! 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   0.3416736473  -0.0703321502   2.0676806771
Cl  -3.8752537278  -3.6409899750   0.1944497642
Cl   0.0173420079  -4.0939755812  -1.4569050645
S   -0.8822399004   2.7597678094  -0.0574270455
N    2.8530469307   3.4368483795   1.0874951162
N    1.5587046446   1.4524005669  -0.1855146004
N    3.9116835303   3.7728974007   0.3467627832
N    4.5462498284   2.5711237026   2.1344356745
C    1.5095479098   3.6922764217   0.6567899037
C   -1.5226281366   1.6696036352  -1.3588534647
C    0.8471693967   2.4566960788   0.0848250511
C   -2.1004714164   0.3525973032  -0.9219108024
C   -2.1829767324  -0.6749080941  -1.8564927384
C   -2.6124397497   0.1365097548   0.3514302904
C    1.1190850056   0.1797809541  -0.5122706587
C   -2.7405762007  -1.9000174428  -1.5285442679
C   -3.1629292164  -1.0865659746   0.7003777121
C    3.2443633831   2.7090303290   2.1314542985
C    0.5801172850  -0.6627316911   0.4630109321
C    1.3473824282  -0.3539952536  -1.7788205186
C   -3.2145583974  -2.0989472945  -0.2432370710
C    0.2506447607  -1.9785806376   0.1850728208
C    1.0134019096  -1.6618477177  -2.0786202060
C    0.4650397852  -2.4642250469  -1.0909656113
C    4.8959224125   3.2414061196   1.0210176028
H    1.5302347792   4.4823478054  -0.0924044035
H    0.9242358487   4.0679626977   1.4983719189
H   -0.7597422913   1.5408358199  -2.1254340863
H   -2.3052241036   2.2783572558  -1.8187932533
H   -1.7993951666  -0.5277213884  -2.8582342079
H   -2.5671942587   0.9154717446   1.1009266991
H   -2.7823942868  -2.6916019032  -2.2632388607
H   -3.5415626561  -1.2428149589   1.7010871590
H    2.5562666857   2.3131657169   2.8618482663
H    1.7882814720   0.2734680765  -2.5418403567
H   -0.1740546774  -2.6072370408   0.9546610389
H    1.1824452811  -2.0458320613  -3.0748427804
H    5.9193389470   3.3480481950   0.6976687579
*