! 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  -3.1265336350  -0.0033940123   0.2527929954
F    1.8252949697  -4.1811229582  -0.5339477677
O   -0.3393577110   1.3690901812   1.2627492380
N    1.8416522171   2.0793509415  -0.4002621624
N    2.1619478790   2.9952009383   0.5173502657
N    3.9000186517   1.6271698318   0.1399400545
C   -1.8008711539   1.0331736464  -0.6349931669
C   -0.3700839779   0.9872459021  -0.0914923200
C    0.4990538485   1.9623257059  -0.9167476060
C   -3.3403819359   0.5082912684   2.0525417946
C   -2.7799973809  -1.8520794847   0.1627500268
C   -4.7307738247   0.3587949697  -0.6696470662
C    0.2232574124  -0.4061410767  -0.1860405603
C    0.8046822994  -1.0349976756   0.9092501473
C    0.2183352173  -1.0778036250  -1.4072656896
C    1.3465088082  -2.3097784805   0.8006327286
C    0.7549076605  -2.3479182444  -1.5366603543
C    2.8800646355   1.2679804112  -0.6019759395
C    1.3077960725  -2.9457957642  -0.4213139912
C    3.3992631741   2.6858373983   0.8025368996
H   -2.1436298018   2.0761968477  -0.6191133082
H   -1.8147173736   0.7546477983  -1.6929608121
H    0.0555900589   2.9579916181  -0.9065656272
H    0.5523771033   1.6439805041  -1.9570803768
H   -2.4852857208   0.2240325036   2.6662327712
H   -4.2239890554   0.0279277161   2.4797610395
H   -3.4777778034   1.5867408961   2.1558222132
H   -3.6252405972  -2.4117159514   0.5714000080
H   -1.8930124000  -2.1394831747   0.7289204755
H   -2.6347256792  -2.1880573502  -0.8654286507
H   -4.9780542807   1.4222786207  -0.6431320287
H   -5.5729445285  -0.1809226439  -0.2311111744
H   -4.6679767004   0.0656610244  -1.7197353962
H   -0.7994223387   2.2110919667   1.3520573337
H    0.8395933505  -0.5467123923   1.8717528378
H   -0.2140732528  -0.6177333026  -2.2868229787
H    1.7928609695  -2.7939977480   1.6592397552
H    0.7397707091  -2.8617035046  -2.4886607049
H    2.8609173396   0.4511507775  -1.3059595589
H    3.9703241249   3.2547720481   1.5193819257
*