! 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  -0.5795698606   0.3427038894   0.8018677178
F    4.8459851443  -0.3738216174  -1.6462290318
F   -3.7157390653  -4.7489759432   0.4328366983
N   -0.5340110128   2.7953992280  -0.5036920640
N   -0.2842742395   3.6931577411   0.4514515775
N    1.0089159003   4.0811714856  -1.3406321975
C   -1.4196543987   1.6720066167  -0.2825438134
C    1.1259270529   0.0824218324   0.0602988271
C   -1.5904598864  -1.2305481259   0.6790174875
C   -0.4411180805   0.9084042192   2.5794287220
C    1.3916303611  -0.9674521855  -0.8204853180
C   -1.6743583207  -2.1018720054   1.7680924038
C    2.1650854008   0.9734645066   0.3435287300
C   -2.2545234584  -1.5931164515  -0.4956988827
C    2.6407971004  -1.1321730108  -1.4023618834
C   -2.3855899481  -3.2906928344   1.6972851420
C    3.4216768240   0.8316196584  -0.2260592036
C   -2.9753234404  -2.7747239184  -0.5906759054
C    0.2489025086   3.0299848263  -1.5531868906
C    3.6330650722  -0.2240588751  -1.0911566336
C   -3.0243026355  -3.6025355039   0.5132835250
C    0.6401919065   4.4407728050  -0.1009755616
H   -1.6715639596   1.2625323547  -1.2618425946
H   -2.3509603165   2.0353217503   0.1535119865
H   -1.4246662391   0.9956727758   3.0430249353
H    0.1516278507   0.2128206036   3.1769167334
H    0.0357667497   1.8873001209   2.6494780873
H    0.6178477108  -1.6850837185  -1.0658658812
H   -1.1792026650  -1.8628334132   2.7012533712
H    2.0104395233   1.8025019880   1.0246003748
H   -2.2175086230  -0.9551810341  -1.3702039601
H    2.8366775595  -1.9505493235  -2.0823983327
H   -2.4441810076  -3.9580034193   2.5467593025
H    4.2190546995   1.5271451342  -0.0001945811
H   -3.4863296114  -3.0450513071  -1.5050852703
H    0.2287726480   2.4232080912  -2.4443251528
H    1.0603326587   5.2883677353   0.4176223954
*
