! 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  -0.6612829868   0.4364861792   0.7430880642
F    4.9746649071  -0.2257021564  -1.1562190801
F   -3.7015746377  -4.7198464292   1.0405288415
N   -0.5346307892   2.5465076043  -1.0526631094
N    0.2454194966   2.3161543237  -2.1061811524
N    0.7672732690   4.2801968884  -1.1705758363
C   -1.4752397736   1.5487638833  -0.5868755077
C    1.1122266734   0.1555746144   0.2132151426
C   -1.6086773176  -1.1807459737   0.8148409564
C   -0.7166882142   1.3402966262   2.3845875733
C    2.1422706108   0.9401144567   0.7348479198
C   -2.9406420535  -1.2603751192   0.4003084236
C    1.4349746986  -0.7656356362  -0.7860797154
C   -1.0121873327  -2.3419878339   1.3138882983
C    3.4482750130   0.8229643780   0.2803308153
C   -3.6571690359  -2.4464063332   0.4726548628
C    2.7330255221  -0.9071395974  -1.2515508207
C   -1.7073937500  -3.5395363103   1.3958139036
C   -0.2097633886   3.7149389466  -0.4971746766
C    3.7158493322  -0.1017030004  -0.7084481673
C   -3.0212786174  -3.5663077711   0.9701653020
C    1.0066367289   3.3824148159  -2.1425086205
H   -1.7980400068   0.9743263520  -1.4552031742
H   -2.3586692823   2.0582329550  -0.1978496106
H   -0.2305620263   0.7653020978   3.1751684602
H   -0.2296151808   2.3169341492   2.3458354997
H   -1.7506546826   1.5090302441   2.6923501203
H    1.9404124482   1.6656163466   1.5136292006
H   -3.4497287166  -0.3879549171   0.0075500926
H    0.6654258858  -1.3936041887  -1.2203132072
H    0.0195709922  -2.3277518234   1.6458625877
H    4.2396679629   1.4391215621   0.6872487473
H   -4.6875200566  -2.4978853763   0.1451962146
H    2.9761365783  -1.6243797503  -2.0249969077
H   -1.2364011935  -4.4349952449   1.7804223865
H   -0.7113824920   4.1139567022   0.3710151488
H    1.7603252432   3.5165577831  -2.9030555908
*