! 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  -5.6958659969  -0.1351754885   0.3671445889
O    2.5419318017  -1.1384823572  -1.5110375161
O    0.0200057328  -0.9907287868  -0.6019684443
N    1.1594682412   0.9957198109  -0.1574314502
N    1.0890481724   1.9270388288   0.8020489535
N    1.4387990290   2.8823529168  -1.1944478265
C    3.5491764110  -0.8937234258   0.7257662490
C    2.3032006488  -1.2305963558  -0.1274113646
C    1.0454550891  -0.4128818098   0.1629886919
C    3.1981363313  -0.9856042221   2.2114531844
C    4.6038387472  -1.9644478296   0.4167555000
C    4.1576142939   0.4760633349   0.4193297128
C    1.3668012175   1.5821976628  -1.3413815627
C   -1.2839297980  -0.7293554665  -0.3119955845
C    1.2659659115   3.0360774800   0.1341033161
C   -2.2122501284  -1.3449150925  -1.1483700910
C   -1.7228484594   0.0743606629   0.7329231927
C   -3.5670762241  -1.1663058524  -0.9419262673
C   -3.0850693803   0.2534421468   0.9386827989
C   -3.9983752589  -0.3644415090   0.1052142899
H    2.0191961347  -2.2580373908   0.1462266466
H    0.8272264481  -0.4662938193   1.2312597195
H    2.5319580752  -0.1844673582   2.5354774832
H    2.7237726899  -1.9383583718   2.4586307478
H    4.1029985327  -0.9071840005   2.8162368892
H    5.4661182564  -1.8421460168   1.0738272144
H    4.9824153400  -1.8986525330  -0.6057513736
H    4.2157003801  -2.9741599688   0.5696857416
H    4.3184243156   0.6240531142  -0.6490813398
H    5.1321997335   0.5566115263   0.9050040499
H    3.5568551912   1.3039746205   0.7940122460
H    3.1822524084  -1.8133693869  -1.7579022314
H    1.4465327946   1.0463268830  -2.2716005447
H    1.2668543048   3.9972404988   0.6230284730
H   -1.8693384041  -1.9705659103  -1.9621905169
H   -1.0418497047   0.5800366514   1.4021900364
H   -4.2781557643  -1.6515615138  -1.5961182563
H   -3.4180115712   0.8816852001   1.7533644107
*