! 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  -2.5489259543   0.3750110447  -0.0408019937
F    1.0420411458  -5.2673490308   0.1764685498
O    0.2713046594   0.7963917321   1.4040444948
N    1.8072790240   2.3185501583  -0.4652949322
N    1.3633152239   3.1075329611  -1.4494400230
N    2.0789576581   4.3441782023   0.2808533855
C   -0.8212169967   0.7379779234  -0.7533007314
C    0.3953317201   0.3293595132   0.0770311520
C    1.7183130215   0.8790664366  -0.5168437865
C   -3.7420265946   0.6556792427  -1.4723248685
C   -2.9626341746   1.6032428383   1.3303669856
C   -2.7551583745  -1.3786905968   0.6071877108
C    0.5515308292  -1.1810842852   0.1266823516
C    0.6290350611  -1.9084777313  -1.0597544267
C    0.6580178372  -1.8706889974   1.3301518373
C    0.7947834082  -3.2845491609  -1.0553774467
C    0.8203393301  -3.2493816153   1.3552849175
C    2.2207076291   3.0698812132   0.5565616236
C    0.8843066825  -3.9329706073   0.1598849919
C    1.5498161401   4.3044296422  -0.9556046566
H   -0.7959384844   1.8185943478  -0.9394199411
H   -0.7591567260   0.2920310253  -1.7494785886
H    1.8387964271   0.5708214370  -1.5537256959
H    2.5618347218   0.4789477733   0.0461062564
H   -3.5698773294  -0.0544198164  -2.2840244236
H   -3.6375322381   1.6591372431  -1.8906386106
H   -4.7806273149   0.5424701541  -1.1544527441
H   -2.4153427543   1.4063530335   2.2535588158
H   -4.0266091299   1.5573293958   1.5740210503
H   -2.7484597822   2.6314276699   1.0296820984
H   -2.1654438188  -1.5581253342   1.5064104704
H   -2.4652753877  -2.1284550636  -0.1309917737
H   -3.8028198845  -1.5579569783   0.8619623948
H   -0.1273516863   1.6728751480   1.3965905741
H    0.5579815288  -1.4091273937  -2.0176450227
H    0.6054682015  -1.3462344054   2.2728391668
H    0.8533290627  -3.8384788798  -1.9829026183
H    0.8942483361  -3.7788400039   2.2960799623
H    2.6362567951   2.6541811181   1.4606304660
H    1.2957727435   5.1903265708  -1.5160846131
*