! 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  -0.2725121507   0.3712332537   0.3109051756
F    5.5007129965  -0.8851269888  -0.6688031253
F   -3.5371165824  -4.6491356515   0.5306898790
N   -1.0243770392   2.8137820516  -0.8404768484
N   -2.1000180236   3.3369125259  -0.2527052117
N   -0.4726424421   4.8729281058  -0.4081858357
C   -0.9515204471   1.4025339450  -1.1553649734
C    1.5376581209  -0.0013862874   0.0088970491
C   -1.2584146288  -1.2248382985   0.3570629182
C   -0.4925739897   1.3363736654   1.8985018661
C    1.9454222137  -0.6371980922  -1.1679176978
C   -0.6608903547  -2.4847266330   0.4038581285
C    2.5194517781   0.3293679982   0.9438811608
C   -2.6550274898  -1.1642100534   0.3762071907
C    3.2765635804  -0.9404420655  -1.4079916326
C   -1.4184851042  -3.6469625010   0.4629734953
C    3.8594427603   0.0379135736   0.7265151691
C   -3.4338064776  -2.3092402952   0.4366845622
C   -0.0638244186   3.7302252899  -0.9140514612
C    4.2098106111  -0.5947703761  -0.4488544036
C   -2.7939788806  -3.5334130367   0.4770988525
C   -1.7206359758   4.5691788043  -0.0194642078
H   -0.3264113673   1.2799779889  -2.0410039805
H   -1.9502781139   1.0772307692  -1.4448416118
H   -1.5475696441   1.5264098704   2.1010341085
H   -0.0985924500   0.7772661685   2.7491610222
H    0.0166933456   2.3017079651   1.8734292367
H    1.2184665142  -0.9148711489  -1.9228858136
H    0.4179578219  -2.5798162675   0.3939027068
H    2.2522424850   0.8244166782   1.8691971980
H   -3.1652804292  -0.2078417864   0.3439184586
H    3.5812619543  -1.4364673383  -2.3198295156
H   -0.9462885922  -4.6198033903   0.4959821956
H    4.6127094616   0.2977674853   1.4583781589
H   -4.5139828114  -2.2507906081   0.4507198894
H    0.9032113618   3.5330395987  -1.3489040462
H   -2.3830982259   5.2806833773   0.4476103834
*