! 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 "1-OCTANOL"
end
*xyz 0 1
Si   0.4123091829   0.6746115802   0.7959458650
F    5.8810072378  -1.4199732988  -0.5058489695
F   -3.8484211560  -3.3178559856  -0.5661213268
N   -1.3609237109   2.4128393158  -0.4614025950
N   -2.0831182952   2.7756955272   0.5981527663
N   -3.4040193786   2.5067762378  -1.1872361793
C    0.0581589672   2.1636224302  -0.3504338143
C    2.1307157184   0.0417878963   0.3768024189
C   -0.8917985347  -0.6175979072   0.3977341053
C    0.3182686520   1.1773888936   2.5958075293
C    2.9934712004  -0.3956798183   1.3852409080
C   -2.1095775031  -0.6303568744   1.0826023478
C    2.5886274032  -0.0317376273  -0.9419745675
C   -0.7086839466  -1.5562851286  -0.6195398203
C    4.2582334982  -0.8902873842   1.1011966178
C   -3.1126878170  -1.5350823680   0.7672163339
C    3.8481565305  -0.5228546429  -1.2525075573
C   -1.6965931677  -2.4708508580  -0.9545052999
C   -2.1582493504   2.2454288465  -1.5150719470
C    4.6606193028  -0.9445006413  -0.2184820641
C   -2.8846052709  -2.4388689436  -0.2513617529
C   -3.3015843198   2.8259633677   0.1141742096
H    0.5558808490   3.0696083272   0.0002626408
H    0.4337458753   1.9748748356  -1.3564542776
H    1.0961043603   1.9010556560   2.8451275256
H   -0.6384798292   1.6464774668   2.8245874953
H    0.4331770454   0.3228542733   3.2638884314
H    2.6873969714  -0.3559521176   2.4236324756
H   -2.2962294398   0.0740732646   1.8836707306
H    1.9629938051   0.2967783991  -1.7636449463
H    0.2230626198  -1.5920239842  -1.1718005379
H    4.9171432446  -1.2251664194   1.8918739021
H   -4.0523549403  -1.5370485940   1.3042717916
H    4.1904536675  -0.5739497090  -2.2779727070
H   -1.5434414329  -3.1944238749  -1.7447539054
H   -1.7950862753   1.9434767151  -2.4846584292
H   -4.1452029669   3.1045314952   0.7265066205
*