! 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  -2.4278761353   0.3260263593   0.1080835415
F    0.4772397656  -5.1847639562  -0.8813789873
O    0.5019151385   0.4800876757   1.6875659098
N    1.8992649894   2.3509699695  -0.1544984413
N    1.7379385447   2.9534028265   1.0277951506
N    2.0333154102   4.4746579915  -0.5806178328
C   -0.7055716034   1.0016462149  -0.3413666314
C    0.5201257457   0.3282101598   0.2900201365
C    1.8372725606   0.9113895269  -0.2733770731
C   -2.6697539255   0.0606857499   1.9566700192
C   -2.8183710510  -1.2824752452  -0.7961324554
C   -3.6349256147   1.6547863297  -0.4760555281
C    0.5285301447  -1.1615775889  -0.0098308312
C    0.5136962256  -2.1104684097   1.0071509620
C    0.5310811567  -1.6103662304  -1.3295466896
C    0.4917655458  -3.4694794213   0.7206964451
C    0.5165917851  -2.9613068800  -1.6351041893
C    2.0688186760   3.2703884294  -1.1032842155
C    0.4945208611  -3.8727388033  -0.5975487003
C    1.8224832600   4.2248995243   0.7226151365
H   -0.7108188574   2.0646397069  -0.0721387637
H   -0.6284137591   0.9872265794  -1.4344757629
H    1.9483718624   0.6782051614  -1.3307821045
H    2.6877152801   0.4743675612   0.2538180121
H   -2.4289627303   0.9522628717   2.5384138507
H   -2.0588448256  -0.7574509909   2.3399738709
H   -3.7136475653  -0.1897283394   2.1636494105
H   -2.2338636506  -2.1247930689  -0.4224714050
H   -2.6329165319  -1.2043747008  -1.8694224278
H   -3.8734223533  -1.5399795674  -0.6697441283
H   -3.4733911555   2.5986970753   0.0503923070
H   -4.6734256782   1.3630274959  -0.3040741914
H   -3.5285987529   1.8590195482  -1.5441483872
H    0.6726834264   1.4112398313   1.8921464760
H    0.5134965581  -1.8056532929   2.0432323018
H    0.5310545117  -0.9069347270  -2.1531281544
H    0.4759004851  -4.1994819533   1.5197276654
H    0.5166599838  -3.2957183191  -2.6642971954
H    2.2176885893   3.0201253110  -2.1419187600
H    1.7321215400   4.9959571603   1.4718575865
*