! 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  -4.5521391794  -1.5476534317   0.3537522737
O    1.4682929957   0.1488975062  -1.7835393896
N    0.6067843872   2.1497914544   0.2476596786
N   -0.2853042105   2.4334896020   1.2000943592
N   -0.7025066429   3.6402381147  -0.6430373184
C    3.6446734361  -1.0084738040  -0.0792243215
C    4.3839409586  -0.3547535026   1.0490770846
C    4.6183838293  -1.7999708187   0.7383960422
C    2.1692423755  -1.3326311494   0.0214110601
C    1.2681507669  -0.1484248752  -0.4198561585
C    1.8611443510  -2.5952296083  -0.7766274577
C    1.5880162510   1.1031327730   0.4231944195
C   -0.1975812785  -0.5027376669  -0.2485005574
C   -0.6814145522  -0.8626197205   1.0071609614
C   -1.0927619105  -0.4600408212  -1.3106165264
C   -2.0131614680  -1.1858541424   1.2021392414
C   -2.4325792488  -0.7791305114  -1.1326212495
C    0.3398156382   2.8681214747  -0.8424029298
C   -2.8820856312  -1.1425341202   0.1234529728
C   -1.0398064672   3.3302624380   0.6214442166
H    3.9961247137  -0.7580632188  -1.0770602340
H    3.8334589062  -0.1187238360   1.9515595572
H    5.1603938493   0.3592364256   0.8062441786
H    5.5582155312  -2.0847562116   0.2838460011
H    4.2168264371  -2.5351510143   1.4257053749
H    1.9498562003  -1.5348107190   1.0756325261
H    2.0897679601  -2.4679138739  -1.8354993873
H    0.8153004920  -2.8916369813  -0.6936723973
H    2.4658184903  -3.4244842884  -0.4080899571
H    2.5705388926   1.4942733523   0.1569201428
H    1.6117281370   0.8701257891   1.4853316723
H    2.3807741774   0.4332046482  -1.9096420290
H   -0.0216876472  -0.8965310262   1.8647939347
H   -0.7654690700  -0.1775627156  -2.3000885187
H   -2.3649627480  -1.4650697457   2.1855279452
H   -3.1117718082  -0.7421625779  -1.9733028024
H    0.9313095815   2.8211178114  -1.7411744391
H   -1.8718755461   3.7827284589   1.1373277612
*