! 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  -0.0293815529   0.3474475676   1.4605695202
F    4.9126735066  -0.4063508036  -1.8379207480
F   -4.2455459803  -3.6718197326   0.0379963424
N   -0.5947345411   2.4422541219  -0.3141970831
N    0.4381867049   3.0987560458  -0.8395608180
N   -1.0109255514   2.5246142587  -2.4441348132
C   -0.6379253159   2.1212701727   1.0976663759
C    1.5164338487   0.0556736044   0.4436423704
C   -1.3562807218  -0.8797831724   0.9482719624
C    0.3135789561   0.2220437130   3.2972824659
C    1.4364081794  -0.2457870394  -0.9188345323
C   -1.0127378426  -2.1853582629   0.5863428897
C    2.7869071968   0.1908403132   1.0060471400
C   -2.7146828754  -0.5570832332   0.9937134786
C    2.5725733521  -0.4033700333  -1.6973585531
C   -1.9762986425  -3.1346964613   0.2791790264
C    3.9394642776   0.0370871305   0.2481973976
C   -3.6975686425  -1.4868240153   0.6856860525
C   -1.4481711715   2.0982685382  -1.2803207541
C    3.8066477160  -0.2560688264  -1.0942592718
C   -3.3053418516  -2.7631459464   0.3341109033
C    0.1447702367   3.1283786551  -2.1167141396
H   -1.6453763418   2.3034664849   1.4759790736
H    0.0078898975   2.8345356224   1.6102593532
H    0.7032295588  -0.7625561069   3.5629157970
H    1.0309018556   0.9698605671   3.6401451358
H   -0.6060742488   0.3698744663   3.8674048585
H    0.4726231557  -0.3694983922  -1.3988972525
H    0.0278659051  -2.4844755768   0.5407437209
H    2.8991596200   0.4207206538   2.0589464317
H   -3.0371927642   0.4373888579   1.2791138235
H    2.4987875365  -0.6367308237  -2.7516605499
H   -1.6971910617  -4.1433900267   0.0033700385
H    4.9194532831   0.1430679239   0.6950487015
H   -4.7462908406  -1.2220472220   0.7217856190
H   -2.3630077463   1.5568382400  -1.0950205060
H    0.7912287010   3.6070296483  -2.8359841353
*