! 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    2.3660347102   0.1526950924  -2.6979061301
F    3.2877929685   2.1037743834  -2.3707824806
O    0.8913076713  -0.9233812857   1.8395209304
N    0.5460968580  -0.8994936212  -0.4027512358
N    4.7427478832   0.3137155872   0.8270568080
N    4.4600956524   0.8998996900  -0.3296692669
C   -3.2663543617   0.9651151868   0.8200457864
C   -1.8869012773   0.3882678150   1.2167399985
C   -3.9916141591  -0.3902921978   0.9918020558
C   -2.2117266004  -0.1778710846   2.6210244495
C   -3.6586319326  -0.7065470922   2.4675049526
C   -1.8076602182  -0.7920939943   0.2856101851
C   -3.1143986511  -1.2785134605   0.1530926994
C   -3.3664523745   1.6399756715  -0.5444024749
C   -0.7747265637  -1.3939849212  -0.4096413873
C   -3.4078716623  -2.3618487889  -0.6479628722
C   -2.4572389398   2.8631179431  -0.6081202094
C   -4.8076525452   2.0384010118  -0.8447487719
C   -1.0682282083  -2.4857961005  -1.2350908053
C   -2.3630608422  -2.9612232530  -1.3524993321
C    1.2907167504  -0.6848678129   0.7094494276
C    2.6402100560  -0.1487935050   0.4763919184
C    3.1931955084   0.6308109025  -0.5624298576
C    3.6902452617  -0.3163178315   1.3553390806
C    2.5213986409   1.1619785236  -1.7788080648
C    6.0737062003   0.3922982143   1.3906613887
H   -3.6090021401   1.6807808852   1.5787336890
H   -1.0431014362   1.0747521577   1.2002187132
H   -5.0540089578  -0.4260356080   0.7553866459
H   -2.1604519035   0.6206003720   3.3628137370
H   -1.5052998724  -0.9479490257   2.9227245736
H   -3.7499126894  -1.7700213738   2.6894797413
H   -4.3476005886  -0.1781816896   3.1281257801
H   -3.0418549909   0.9371011405  -1.3190369460
H   -4.4224683895  -2.7256085441  -0.7528738996
H   -1.4052535327   2.6019481001  -0.4823002323
H   -2.5504346320   3.3727170149  -1.5687542835
H   -2.7130980902   3.5846693193   0.1722059072
H   -5.1966374124   2.7153354876  -0.0796708497
H   -4.8806003062   2.5531147687  -1.8045485498
H   -5.4728636099   1.1749643020  -0.8900695317
H   -0.2702478960  -2.9559056242  -1.7973179015
H   -2.5614558553  -3.8016555172  -2.0048113480
H    1.0360862910  -0.9702779267  -1.2811738953
H    3.7490627056  -0.8442519890   2.2934656202
H    1.5360118247   1.5831578493  -1.5792683737
H    6.5089490846  -0.6006903493   1.4723684231
H    6.6909423921   0.9981505670   0.7362310449
H    6.0399171187   0.8519992574   2.3751987532
*