! 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   4.1421139586   2.3552785467  -1.5031449380
S    1.3658142536  -1.6566400586   1.1639256064
O    1.3145648308  -1.0432562960   2.4702650783
O    1.7690913342  -3.0378244571   1.0442968218
O    1.9663366684   2.9019141966   0.4549948676
O    0.4605581493   1.3646974423   1.0559858043
O    0.4430794425  -2.2083492275  -1.5432458837
O   -3.4604495052   0.5769967505   2.5031117580
O   -5.6954076351   0.6981415837  -1.5623118879
N    3.4263927820  -1.1911757650  -0.6110913346
N   -0.1385642368  -1.4554281486   0.5160836753
N    4.1049432243  -0.2340142949  -1.2245235119
N   -1.6069551089  -1.3011072104  -1.2773673782
N   -2.5163629603  -0.3641451200   0.6447783800
N   -3.6503020810  -0.3148828257  -1.4241347080
C    2.4210065764  -0.6872892195   0.1227860537
C    2.4521974605   0.6957590113  -0.0151802685
C    3.5392077773   0.8968085930  -0.8762700521
C    3.8458297237  -2.5666509593  -0.8351108810
C    1.5181712068   1.6690993512   0.5602937420
C   -0.3799657645  -1.6935028501  -0.8135449830
C   -2.6336872947  -0.6282580722  -0.6440318660
C   -3.5249235704   0.2884103188   1.2151513282
C   -4.6466852373   0.3388272080  -0.8421766660
C    1.1215249571   3.9499790839   0.9374668562
C   -4.6476587278   0.6770478758   0.5057354349
C   -2.3013698338   0.1937059745   3.2420466393
C   -5.7226291948   0.3861604335  -2.9537091707
H   -0.8325482815  -0.8927633372   1.0318403657
H    4.2535683656  -3.0007114178   0.0724712544
H    3.0184652317  -3.1643878135  -1.2002553092
H    4.6212479428  -2.5335355839  -1.5915198162
H   -1.7524985607  -1.4782167256  -2.2627946297
H    1.6550698843   4.8743465685   0.7395404480
H    0.1675540847   3.9640407414   0.4117217344
H    0.9472307086   3.8555860589   2.0085797244
H   -5.4662252735   1.2090362055   0.9674770805
H   -1.4083962097   0.6974532310   2.8729550490
H   -2.1527009068  -0.8860535015   3.2292850494
H   -2.4873965045   0.5106172051   4.2641954753
H   -5.7024141664  -0.6892318745  -3.1263761264
H   -4.8960018245   0.8536109456  -3.4874922743
H   -6.6604247402   0.7898434105  -3.3246471990
*