! 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   0.3371941589   0.4169097211   1.3862721878
F    5.4314236217  -0.7900401805  -1.5268442079
F   -4.2765370253  -2.8487717825  -0.5896803668
N   -1.0130123719   2.3217641402  -0.1269349058
N   -0.4120477454   2.2683504351  -1.3159155025
N   -2.6427086524   2.2772164594  -1.5685198505
C   -0.2700332832   2.2068122745   1.1079880851
C    1.8984179595   0.0658221632   0.4090105051
C   -1.0561190826  -0.6814217571   0.7822038131
C    0.6521280578   0.2073446739   3.2203698229
C    2.2042210459  -1.2366803758   0.0059090661
C   -2.0536419685  -1.1209980184   1.6548266050
C    2.8309844950   1.0679030629   0.1322254797
C   -1.1875733528  -1.0007443566  -0.5722598546
C    3.3899127457  -1.5378720215  -0.6490432452
C   -3.1436142999  -1.8530210995   1.2049053556
C    4.0254528797   0.7919987078  -0.5177768207
C   -2.2674494404  -1.7297630366  -1.0463992937
C   -2.3329640420   2.3078295998  -0.2910973039
C    4.2800073460  -0.5115343068  -0.8965029725
C   -3.2270987865  -2.1415090746  -0.1426707917
C   -1.4297628130   2.2482825479  -2.1426658127
H   -0.9457214910   2.4720670555   1.9233459658
H    0.5279927590   2.9509307084   1.1210618792
H   -0.2247139627   0.4526711717   3.8217089840
H    0.9498598616  -0.8141786252   3.4618156373
H    1.4606582491   0.8672413048   3.5410673703
H    1.5101340939  -2.0464167391   0.1984622671
H   -1.9938520718  -0.8967080648   2.7131744499
H    2.6390361681   2.0931245307   0.4241491451
H   -0.4386481019  -0.6804227747  -1.2861610590
H    3.6150082338  -2.5498990376  -0.9589542641
H   -3.9108471879  -2.1908504292   1.8889747238
H    4.7419615012   1.5758406422  -0.7257928805
H   -2.3592265111  -1.9712108509  -2.0972212420
H   -3.0252067257   2.3338584618   0.5358604670
H   -1.2839716217   2.2191608712  -3.2115149750
*