! 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  -3.4783216676   0.6583095834   0.0302000128
F    3.3621662074  -3.8600997009  -0.4676511772
O   -0.7613887008   0.5165436313   1.3990435399
N    1.2785269558   1.7663267024  -0.2040881215
N    2.3682302625   1.4102656275  -0.8871973062
N    2.9417362598   2.4904051475   0.9876704091
C   -1.9217718702  -0.2448561316  -0.5911996965
C   -0.5815637497   0.1381735252   0.0500227998
C   -0.0400619683   1.3918165120  -0.6542460765
C   -3.9854803583   0.0306317592   1.7337514302
C   -4.8331396147   0.1940046254  -1.1969475453
C   -3.3278931706   2.5346479414   0.0693001240
C    0.4565551361  -0.9719231394  -0.0662431372
C    1.3371492486  -1.2472897724   0.9752101696
C    0.5909342484  -1.6934373304  -1.2503818912
C    2.3175227421  -2.2226424331   0.8511046988
C    1.5659743388  -2.6671272073  -1.3968351156
C    1.6343312693   2.4040409738   0.9136646064
C    2.4154120138  -2.9156741254  -0.3363583301
C    3.3388558910   1.8689936892  -0.1403752609
H   -1.8715609313  -0.1391257121  -1.6791453021
H   -2.1168098163  -1.3098274728  -0.4202018983
H   -0.7147878820   2.2337082023  -0.4974159836
H    0.0260773690   1.2187896566  -1.7262560638
H   -3.3766558617   0.4469047219   2.5378297650
H   -3.9195798699  -1.0578448151   1.7992381248
H   -5.0226369976   0.2999226093   1.9474926156
H   -4.6117635490   0.5607341810  -2.2019029210
H   -5.7980424525   0.6155234335  -0.9059656288
H   -4.9640066215  -0.8882034624  -1.2697072707
H   -2.6013409336   2.8828059827   0.8059955361
H   -4.2912761937   2.9751440845   0.3401512881
H   -3.0517690307   2.9527903084  -0.9008585067
H   -1.0596076233  -0.2493365058   1.9039543075
H    1.2772974810  -0.7014334444   1.9067855839
H   -0.0703010590  -1.5036281354  -2.0864162929
H    2.9940415147  -2.4324875775   1.6694042481
H    1.6608903241  -3.2227255174  -2.3207410021
H    0.9222698954   2.7902088246   1.6251360806
H    4.3747153156   1.7504826731  -0.4183275369
*