! 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  -0.4833690236   0.4516324989  -2.1784588359
F    5.1267721184  -0.5741179335  -0.3251271983
O   -0.4485894268   0.0081242612   2.3341131379
N   -3.3333096974  -1.9919756635  -0.3924755978
N   -1.7657774116  -3.5161949427   0.4990420639
C   -0.3500196328  -0.0524615709   0.9242091335
C    1.1205243543  -0.2458771465   0.5393911225
C   -0.8011100109   1.3121500786   0.4009370077
C   -1.2671267872  -1.1825522107   0.4745493193
C    2.0564663296   0.5872746705   1.1528449955
C    1.5752456347  -1.1871424414  -0.3760112099
C   -0.8483811078   1.6294531519  -0.9585432663
C   -1.1429990100   2.3255781308   1.2946996121
C   -2.5106559533  -0.9900222539  -0.1066843327
C   -0.9595905601  -2.5022646096   0.7814554311
C    3.4071183863   0.4871644543   0.8671489844
C    2.9265695696  -1.3082262776  -0.6711035400
C   -1.2075983833   2.8916235897  -1.4064452203
C   -1.5024538303   3.5924129616   0.8601461834
C    3.8194196468  -0.4669962330  -0.0430606480
C   -1.5327274205   3.8805783025  -0.4934904268
C   -2.9121254299  -3.2072757749  -0.0864154746
H    1.7376874591   1.3382947901   1.8638717279
H    0.8883082913  -1.8444992810  -0.8896247417
H   -1.1258933143   2.1309740581   2.3559015991
H    0.0011048101  -0.7586279984   2.7081840714
H   -2.8766164241   0.0019816618  -0.3422060562
H   -0.0286386506  -2.7620213340   1.2738259461
H    4.1243335342   1.1405122421   1.3457878020
H    3.2696346269  -2.0461575136  -1.3837826322
H   -1.2325421040   3.0980129792  -2.4676139239
H   -1.7570852344   4.3511258504   1.5874753030
H   -1.8094024419   4.8649580341  -0.8453103728
H   -3.5735273176  -4.0295254576  -0.3283207793
*