! 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   0.6467343174  -1.6359151336   2.0201793317
S   -2.1922430607   1.0946666629  -1.5767720626
O    1.9862876311   0.6063443452  -0.3094467377
O   -0.7634247927   3.0323776501  -0.5159193012
O    2.8138318285   1.0796465473   1.7175442334
N   -0.5244413992   0.9267906490   0.3814700836
C   -0.9358426091  -0.3822121303   0.1526769581
C    0.4799704136   1.3591681294   1.3267090068
C   -1.8818180889  -0.4668941619  -0.8754709665
C   -1.0346218434   1.8544960675  -0.4891015347
C   -0.5547564278  -1.5681845893   0.7761455557
C   -2.4621125812  -1.6576620389  -1.2675778050
C    1.8933442995   0.9906940920   0.9427409510
C   -1.1318156254  -2.7704606346   0.3923268381
C   -2.0816707235  -2.8180512531  -0.6154088650
C    3.2819313009   0.2425869972  -0.8234388466
C    3.1429293903   0.0475512476  -2.3094906474
H    0.4342430368   2.4472917348   1.3892834150
H    0.2582339855   0.9976192445   2.3271873286
H   -3.1915114654  -1.6826661841  -2.0652712784
H   -0.8274507590  -3.6812044841   0.8888367930
H   -2.5170369031  -3.7665922419  -0.8953361725
H    4.0007287911   1.0300112611  -0.5979298572
H    3.6131756142  -0.6732906353  -0.3326902392
H    2.4266240174  -0.7364076554  -2.5494352860
H    2.8340177422   0.9665677068  -2.8050466249
H    4.1083341283  -0.2446859482  -2.7209110413
*