! 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   -1.2850733820   2.0619216916  -0.5156944784
F   -1.0894308759   0.4280558073  -1.9020697014
F   -2.6274684515   1.8977561969  -2.1836872662
O    4.3813271581  -0.8844856282  -0.4785951420
O   -1.1896696564   0.9520723181   2.4865479766
N   -0.1700511267  -0.3738330888   0.9363775063
C    3.9999475010  -1.3038495249  -1.7955786394
C   -2.5468707575  -0.0851574741   0.8503577277
C    1.1923236031  -0.2016282132   1.2262451553
C    3.4512511577  -0.4964770659   0.4170827287
C   -2.9201310482   0.3684967436  -0.4172960105
C    2.0798985466  -0.6120196827   0.2282011116
C   -1.2325091379   0.2363605793   1.5017733176
C    3.6243482817  -0.1083902237  -2.6527592663
C    5.1860222520  -2.0560105323  -2.3611575490
C    1.6704457043   0.3246123919   2.4204453627
C    3.9366534945   0.0434426645   1.6103646575
C   -3.4514209690  -0.8221663885   1.6046793418
C   -4.1780526537   0.0572732454  -0.9191870986
C    3.0458565357   0.4390839218   2.5878915033
C   -1.9844788206   1.1901753651  -1.2538836670
C   -4.7015634157  -1.1370963117   1.0964566483
C   -5.0636450104  -0.6980011197  -0.1666669083
H    3.1553752831  -1.9971962784  -1.7276088309
H    1.6718364479  -1.0157302245  -0.6892776807
H   -0.3654581212  -0.9780860583   0.1519852963
H    2.7846359814   0.4552513806  -2.2454448525
H    4.4699828760   0.5732001235  -2.7575370991
H    3.3369379592  -0.4440219268  -3.6491673046
H    4.9449202510  -2.4216640060  -3.3588255325
H    5.4425177872  -2.9185155382  -1.7456067505
H    6.0643612090  -1.4138128673  -2.4434303118
H    1.0088939321   0.6317951993   3.2122693196
H    5.0037303400   0.1418878531   1.7617631189
H   -3.1712393935  -1.1629529509   2.5926604188
H   -4.4852735936   0.4055930072  -1.8952930142
H    3.4268839920   0.8484485127   3.5141081891
H   -5.3917399029  -1.7196475074   1.6910263445
H   -6.0396139369  -0.9324562732  -0.5682304655
*