! 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  -3.1042634557  -0.1310307387   0.0235658761
F    1.8984998444  -4.1653955860   0.0233406808
O   -0.4059124076   1.5083905452   1.1047803902
N    1.8246338582   2.0966940796  -0.4962341678
N    2.0368124993   3.1322917154   0.3183634492
N    3.8653910240   1.8453703098   0.2006978455
C   -1.7830458985   0.9648761189  -0.8058716385
C   -0.3767188468   0.9837784702  -0.1964671237
C    0.5284760079   1.8672780131  -1.0859670280
C   -4.7618643972   0.6556538430  -0.4118483267
C   -2.9556463533  -0.2253191460   1.8970823683
C   -3.0645450792  -1.8811593152  -0.6738745557
C    0.2224384523  -0.4084988810  -0.1098554100
C    0.2763987474  -1.2111148613  -1.2481686590
C    0.7615824613  -0.9051787658   1.0720154504
C    0.8387711357  -2.4766365902  -1.2162084463
C    1.3266538949  -2.1731942855   1.1255579450
C    2.9198265686   1.3348964632  -0.5525177621
C    1.3543822460  -2.9381344842  -0.0207755250
C    3.2706932064   2.9420622728   0.7097918871
H   -2.1611496742   1.9951669826  -0.8176221452
H   -1.7378302209   0.6787854615  -1.8621179548
H    0.0646516706   2.8425698384  -1.2416305904
H    0.6640949854   1.4145128146  -2.0676937431
H   -5.5987807250   0.0643599507  -0.0329028000
H   -4.8983132919   0.7536355665  -1.4914359474
H   -4.8538676432   1.6563779324   0.0172458153
H   -3.7916071384  -0.8031660439   2.3015841726
H   -2.9812542123   0.7567351396   2.3718903354
H   -2.0370401613  -0.7213308284   2.2142661113
H   -2.1805796454  -2.4362979750  -0.3551688546
H   -3.0783215294  -1.8877789220  -1.7661550103
H   -3.9388611247  -2.4449402252  -0.3374963212
H   -0.7804743266   2.3965208423   1.0755916404
H   -0.1284642930  -0.8586950970  -2.1887838550
H    0.7512691450  -0.3106035980   1.9737321816
H    0.8709927334  -3.0918091072  -2.1059121537
H    1.7424600961  -2.5523916568   2.0500682471
H    2.9855075445   0.4401508770  -1.1522415913
H    3.7645268551   3.6246278200   1.3841674965
*