! 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   4.5326604901   2.2433539393  -1.1095589900
S    1.2516764988  -1.6847961431   0.9944921949
O    1.1874126589  -1.1082514319   2.3192710920
O    1.5655504553  -3.0843758825   0.8318000472
O    0.6046417448   1.4675542629   0.8577043034
O    2.4461115762   2.6921412625   1.1929806126
O    0.3874931908  -1.8973156629  -1.8012379711
O   -5.7577397907   1.0000777479  -1.5247423124
O   -3.5736417523   0.3299101287   2.5160047366
N    3.3750230524  -1.2819025773  -0.7242575152
N   -0.2119331482  -1.3472655711   0.3149855957
N    4.1860174994  -0.3499654645  -1.1971245051
N   -1.6524796055  -0.9846948123  -1.4639878096
N   -3.7011202900   0.0034412967  -1.5013932695
N   -2.5936328252  -0.3224204511   0.5555395286
C    2.4143087781  -0.7483650330   0.0519012116
C    2.6269086832   0.6210346400   0.0997966070
C    3.7570132050   0.7881984157  -0.7057200674
C    3.6328635098  -2.6641399047  -1.0980843516
C    1.8995839627   1.6982491518   0.7853994629
C   -0.4375434655  -1.4476973114  -1.0320738630
C   -2.6911820478  -0.4078222335  -0.7605079558
C   -4.7132125728   0.5581728629  -0.8477076378
C   -3.6197191247   0.2285916396   1.1982682613
C   -0.1978191286   2.4580702943   1.5082140874
C   -4.7374444301   0.7009602456   0.5351528899
C   -5.7645960750   0.8825132657  -2.9464890313
C   -2.4650242003  -0.2269208443   3.2192208124
H   -0.9391458554  -0.8877975200   0.8864136753
H    2.7417196022  -3.1209373987  -1.5128626840
H    4.4070155246  -2.6414230402  -1.8562637781
H    3.9873144812  -3.2359438550  -0.2461100534
H   -1.7878879602  -1.0402650761  -2.4652796223
H    0.0449116931   2.5283075403   2.5677231921
H   -0.0794469716   3.4339812999   1.0400338251
H   -1.2269949850   2.1358493537   1.3880599212
H   -5.5706312817   1.1496362695   1.0554199406
H   -6.7073277811   1.3143277171  -3.2699784200
H   -5.7189509654  -0.1582269718  -3.2646309317
H   -4.9429288678   1.4358786561  -3.3995305665
H   -2.6845598282  -0.0857923703   4.2734243591
H   -1.5332260026   0.2913444774   2.9893749643
H   -2.3536400855  -1.2926743684   3.0202326165
*