! 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
F    1.5462332149   1.9988072073  -1.4760547625
F    2.2565993861   0.3529369171  -2.7165415192
O    1.0011076691  -1.0712423323   1.7044677834
N    0.6075412720  -0.9234833093  -0.5197168667
N    4.8012403241   0.3008720242   0.7798550471
N    4.5250737741   0.9412372421  -0.3475959606
C   -3.1148315378   0.9866719247   0.8416821812
C   -1.7445794128   0.3604121641   1.1888090193
C   -3.8759275759  -0.3520031674   0.9962006981
C   -2.0514836056  -0.2370456586   2.5843636067
C   -3.5172691286  -0.7179509718   2.4542173322
C   -1.7223139300  -0.7927759595   0.2231648659
C   -3.0438108876  -1.2417402597   0.1122227732
C   -3.2369536479   1.6946491609  -0.5047179335
C   -0.7210754134  -1.3964351689  -0.5150751274
C   -3.3810733275  -2.2966907612  -0.7095778874
C   -2.2081340097   2.8134035598  -0.6312530906
C   -4.6471606949   2.2459627661  -0.6879537856
C   -1.0593812008  -2.4572457658  -1.3623032897
C   -2.3681258604  -2.9001276630  -1.4564096362
C    1.3696939507  -0.7541059152   0.5814800786
C    2.7081741361  -0.1771866559   0.3694701656
C    3.2661881893   0.6648381555  -0.6194092859
C    3.7483300846  -0.3718010547   1.2540562865
C    2.6642447879   1.3014171514  -1.8150862028
C    6.1209266160   0.3669726460   1.3696854887
H   -3.4139101750   1.6929147750   1.6268809577
H   -0.8823779558   1.0235811959   1.1708497675
H   -4.9440706504  -0.3500334288   0.7832674492
H   -1.9568453336   0.5373736385   3.3471602277
H   -1.3616859267  -1.0369022050   2.8450894810
H   -3.6349592807  -1.7839843006   2.6505636603
H   -4.1730558204  -0.1868961801   3.1460679091
H   -3.0488231650   0.9744358441  -1.3081309453
H   -4.4055017201  -2.6364591693  -0.7981278319
H   -1.1858932892   2.4317406936  -0.6384180321
H   -2.3493420823   3.3715456172  -1.5587450326
H   -2.2902055128   3.5243307508   0.1949937951
H   -5.4032304599   1.4600773324  -0.6506073589
H   -4.8891244728   2.9736496471   0.0908634949
H   -4.7504723378   2.7499666504  -1.6505929731
H   -0.2871801208  -2.9297469642  -1.9570282389
H   -2.6029690508  -3.7189769715  -2.1238556479
H    1.0522182209  -0.8568111686  -1.4216689505
H    3.7993359781  -0.9470279887   2.1643265234
H    3.3633091016   1.9685334462  -2.3180645863
H    6.5714575505  -0.6220204085   1.4012457621
H    6.7390103297   1.0201806103   0.7632496988
H    6.0627306506   0.7670455951   2.3787947252
*