! 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  -3.1624690205  -0.1148425741  -0.0452453106
F    2.1250515486  -4.0953616520   0.4244610556
O   -0.5427252664   1.4922313079   0.9466399870
N    1.7751151861   2.0586834425  -0.5837103322
N    1.9240415897   3.1359023091   0.1894129974
N    3.8033905473   1.9207843902   0.1764263267
C   -1.7624665580   0.7461659654  -1.0048201268
C   -0.4030777081   0.8862676615  -0.3135991332
C    0.5107840894   1.7570793356  -1.2070436919
C   -4.6141180889  -0.1822928862  -1.2484212898
C   -3.6908198519   0.8744708168   1.4686775109
C   -2.7233311615  -1.8698379280   0.4745656345
C    0.2650502370  -0.4593056838  -0.0919853337
C    0.4007838489  -1.3534073456  -1.1521849916
C    0.7928255213  -0.8196375169   1.1434365636
C    1.0254859501  -2.5793772513  -0.9908847235
C    1.4202598183  -2.0452502155   1.3263106862
C    2.9001735526   1.3396946239  -0.5765940528
C    1.5225372468  -2.9066195564   0.2551366175
C    3.1531288151   3.0143056828   0.6198855424
H   -2.1273340852   1.7492826817  -1.2636461874
H   -1.6515419997   0.2381011321  -1.9676019798
H    0.0222909231   2.7066496791  -1.4298153848
H    0.6991960905   1.2598904331  -2.1581978103
H   -5.4923290053  -0.6419124507  -0.7887661159
H   -4.3752276403  -0.7645407246  -2.1414569477
H   -4.9102639757   0.8151098539  -1.5821413495
H   -4.6173683882   0.4690967904   1.8831978937
H   -3.8814166605   1.9226876668   1.2273932537
H   -2.9425981448   0.8487478723   2.2614661752
H   -3.5965250643  -2.3606843893   0.9128239861
H   -1.9268980947  -1.8987281239   1.2193996747
H   -2.4011491332  -2.4792849935  -0.3718032299
H   -0.9883553357   2.3396911182   0.8401131820
H    0.0139956360  -1.1078189381  -2.1333838099
H    0.7202577958  -0.1505807635   1.9884268308
H    1.1206663848  -3.2663284347  -1.8216977990
H    1.8242234760  -2.3190071524   2.2924143863
H    3.0170607330   0.4232990155  -1.1337388634
H    3.6012067590   3.7445929335   1.2759753548
*