! 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  -5.2996054935   1.2623587250  -0.4795146306
F   -0.1746627677  -1.0727664791   1.7312399636
F   -2.1220999657  -1.9277304273   2.0194516468
F   -0.8405421282  -2.6879574689   0.4762689698
O    2.3480426490   2.0195268195   0.2541667113
N    2.5397154940  -0.4208111385  -1.2091238584
N    0.2812609132  -0.5399989881  -1.0809764201
N    4.6817879383  -0.7049984337  -1.6613316808
C    1.3068966531   0.1948827354  -0.9793160124
C    1.3296599482   1.6706158380  -0.6365358876
C    2.1756669521   1.5015126212   1.5625285452
C   -1.0091969211  -0.0601422890  -0.9051522540
C    3.3538787690   1.9246100564   2.4109704469
C   -1.8148207672  -0.5729304451   0.1195613518
C   -1.5653088453   0.8528176357  -1.7982084072
C   -3.1312969752  -0.1570129270   0.2538137253
C    2.7430274091  -1.7837874870  -1.3143635633
C    3.2167393428   1.4209415811   3.8391638968
C    3.7548484188   0.1719672763  -1.4294097066
C   -1.2402838393  -1.5654515699   1.0836371263
C   -2.8798304657   1.2645880734  -1.6735278310
C   -3.6540998653   0.7574653490  -0.6444614238
C    4.0597995319  -1.9308731033  -1.5873442029
H    0.3445629304   1.9516493499  -0.2475713858
H    1.4868748156   2.2415782995  -1.5557674048
H    2.1159904436   0.4056348206   1.5452176623
H    1.2349284628   1.8706318647   1.9921209426
H    4.2720874651   1.5348090634   1.9634296247
H    3.4331508333   3.0145380545   2.4089856156
H   -0.9642580300   1.2349999911  -2.6129156858
H   -3.7554972414  -0.5384372104   1.0492537657
H    1.9501734914  -2.4962645204  -1.1725160178
H    4.0773318573   1.7126406762   4.4404490363
H    2.3265322804   1.8273301593   4.3217745531
H    3.1453769320   0.3326438341   3.8759456771
H    3.9011077074   1.2374549491  -1.4345865654
H   -3.2894286270   1.9751689575  -2.3778746172
H    4.6022584048  -2.8512111975  -1.7301565849
*