! 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    2.3492332907   0.9352123341  -2.6192323036
F    2.8846991778  -1.1662452741  -2.4514328420
O    0.8864943362  -0.6039014685   1.7457121448
N    0.5425305072  -0.6367836551  -0.4865119252
N    4.6728085546   0.7547751774   0.9938459716
N    4.7197270573   0.6883508425  -0.3289267308
C   -3.3257591688   1.0644452493   0.8936468448
C   -1.9195658968   0.5193790167   1.2367894219
C   -3.9989634999  -0.3227113090   1.0060647011
C   -2.2000833737  -0.1285505202   2.6155688518
C   -3.6297791047  -0.7012196780   2.4582719174
C   -1.8120548388  -0.6114818083   0.2478668438
C   -3.1047425486  -1.1361858408   0.1115375897
C   -3.4807900650   1.8064705599  -0.4303078489
C   -0.7714587574  -1.1524347909  -0.4862984652
C   -3.3772754649  -2.1929633112  -0.7306055501
C   -2.5953034203   3.0481461910  -0.4604811167
C   -4.9379109317   2.1934413570  -0.6617121838
C   -1.0467007671  -2.2151247924  -1.3562265597
C   -2.3263068157  -2.7271125478  -1.4767763625
C    1.3039889085  -0.4263527167   0.6093057284
C    2.6878210846   0.0435862171   0.4032737473
C    3.5339984025   0.2627555245  -0.7120370370
C    3.4870022583   0.3804576398   1.4783831190
C    3.3271485612   0.0961523089  -2.1704882546
C    5.8117800129   1.2211847989   1.7554389181
H   -3.6775567212   1.7262581507   1.6956796480
H   -1.1023936048   1.2364136355   1.2412619160
H   -5.0630723529  -0.3862307441   0.7831093225
H   -2.1641671895   0.6323640419   3.3968542834
H   -1.4620666119  -0.8873984107   2.8651275794
H   -3.6788208646  -1.7774138600   2.6263852952
H   -4.3257196356  -0.2324005042   3.1557266988
H   -3.1705777689   1.1500093647  -1.2504747413
H   -4.3811089867  -2.5858842600  -0.8332690903
H   -1.5351613713   2.7995490324  -0.3952411097
H   -2.7388795639   3.6102254231  -1.3850852113
H   -2.8293024165   3.7187232569   0.3704939687
H   -5.5922926079   1.3223065722  -0.7167109105
H   -5.3074840690   2.8336581656   0.1435425344
H   -5.0537838262   2.7445041226  -1.5967590457
H   -0.2433240789  -2.6368075996  -1.9485331592
H   -2.5076587423  -3.5444690894  -2.1623745174
H    0.9850539188  -0.6316573628  -1.3889487483
H    3.2785511471   0.3773018037   2.5356625867
H    4.2389353918   0.2814449809  -2.7369917745
H    6.6566442513   1.3278643277   1.0836873236
H    5.5952459468   2.1835836926   2.2130212206
H    6.0621208694   0.5021069639   2.5307583940
*