! 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   -3.4778051515   2.8492838219   0.3432549327
F   -1.5114647287   2.0579462091   0.6725602004
F   -2.2319572968   2.3692427437  -1.3340792426
O    4.5299154850  -0.1886658273  -0.1472709311
O   -0.2896622888   0.1085651518  -1.1550958592
N   -0.1754626563  -1.0176185566   0.8276785117
C    4.2749647205   0.5468802338  -1.3507620236
C   -2.3159331084  -0.5531005274  -0.1153888517
C    1.1998815878  -1.1441045244   1.0622789373
C    3.5183072779  -0.7280075624   0.5644067156
C   -3.1532940379   0.5665049595  -0.1228580815
C    2.1714847163  -0.5658009741   0.2453649824
C   -0.8230507834  -0.4376431370  -0.2050136371
C    5.5054370754   1.3935296081  -1.5993535335
C    3.9903397750  -0.3930795546  -2.5086257841
C    1.5713144284  -1.8807221681   2.1845249406
C    3.8933960766  -1.4673820677   1.6859597370
C   -2.8779147413  -1.8234749855  -0.1013587343
C   -4.5306877852   0.3963624045  -0.1245776675
C    2.9151191806  -2.0330608346   2.4831987216
C   -2.5917463832   1.9582710757  -0.1127785416
C   -4.2554172367  -1.9878042380  -0.1134392342
C   -5.0808533384  -0.8773154151  -0.1273292144
H    3.4240236508   1.2175371586  -1.1941061265
H    1.8704106666   0.0039725198  -0.6163566642
H   -0.7612704381  -1.4146153599   1.5481990624
H    5.3588160054   1.9985592755  -2.4936928570
H    5.6973950919   2.0725711496  -0.7682915386
H    6.3910418573   0.7754133475  -1.7551008232
H    3.7774285446   0.1846414701  -3.4082060739
H    3.1306210416  -1.0387138485  -2.3264642498
H    4.8534561553  -1.0284851756  -2.7138702008
H    0.8164457348  -2.3314023902   2.8166737110
H    4.9415835902  -1.5874148766   1.9268696343
H   -2.2376622186  -2.6958953385  -0.1003769452
H   -5.1930027241   1.2504612777  -0.1175011995
H    3.2037470197  -2.6050880487   3.3547935140
H   -4.6767666542  -2.9835375983  -0.1119416671
H   -6.1555670494  -0.9938163206  -0.1327791544
*