! 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  -3.2404695825   0.0405668911   0.1518648530
F    2.1899791950  -3.9394410116  -0.5084187040
O   -0.6084120115   1.3029362442   1.3192875945
N    1.7735275085   2.0139428297  -0.2579389273
N    2.7356997495   1.4025776792  -0.9546712821
N    3.5044704899   2.0222331804   1.0596614268
C   -1.8579193942   1.0120194941  -0.7247481655
C   -0.4837817713   0.9961889484  -0.0543665466
C    0.4102179983   2.0587544763  -0.7301322250
C   -3.9105242716   1.0212961899   1.6160324774
C   -2.6956027747  -1.6657237116   0.7289881763
C   -4.6206761907  -0.1503638901  -1.1179525670
C    0.2035440530  -0.3523446780  -0.1526649951
C    0.8396568983  -0.9253362225   0.9434271724
C    0.2724108171  -1.0142187012  -1.3753862099
C    1.5112023413  -2.1352722789   0.8322659099
C    0.9360749575  -2.2234595060  -1.5073417841
C    2.2434459561   2.3637054049   0.9395232835
C    1.5445170788  -2.7654220010  -0.3930701273
C    3.7466381308   1.4365348052  -0.1272076346
H   -2.2007652156   2.0523454868  -0.8038126981
H   -1.7852133801   0.6663579036  -1.7587751144
H    0.0018535052   3.0536135349  -0.5430974412
H    0.4333873188   1.9133128439  -1.8079903717
H   -4.1430181440   2.0506468429   1.3342089978
H   -3.2097127776   1.0583914995   2.4510880824
H   -4.8338926600   0.5732426286   1.9902173567
H   -2.2590715503  -2.2540632017  -0.0799831213
H   -3.5547171050  -2.2218645545   1.1125565730
H   -1.9566605653  -1.6129359748   1.5290748515
H   -4.2961802099  -0.7398551101  -1.9781513686
H   -4.9580888811   0.8173204357  -1.4955682435
H   -5.4903805122  -0.6525856575  -0.6888368785
H   -1.1186402577   2.1168674127   1.4022157766
H    0.8213511864  -0.4405618046   1.9084232819
H   -0.1903930139  -0.5906148501  -2.2573105150
H    1.9990935288  -2.5761722222   1.6916953418
H    0.9799186575  -2.7305343663  -2.4620986154
H    1.6533635537   2.8815460811   1.6774207520
H    4.7074362179   1.0262356753  -0.3962456386
*