095   0.6451206988
C   -4.8602811110   0.8009548940  -1.9355904167
C   -6.0097936779   1.3286546989   0.1187643489
C   -6.0137361165   0.8097473333  -1.1657368665
H    3.0273708352  -0.4490448044  -2.6002622651
H    2.0068129194  -1.3721612462   2.0378358361
H    2.9216934658   0.0314584321   2.5438636873
H    4.7495043916   1.4196689352  -1.3703111419
H    3.0184272182   1.7014065970  -1.6342045953
H    5.4860613204  -1.0608566418  -0.8759986825
H    4.6777114023  -2.2495842818  -1.9095794642
H    5.4300493898  -0.8264642906  -2.6221471593
H    1.8981687000   2.5663108680   0.6298877701
H   -2.1182920496  -0.2548868730   0.2432462512
H   -0.3069231798   3.6180993723   0.5921982268
H    3.3092900823  -3.3970455641   1.0714195934
H    7.0889510054  -1.9917013700   1.9828395176
H   -2.7911120528   1.3256788629  -2.0224031322
H   -4.8146767858   2.2373286531   1.6488069001
H   -4.8704007291   0.4013842397  -2.9400639268
H   -6.9118029084   1.3362171914   0.7146668762
*
