! 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  -5.1095624713   1.4892629236   0.5138343933
F   -1.1333025557  -3.0217493063  -0.1021097418
F   -2.5066674601  -2.4078044496  -1.6331434639
F   -0.4752320920  -1.7121443397  -1.6762960262
O    2.1686371911   1.7468867199  -0.3000786841
N    2.5547419904  -0.9584839428   0.5964093222
N    0.3200525377  -0.7671372841   0.9812734149
N    4.0183447453  -2.3162411604   1.5388604469
C    1.3243390779  -0.3578072129   0.3307122159
C    1.3290575676   0.7094555084  -0.7301245004
C    2.3844819092   2.7129678510  -1.3133776064
C   -0.9424399347  -0.2068346798   0.8126906750
C    3.4148482222   3.7182063426  -0.8486635720
C   -1.8892588691  -0.7925109211  -0.0356287748
C   -1.3100564033   0.9083930783   1.5602643504
C   -3.1706191652  -0.2664675155  -0.1287660353
C    3.7583411741  -0.7552066616  -0.0538001321
C    3.6360123767   4.7901478482  -1.9053013029
C    2.7856624669  -1.9168787892   1.5472114758
C   -1.5067999438  -1.9840077592  -0.8579502199
C   -2.5857748804   1.4350316666   1.4711700914
C   -3.5091674702   0.8412654300   0.6272063532
C    4.6346364017  -1.5988649755   0.5383729733
H    0.3077589890   1.0627816605  -0.9043358275
H    1.6773224747   0.2699324805  -1.6751439135
H    1.4415881957   3.2199237299  -1.5586706360
H    2.7314110282   2.2213477428  -2.2324006212
H    3.0858740056   4.1797298403   0.0856823624
H    4.3560916460   3.2037689157  -0.6387433033
H   -0.5888114035   1.3623326213   2.2262604871
H   -3.9049906584  -0.7088067854  -0.7868595928
H    3.8927309292  -0.0567055379  -0.8597353582
H    3.9647967610   4.3556200993  -2.8509651212
H    2.7207790091   5.3514444769  -2.1003925557
H    4.3977570892   5.5025583793  -1.5902601564
H    2.0111924104  -2.2697491851   2.2069018229
H   -2.8518583076   2.3032726352   2.0581092354
H    5.6783541935  -1.7304406776   0.3040355373
*