! 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   3.9376261970   2.4887764489  -1.1886055437
S    1.3291050483  -1.9142261750   0.9882592175
O    1.2547041277  -1.4641039720   2.3587021227
O    1.7792875076  -3.2560133315   0.7056046190
O    1.7368408570   2.7172680568   0.8072147073
O    0.2932927399   1.0611565397   1.2081431441
O    0.4400201603  -2.1678575398  -1.7726106431
O   -5.3091957154   1.4052795023  -1.5991230566
O   -3.4207462098   0.3273968133   2.4997729472
N    3.3844841044  -1.1633089242  -0.6940448978
N   -0.1798773520  -1.6858249746   0.3568709481
N    4.0221725369  -0.1158500510  -1.1923800066
N   -1.5741598596  -1.2044621201  -1.4385759323
N   -3.4444306762   0.0851675877  -1.5238236289
N   -2.4970428742  -0.4703803815   0.5645457942
C    2.3515557655  -0.7884588665   0.0777687618
C    2.3195011084   0.6014927738   0.0917210900
C    3.4008020185   0.9445905389  -0.7304668895
C    3.8626720565  -2.4864747867  -1.0645263491
C    1.3398054675   1.4633165953   0.7614982228
C   -0.3838964158  -1.7203020341  -1.0012170629
C   -2.5457463763  -0.4979077690  -0.7546572918
C   -4.3776165056   0.7863257194  -0.8946132929
C   -3.4306485039   0.2479268314   1.1809045815
C    0.8423774611   3.6642373405   1.3970623620
C   -4.4257390085   0.9149997362   0.4879913939
C   -5.2760749907   1.3184144271  -3.0221791064
C   -2.4045193436  -0.3582728952   3.2298738406
H   -0.8753209765  -1.1705401367   0.9200060079
H    4.2512413765  -3.0160153099  -0.2003767442
H    3.0715121921  -3.0608001532  -1.5331072233
H    4.6648227824  -2.3369606469  -1.7777378421
H   -1.6847482420  -1.2177945193  -2.4442315766
H    1.3393920151   4.6262318228   1.3235130435
H   -0.1034707000   3.7042045246   0.8584639916
H    0.6561115094   3.4330784126   2.4449046174
H   -5.1861545747   1.4960890164   0.9882671255
H   -4.3531431117   1.7292578678  -3.4297847622
H   -6.1154070397   1.9137473199  -3.3701820229
H   -5.3983210497   0.2921666283  -3.3665297911
H   -1.4128273568   0.0263599991   2.9931070110
H   -2.4381537584  -1.4335510591   3.0555388951
H   -2.6146184260  -0.1638713569   4.2777316111
*