! 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  -0.1739738440  -0.9652036911   0.8410870726
Cl  -4.1567985435  -2.1420462601   2.0560632011
Cl   4.2475048281  -3.3921209185  -1.0090537689
S   -0.9891148243   3.1748191103  -1.1869424496
N    1.7451229976   2.0038917562   0.8838368765
N    0.1338918367   0.8169235650  -1.4808127804
N    0.9061125550   2.2758592800   1.8859314586
N    2.4808263321   0.8170519001   2.5442177982
C    1.5505980856   2.5616165391  -0.4300270892
C   -2.3747649265   2.1561585217  -1.7533291818
C    0.2953341558   2.0036054781  -1.0741952618
C   -2.7967471055   1.0912532073  -0.7813363758
C   -2.9578837087   1.3586537809   0.5730920856
C   -3.0677994580  -0.1913623527  -1.2428584807
C    1.1380808926  -0.1386983538  -1.3568771455
C   -3.3789201713   0.3720378566   1.4505670105
C   -3.4967111701  -1.1892416340  -0.3824153868
C    2.6665378644   1.1267114443   1.2861079958
C    1.0832939676  -1.0828192667  -0.3291597685
C    2.1752866674  -0.2354323998  -2.2803681388
C   -3.6442606919  -0.8970690127   0.9626669333
C    2.0345636548  -2.0811479110  -0.2117137915
C    3.1338584922  -1.2308155591  -2.1829239955
C    3.0556544556  -2.1450747869  -1.1459669804
C    1.3878358159   1.5415312493   2.8525510485
H    2.4235414758   2.3187688130  -1.0343562238
H    1.5084259167   3.6476988171  -0.3566458778
H   -2.1307110084   1.7280928271  -2.7246757551
H   -3.1796051089   2.8770502073  -1.9152693672
H   -2.7420662702   2.3448613264   0.9636785797
H   -2.9367870861  -0.4248526174  -2.2919023044
H   -3.4943779806   0.5941971467   2.5026173293
H   -3.6972664707  -2.1831320697  -0.7585610825
H    3.4571620011   0.7704682236   0.6439897988
H    2.2285601736   0.4769878323  -3.0931738125
H    1.9795509696  -2.7929921722   0.6000421397
H    3.9293137390  -1.2857095805  -2.9128011655
H    0.9349801951   1.5333257517   3.8313566790
*