! 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   0.4427541750   0.6874781164   0.8747538187
F    5.8645010311  -1.3955934530  -0.6081048248
F   -3.9395645507  -3.0976367166  -0.6679769570
N   -1.3447538528   2.3609985931  -0.4318471054
N   -2.1707438503   2.7584113618   0.5356026263
N   -3.3372825003   2.0837618953  -1.2576348719
C    0.0762966098   2.2239826419  -0.2072783761
C    2.1452062623   0.0524323799   0.4090029296
C   -0.8875181197  -0.5616959644   0.4315763961
C    0.3623573701   1.1263204620   2.6903003419
C    3.0238460574  -0.4293320242   1.3825022816
C   -2.0971978080  -0.5811411818   1.1304643715
C    2.5737927446   0.0261921316  -0.9214046794
C   -0.7454017324  -1.4363047402  -0.6475524176
C    4.2789386652  -0.9207166272   1.0525218244
C   -3.1327042404  -1.4302301581   0.7692410979
C    3.8227112535  -0.4605693834  -1.2772029377
C   -1.7651934773  -2.2970046943  -1.0270811893
C   -2.0497494069   1.9454351965  -1.4790380695
C    4.6529335115  -0.9258010549  -0.2766406170
C   -2.9439955858  -2.2719794838  -0.3084862390
C   -3.3482618677   2.5774200195  -0.0105342221
H    0.4549104634   3.1391393146   0.2487419533
H    0.5553612464   2.1462982963  -1.1834167698
H   -0.5930775039   1.5894628085   2.9414240450
H    0.4796814545   0.2494615752   3.3290117434
H    1.1443372513   1.8400411355   2.9551260562
H    2.7391518709  -0.4264938079   2.4275918435
H   -2.2525605028   0.0744752304   1.9780026516
H    1.9335484919   0.3917756876  -1.7155104965
H    0.1778935583  -1.4641863173  -1.2138648965
H    4.9520028200  -1.2892834139   1.8152818379
H   -4.0659473255  -1.4369618566   1.3167100533
H    4.1425552261  -0.4739297211  -2.3107192526
H   -1.6439125242  -2.9723821653  -1.8637430749
H   -1.5910568940   1.5693512943  -2.3792425011
H   -4.2559034960   2.8245804847   0.5171729441
*