! 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    0.3207352547   1.0690284520  -1.7744210517
F    5.5942216782  -0.2455085439  -0.1777123900
O   -0.1891191820  -1.1013735354   1.8013655858
N   -2.1078509791  -1.5350336518  -0.3202163083
N   -2.8385918619  -0.8200182815  -1.1805724945
N   -4.1263363466  -1.5986379202   0.4823782287
C    0.0127421324  -0.5873836970   0.5017027006
C   -0.6723282472  -1.6008872142  -0.4317112421
C    1.5118804985  -0.4924380692   0.2398567402
C   -0.6659382367   0.7674139154   0.3390113282
C    2.2314007086   0.5341025657   0.8479227427
C    2.2081208776  -1.4360738543  -0.5064755224
C   -0.4924607751   1.5296973736  -0.8076445497
C   -1.5471647537   1.2619641402   1.2942732069
C    3.6072753970   0.6269451893   0.7157160530
C    3.5858688104  -1.3585009373  -0.6559106127
C   -1.1235086068   2.7380512970  -1.0131530026
C   -2.2003130245   2.4737850219   1.1149262693
C   -2.8851638106  -1.9778665818   0.6682282457
C    4.2616308353  -0.3267547814  -0.0391012813
C   -1.9876662606   3.2135427538  -0.0370966436
C   -4.0340713733  -0.8926357887  -0.6599210594
H   -0.4212660340  -1.4154942261  -1.4726082232
H   -0.3506831793  -2.6123113577  -0.1841011031
H    1.7208978642   1.2892858979   1.4334298917
H    1.6963789901  -2.2533945381  -0.9952238238
H   -1.7366178727   0.6952177365   2.1953568251
H    0.1976825803  -0.4987600622   2.4480764995
H    4.1570099661   1.4288434120   1.1898772577
H    4.1193366148  -2.0933176295  -1.2437313240
H   -0.9458443239   3.2937786398  -1.9243496922
H   -2.8778603038   2.8337230577   1.8770023445
H   -2.5202403745  -2.5854116690   1.4794618271
H   -2.4927354625   4.1584166148  -0.1845775192
H   -4.8818984856  -0.4193590301  -1.1290508874
*