! 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  -0.0979324662   0.3147394705   1.4962291169
F    4.7358221877  -0.1252276337  -2.0015345593
F   -4.2699369497  -3.7319538962   0.0220507983
N   -0.4778489170   2.4264029934  -0.2789887181
N    0.6286657442   3.0666375641  -0.6547082881
N   -0.5508605195   2.4322533026  -2.4541327303
C   -0.7170078992   2.0821362105   1.1083113237
C    1.4262863037   0.0548146138   0.4393738126
C   -1.4167610098  -0.9230058023   0.9907336017
C    0.2966768667   0.1982916696   3.3215607988
C    1.3135330440  -0.3181753529  -0.9020099689
C   -1.0703641512  -2.2589504248   0.7658589269
C    2.6996510614   0.3491994671   0.9294534663
C   -2.7643314864  -0.5755369360   0.8778887053
C    2.4200437871  -0.3796057523  -1.7353605430
C   -2.0216653356  -3.2145402278   0.4419826141
C    3.8237196350   0.2871502043   0.1185434515
C   -3.7350739383  -1.5118445484   0.5499479668
C   -1.1597298034   2.0433570873  -1.3561821315
C    3.6569342409  -0.0712554765  -1.2044203734
C   -3.3410308053  -2.8176072525   0.3388580064
C    0.5376380305   3.0435383848  -1.9610125567
H   -1.7761220619   2.2184689085   1.3298733043
H   -0.1842134011   2.8068028940   1.7233931713
H   -0.5893894715   0.4048638292   3.9245453586
H    0.6514506970  -0.7981122857   3.5897372622
H    1.0643017412   0.9163885415   3.6154962169
H    0.3463595588  -0.5660591634  -1.3229977426
H   -0.0371031545  -2.5763726756   0.8435318995
H    2.8355570078   0.6400164689   1.9641300124
H   -3.0888177176   0.4436797374   1.0479123157
H    2.3215979051  -0.6632159939  -2.7748501235
H   -1.7419565874  -4.2457237151   0.2715485330
H    4.8068544713   0.5168170953   0.5076744287
H   -4.7754310725  -1.2280927360   0.4625318135
H   -2.0942310374   1.5070130491  -1.3010799610
H    1.2902972371   3.5012555670  -2.5834073107
*