! 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  -2.4646309223   0.4456495921  -0.2164034629
F    1.0701515494  -5.3068189050   0.3966707840
O    0.0829976914   0.7404298562   1.4979235608
N    1.7692955081   2.2960345078  -0.3725127870
N    1.3126042413   3.1091986911   0.5873905436
N    1.7935973378   4.2818791045  -1.2571095377
C   -0.6716877685   0.6903507917  -0.7987709064
C    0.4168331514   0.2901073854   0.2026511727
C    1.7979343141   0.8612633915  -0.1981007782
C   -3.5272807755   0.5798163423  -1.7704724361
C   -2.9695816582   1.8364760601   0.9534611623
C   -2.7785689861  -1.2288956200   0.5845840130
C    0.5805824943  -1.2205609710   0.2709946143
C    0.7811921573  -1.9565721050  -0.8958127655
C    0.5678906958  -1.9032523142   1.4831780509
C    0.9495015826  -3.3318087401  -0.8661343032
C    0.7292908868  -3.2814708400   1.5338452610
C    2.0368152047   3.0080247925  -1.4640803364
C    0.9149401241  -3.9727838564   0.3560060088
C    1.3469917628   4.2842192309   0.0093956425
H   -0.5919659000   1.7575643323  -1.0404454193
H   -0.5267559928   0.1785590921  -1.7536302877
H    2.1307129410   0.4381998959  -1.1434374729
H    2.5386225845   0.6044587201   0.5602931364
H   -4.5909846522   0.5094044703  -1.5324038808
H   -3.2994533970  -0.2145843531  -2.4845653609
H   -3.3719582268   1.5319374561  -2.2829134999
H   -2.5245799306   1.7322901157   1.9430868450
H   -4.0538992114   1.8600251583   1.0827624374
H   -2.6710307958   2.8110102040   0.5599868812
H   -3.8488526208  -1.3623065125   0.7606303765
H   -2.2741974812  -1.3310194906   1.5454651096
H   -2.4471633996  -2.0520219173  -0.0509588063
H    0.1715485315   1.7058468850   1.5107702760
H    0.8105233963  -1.4652136118  -1.8601219454
H    0.4222336089  -1.3720256037   2.4118578858
H    1.1036772749  -3.8907832501  -1.7795651643
H    0.7088387303  -3.8050112001   2.4807204090
H    2.4093584073   2.5653058543  -2.3739335394
H    1.0377952673   5.1777438189   0.5283549690
*
