! 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  -3.1631861260  -0.1847534675  -0.0964205205
F    2.1659469108  -3.8512384888   0.5693519442
O   -0.7647051443   1.7232307979   0.9337246043
N    1.7424295042   2.0494033774  -0.6328214038
N    1.9598516057   2.5301540001   0.5971306354
N    3.8382786350   1.6342569243  -0.2294656321
C   -1.8238057442   0.8354958118  -0.9814584274
C   -0.4875283895   1.0530125040  -0.2749597850
C    0.4029509885   1.9484041460  -1.1642107270
C   -4.6546785280  -0.1269785906  -1.2501299924
C   -3.6562124816   0.5348888450   1.5712044218
C   -2.6517006496  -1.9852028896   0.1215273861
C    0.2314389872  -0.2685935875  -0.0319676364
C    0.5697764039  -1.0902846564  -1.1061547333
C    0.5750518890  -0.6852891855   1.2481729599
C    1.2198219814  -2.2983422207  -0.9159245675
C    1.2273782150  -1.8931064167   1.4616354552
C    2.8623406268   1.5029381844  -1.0982013851
C    1.5365246604  -2.6797099610   0.3731726251
C    3.2269419438   2.2604631509   0.7893527408
H   -2.2581920925   1.8135483055  -1.2205436329
H   -1.6528235324   0.3525629518  -1.9485938399
H   -0.0339210961   2.9445887962  -1.2411392998
H    0.4857712276   1.5463842626  -2.1718540090
H   -5.4959866532  -0.6914729730  -0.8420085423
H   -4.4219073408  -0.5535175245  -2.2283806949
H   -4.9988300858   0.8963328557  -1.4151264796
H   -3.9030693714   1.5955503278   1.4988223158
H   -2.8641337427   0.4297372310   2.3122928392
H   -4.5389669157   0.0217780659   1.9593042961
H   -2.2994305897  -2.4208896229  -0.8154481996
H   -3.5046726946  -2.5807262257   0.4570653198
H   -1.8568819395  -2.1086393428   0.8582754238
H    0.0647235709   2.0870467423   1.2803133044
H    0.3237923493  -0.7997457652  -2.1203013137
H    0.3229756315  -0.0817150897   2.1085739757
H    1.4747270067  -2.9293704671  -1.7571264037
H    1.4862636646  -2.2118608487   2.4628845684
H    2.9283103292   1.0432185460  -2.0714236419
H    3.7294821306   2.5361152567   1.7031511813
*
