! 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   4.0901762191   2.3310635214   0.7619046392
S    1.0432630752  -1.6809285454  -1.5879193434
O    1.5334304546  -3.0353800528  -1.6699896832
O    0.6761115144  -0.9756999639  -2.7936117951
O    1.5415550786   2.8449647213  -0.7127183167
O   -0.0072132276   1.2534981231  -0.9488224651
O    0.7477514997  -2.5188040715   1.1889152974
O   -4.7693562187   0.9775415397   2.9691892554
O   -3.8660122766   0.7256632597  -1.5740508210
N    3.4234258267  -1.1858559766  -0.2738025878
N   -0.2951734200  -1.6275794572  -0.6197461552
N    4.1602599148  -0.2255338486   0.2615772857
N   -1.2595988046  -1.5307579691   1.4914810184
N   -3.0170920157  -0.2935198675   2.2326921098
N   -2.5710467009  -0.4288850125  -0.0807568669
C    2.2478303030  -0.7127747964  -0.7193569002
C    2.2245820324   0.6543936680  -0.4701780390
C    3.4610538828   0.8785178607   0.1487549498
C    3.9665973150  -2.5351404037  -0.2786781084
C    1.1310259329   1.5945520771  -0.7397476337
C   -0.2065632466  -1.9355994972   0.7161249244
C   -2.3305288823  -0.7111228965   1.1863934113
C   -4.0384672602   0.5105794943   1.9713030070
C   -3.5885769085   0.3909419865  -0.3260898987
C    0.5525715685   3.8607050833  -0.8970878329
C   -4.3827664196   0.9047903926   0.6842524775
C   -4.4292051934   0.6184329539   4.3063549771
C   -3.0357350223   0.2404160855  -2.6277841999
H   -1.0775987957  -1.0186103761  -0.9062633853
H    4.9287682337  -2.4835315867   0.2175191229
H    3.3178731583  -3.2100784313   0.2692663334
H    4.1112433450  -2.8926896947  -1.2928661058
H   -1.1575306182  -1.7501917100   2.4738133670
H   -0.2067235156   3.8191253401  -0.1169753050
H    1.0832022847   4.8054054606  -0.8333295952
H    0.0766150777   3.7786257447  -1.8734411251
H   -5.2106621507   1.5692747994   0.4857033998
H   -4.5023806781  -0.4565383417   4.4668627078
H   -5.1548753717   1.1235762479   4.9375309929
H   -3.4280271859   0.9562060013   4.5720671980
H   -3.0289839316  -0.8485845235  -2.6709686846
H   -2.0170270054   0.6160262631  -2.5376088652
H   -3.4723302032   0.6258992996  -3.5447684217
*