! 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  -3.4831453683   0.6593672392   0.0280704781
F    3.3735230927  -3.8264451604  -0.4598777603
O   -0.7662742206   0.5306989192   1.3982373151
N    1.2773285802   1.7762402920  -0.2238601106
N    2.3628538518   1.4190571996  -0.9160806148
N    2.9537614140   2.3829752086   1.0212759840
C   -1.9225759840  -0.2369142907  -0.5923265618
C   -0.5847980913   0.1556829462   0.0469398801
C   -0.0490374789   1.4119631825  -0.6596622308
C   -3.9849540057   0.0189935571   1.7294956505
C   -4.8378385977   0.1925342541  -1.1989631201
C   -3.3378101138   2.5367929998   0.0625971215
C    0.4591905514  -0.9481911770  -0.0660674871
C    1.3546445654  -1.2013033000   0.9686312572
C    0.5812696723  -1.6869755926  -1.2405512454
C    2.3386299996  -2.1732039522   0.8465202661
C    1.5600833137  -2.6572413269  -1.3849086733
C    1.6462722759   2.3364983961   0.9282544459
C    2.4240872129  -2.8837422713  -0.3316592669
C    3.3351203768   1.8045752206  -0.1328065220
H   -1.8735080548  -0.1358810852  -1.6806100487
H   -2.1119110443  -1.3015130009  -0.4137038374
H   -0.7174485553   2.2557130259  -0.4878063051
H   -0.0010172563   1.2448851253  -1.7328918307
H   -3.3764655396   0.4318784135   2.5350770872
H   -3.9085145136  -1.0693612554   1.7817842215
H   -5.0238679400   0.2784966227   1.9455170248
H   -4.6147125467   0.5601873966  -2.2028734821
H   -5.8017246152   0.6138758773  -0.9053472304
H   -4.9649523119  -0.8898504183  -1.2698191630
H   -2.6120055893   2.8891595265   0.7964426105
H   -4.3028331508   2.9751059809   0.3289418095
H   -3.0601272431   2.9459684289  -0.9107743252
H   -1.0604474287  -0.2406044209   1.8972383477
H    1.3011373044  -0.6423558314   1.8926887563
H   -0.0931817405  -1.5129411590  -2.0689652600
H    3.0258602296  -2.3692340507   1.6590606708
H    1.6459435051  -3.2270172388  -2.3006567470
H    0.9435911053   2.7148498059   1.6522143013
H    4.3687542715   1.6707960742  -0.4112640032
*