! 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  -2.4560173975   0.3929108789   0.0549603933
F    0.6046603071  -5.2496769335  -0.5483890683
O    0.3978152917   0.5589167668   1.6648307008
N    1.8836066438   2.3267954278  -0.2104867583
N    1.6615230126   2.9939502649   0.9258085054
N    2.0433654332   4.4225500856  -0.7476336922
C   -0.7073934699   0.9419327880  -0.4525087896
C    0.4889901719   0.3227710515   0.2812123988
C    1.8292825970   0.8828836741  -0.2520347150
C   -2.8123480424   0.7527462284   1.8683390094
C   -2.7991232858  -1.4238572270  -0.3065549377
C   -3.6127000236   1.4334406776  -1.0128811510
C    0.5341844769  -1.1822124679   0.0753566231
C    0.5583875833  -1.7098606866  -1.2150068569
C    0.5472556851  -2.0666784567   1.1492145330
C    0.5844817533  -3.0772308378  -1.4368114416
C    0.5680430148  -3.4408185077   0.9470800019
C    2.1052482211   3.1910780200  -1.1994724923
C    0.5847417129  -3.9220100512  -0.3444851132
C    1.7657244812   4.2469241008   0.5560709310
H   -0.6923822932   2.0308278284  -0.3170978942
H   -0.6107129763   0.7936836962  -1.5335852724
H    1.9846167569   0.5906262211  -1.2890586753
H    2.6562503860   0.4786700317   0.3355316563
H   -3.8774349591   0.6258798664   2.0799958916
H   -2.5501499767   1.7782428073   2.1392644367
H   -2.2638286213   0.0862884717   2.5358310004
H   -2.5944583756  -1.6770750204  -1.3488980773
H   -3.8535863789  -1.6487611943  -0.1216064074
H   -2.2106784948  -2.0992669943   0.3169492596
H   -3.4678953443   2.5036790048  -0.8448657963
H   -4.6619498070   1.2125297187  -0.8023301788
H   -3.4517117549   1.2489575520  -2.0781771651
H    0.5568878652   1.5014850762   1.8213537833
H    0.5494456642  -1.0550878858  -2.0781282142
H    0.5304457107  -1.6960188340   2.1640267092
H    0.6011470051  -3.4766630435  -2.4427818792
H    0.5698567616  -4.1233310991   1.7874587093
H    2.3064127413   2.8846167611  -2.2142679246
H    1.6358959454   5.0603973916   1.2532408533
*