! 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
Si  -3.1563221490  -0.0867126392   0.1795245307
F    1.8829432626  -4.0946776470  -0.4723122905
O   -0.3609635421   1.5206104448   1.3146384420
N    1.8198463180   2.0754614707  -0.3912261922
N    2.2245353772   2.9687901321   0.5147386929
N    3.9083895992   1.5884184627  -0.0278027463
C   -1.8470109257   1.0975316895  -0.5477707046
C   -0.4125038254   1.0334447322  -0.0076401428
C    0.4494062898   2.0020322866  -0.8364929735
C   -2.8197670637  -0.5516344607   1.9780250301
C   -3.2658498936  -1.6664473709  -0.8387400704
C   -4.8008073311   0.8248229778   0.0866393355
C    0.1807299808  -0.3656565756  -0.1099651446
C    0.8741258554  -0.9388417006   0.9511746565
C    0.0940328459  -1.0805066183  -1.3039045126
C    1.4463377675  -2.1994385351   0.8409938001
C    0.6662211291  -2.3351112676  -1.4378532929
C    2.8290037528   1.2576388714  -0.6938207224
C    1.3312640890  -2.8756081161  -0.3545233870
C    3.4764136641   2.6391221859   0.6942344038
H   -2.2066880868   2.1230260612  -0.4109230305
H   -1.8524218657   0.9390897401  -1.6309938322
H    0.0304250323   3.0066267077  -0.7927482935
H    0.4458051837   1.6931553970  -1.8806310370
H   -3.6218700010  -1.2049638522   2.3299564100
H   -2.8070260215   0.3062247681   2.6547040551
H   -1.8898568808  -1.1097328090   2.1080529636
H   -2.3924636852  -2.3063632955  -0.7066301813
H   -3.3562744865  -1.4500353854  -1.9052903190
H   -4.1443002769  -2.2481863483  -0.5500831787
H   -5.6241861711   0.2006519712   0.4398381536
H   -5.0363326943   1.1256384893  -0.9364542973
H   -4.7901537981   1.7298021010   0.6977112703
H   -0.9250123768   0.9736264781   1.8723098645
H    0.9832579116  -0.4076839176   1.8865476469
H   -0.4247673815  -0.6641743994  -2.1582504108
H    1.9777945189  -2.6401349221   1.6741345825
H    0.5928354518  -2.8819340418  -2.3685067572
H    2.7434047307   0.4570350406  -1.4116143733
H    4.1107661611   3.1866145207   1.3735092301
*