! 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   -0.8448888133   0.9837568822  -1.8941472779
F    5.6005722543  -0.4025745968  -0.2331141004
O   -0.2240424144  -1.0832480017   1.7728189599
N   -1.9594050031  -1.5284271774  -0.6031915215
N   -2.6683031411  -1.7275008477   0.5142394581
N   -4.0374617455  -1.3883765374  -1.2225421640
C    0.0131368994  -0.5094804337   0.5091723139
C   -0.5158339842  -1.4819055256  -0.5701764980
C    1.5260982453  -0.4353908481   0.3329489679
C   -0.6337590521   0.8809961926   0.4643513355
C    2.3454172589  -1.3506407535   0.9910218481
C    2.1207200154   0.4847577434  -0.5264487445
C   -1.0371666000   1.5481524400  -0.6843822966
C   -0.8308866558   1.5653921676   1.6657330852
C    3.7207263869  -1.3445764809   0.8083620698
C    3.4927304885   0.5019166558  -0.7251515071
C   -1.6246394519   2.7990685896  -0.6741961737
C   -1.4072490479   2.8241737195   1.7090465933
C   -2.7890244841  -1.3200488102  -1.6233116721
C    4.2710830034  -0.4156646084  -0.0497112367
C   -1.8138418322   3.4432689468   0.5362160520
C   -3.9039348648  -1.6334383161   0.0920236008
H   -0.1645613787  -1.2348059393  -1.5665264469
H   -0.1293900328  -2.4749430973  -0.3355118474
H    1.9218245392  -2.0860620270   1.6591766071
H    1.5323644051   1.2173703657  -1.0595356623
H   -0.5269365885   1.0998949603   2.5920246027
H   -1.1647507492  -1.3220022555   1.8160644233
H    4.3488869502  -2.0554316161   1.3286614343
H    3.9437931222   1.2218578289  -1.3948503472
H   -1.9232387043   3.2569529740  -1.6079805349
H   -1.5412174127   3.3174913776   2.6620641252
H   -2.4512286721  -1.1485159749  -2.6323709168
H   -2.2716281457   4.4227643059   0.5584142862
H   -4.7408212499  -1.7487291353   0.7622276918
*