! 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    0.7627907245   2.0133506091   1.9159700408
F    4.2016203019  -1.6985656193  -1.0676057303
O   -1.2361004270  -0.0883013504   1.7249197483
N   -1.6872259551  -1.8222405197  -0.5132423559
N   -0.9981509342  -2.4397224610  -1.4777605602
N   -1.5857456823  -3.8989476376   0.1216588249
C   -0.8449029936   0.2972802308   0.4257039860
C   -1.8542269574  -0.3901419520  -0.5111379735
C    0.5492099582  -0.2045627079   0.0721561010
C   -0.9222219183   1.8148219900   0.2862595652
C    1.1394122454  -1.2443795123   0.7801595377
C    1.2163637449   0.3163574083  -1.0319207015
C   -0.0938528158   2.6131649065   1.0671422498
C   -1.7943801895   2.4799751317  -0.5703229442
C    2.3739907822  -1.7540060810   0.4032251799
C    2.4484488920  -0.1802355028  -1.4253035923
C   -0.0951292034   3.9899230922   1.0181107503
C   -1.8223122115   3.8668650517  -0.6426770181
C   -2.0185383884  -2.7011194660   0.4332927782
C    3.0063739370  -1.2114319353  -0.6954602526
C   -0.9733424022   4.6224599894   0.1492837251
C   -0.9671723477  -3.6740979979  -1.0525872164
H   -2.8743435299  -0.1535418169  -0.2070759928
H   -1.7205757527  -0.0583388848  -1.5373922924
H    0.6455395767  -1.6847685855   1.6358979509
H    0.7777902835   1.1212039495  -1.6086392858
H   -2.4693504629   1.9239964603  -1.2058628508
H   -0.5471338811   0.1453745820   2.3575875096
H    2.8302146422  -2.5624198378   0.9589312611
H    2.9628850069   0.2296130216  -2.2841460213
H    0.5781108091   4.5554124918   1.6485907699
H   -2.5099114596   4.3514879204  -1.3219431055
H   -2.5881935275  -2.4397867331   1.3093515599
H   -0.9881461297   5.7023659051   0.0960456197
H   -0.4832540567  -4.4525640795  -1.6211691405
*