! 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  -1.5514628806   1.7054066711   1.9991788670
Cl   8.2138776666  -0.2476552400  -0.3826134143
Cl  -6.0723995474   2.3351960886  -0.8197752987
S    1.5147931591  -1.1684304849   0.4388926223
N   -2.3063875078  -1.9819042293   0.8093164754
N   -0.6118164429   0.1308678936  -0.3853595169
N   -3.4054762818  -1.4671897861   1.3667041334
N   -3.9349538801  -2.6889773253  -0.4397605337
C   -0.9858062568  -1.6886729069   1.2976975164
C    2.2275249009   0.1655588763  -0.5725669200
C   -0.1906649761  -0.7937357752   0.3684353060
C    3.7201154448   0.0505646694  -0.5183969951
C    4.4375186071   0.6399354613   0.5182189038
C    4.4122023147  -0.6504578052  -1.5001589963
C   -1.9255678156   0.5835173853  -0.4324783580
C    5.8191589109   0.5508567691   0.5691317967
C    5.7945283733  -0.7496340949  -1.4648852928
C   -2.6374946943  -2.6973074108  -0.2681843898
C   -2.4726927526   1.3818974793   0.5728918193
C   -2.6991398549   0.3545300475  -1.5684883047
C    6.4858231039  -0.1434861387  -0.4284720903
C   -3.7397271161   1.9289033286   0.4624773655
C   -3.9747908690   0.8728663971  -1.6897325049
C   -4.4847218478   1.6617544492  -0.6713855556
C   -4.3495844422  -1.9117898239   0.5811326899
H   -0.4511457530  -2.6257164270   1.4609943717
H   -1.0800905150  -1.2071429222   2.2711368065
H    1.8840143678   1.1195353939  -0.1747988955
H    1.8586114800   0.0666783984  -1.5918314298
H    3.9167794014   1.1867097043   1.2942773097
H    3.8715537459  -1.1184714860  -2.3130302368
H    6.3656885749   1.0217672143   1.3742429024
H    6.3212017496  -1.2893610434  -2.2394934838
H   -1.9106751954  -3.2090103738  -0.8793656554
H   -2.2897721789  -0.2484673341  -2.3676818200
H   -4.1376513160   2.5451899758   1.2563805760
H   -4.5573607497   0.6671424929  -2.5763585451
H   -5.3870770503  -1.6796173042   0.7603862684
*