! 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  -2.7301618653  -2.8488852938   0.3439659782
Cl  -5.2087202411  -1.3539588154   0.4258427735
F    2.6134836759  -0.7107721369   2.7240863349
F    3.4263192383   1.2712545185   2.3368929412
O    1.3281344013   0.3021753704  -1.7791324768
N    1.1761625977   1.0174060199   0.3607440866
N    4.9687222926  -1.3050076642  -0.8058632627
N    5.0195817046  -1.0660525380   0.4971078309
C   -1.5034935502  -0.1500754964  -1.0005111898
C   -3.4509255047   1.0294721211  -0.9364606125
C   -1.7731829305   0.1984064723  -2.4905874631
C   -3.1000495482   0.9983104622  -2.4463966978
C   -2.9305370007  -0.3283474623  -0.5386865104
C   -1.2000927483   1.1533686487  -0.2959717877
C   -2.4003744604   1.8759036099  -0.2608280217
C   -0.0560100115   1.6906453121   0.2721135831
C   -2.4920362216   3.1206134887   0.3230625376
C   -3.5382974995  -1.3652452391  -0.0007695217
C   -0.1500260862   2.9475463565   0.8817462821
C   -1.3428444681   3.6485381621   0.9084343580
C    1.8047241606   0.3812389086  -0.6558490751
C    3.1092464155  -0.2376816044  -0.3646636427
C    3.9073166838  -0.4254088746   0.7908719212
C    3.8528077730  -0.8337007893  -1.3647993942
C    3.6989523877  -0.0671722705   2.2141194227
C    6.0411601738  -2.0088572119  -1.4774940063
H   -0.8191669072  -0.9750232642  -0.8323119504
H   -4.4833485409   1.2740148375  -0.7022405373
H   -1.8866044230  -0.7179418158  -3.0701758718
H   -0.9489438780   0.7637664719  -2.9176520477
H   -3.0054372454   2.0050925311  -2.8522210931
H   -3.8883516441   0.4900825865  -3.0020714329
H   -3.4278885009   3.6632802574   0.3490843796
H    0.7293594982   3.3763874021   1.3467864540
H   -1.3769810550   4.6141614357   1.3948206481
H    1.7187912164   1.2465690581   1.1777924398
H    3.6555152843  -0.9413811664  -2.4185480592
H    4.5708104493  -0.2962910005   2.8258185811
H    5.6644723570  -2.9216872033  -1.9319621794
H    6.7997872079  -2.2621043405  -0.7449040598
H    6.4817969802  -1.3790948705  -2.2461866590
*