! 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   -4.0227250576  -2.4095816981  -0.2857524064
F   -1.9576813190  -1.8752063495  -0.5215338747
F   -2.8045970004  -2.0753647797   1.4475029303
O    4.1848815503   0.0226808496   0.8652905864
O   -0.5662779763  -0.0355780254   1.3857039220
N   -0.2490869740   0.9084326115  -0.6678968635
C    5.5874542226  -0.2077027961   0.6793715110
C   -2.4551526304   0.8160922708   0.2302203165
C    1.1269691679   0.7582527480  -0.8833656811
C    3.3926464195   0.3133969958  -0.1877824363
C   -3.4322003157  -0.1821172012   0.1907851777
C    2.0339357337   0.4354632774   0.1168147696
C   -0.9954006163   0.5043728220   0.3816364936
C    6.2359570056  -0.0013988426   2.0319741612
C    5.8358797156  -1.6029533794   0.1366060699
C    1.5752892778   0.9684044052  -2.1902029823
C    3.8424780498   0.5067680128  -1.4904602792
C   -2.8403679602   2.1500272812   0.1993234787
C   -4.7737530563   0.1683576575   0.1270815101
C    2.9194548920   0.8396456747  -2.4743683305
C   -3.0544342957  -1.6337200912   0.2091328835
C   -4.1831183378   2.4953102653   0.1478372801
C   -5.1486344756   1.5041133430   0.1130218170
H    5.9897426465   0.5390083020  -0.0125745581
H    1.7203550621   0.2861154607   1.1379311786
H   -0.7616121099   1.2742578531  -1.4573855951
H    5.8678817614  -0.7194832924   2.7665831261
H    7.3137686188  -0.1354452745   1.9453233378
H    6.0572510578   1.0052981799   2.4104958478
H    6.9054729667  -1.7583546447  -0.0062846021
H    5.3524885793  -1.7724378623  -0.8258977550
H    5.4770730669  -2.3608662928   0.8350525604
H    0.8727576182   1.2241980096  -2.9735391646
H    4.8841431580   0.4115384043  -1.7607918406
H   -2.0887792697   2.9279032905   0.2318846454
H   -5.5424958918  -0.5903489504   0.0839940825
H    3.2647069824   0.9964496877  -3.4875318169
H   -4.4692106364   3.5380497018   0.1343207188
H   -6.1972344332   1.7631698049   0.0681439433
*