! 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  -3.1873123418   0.0692207781   0.1708307784
F    2.0884242589  -4.0986114753  -0.3618905207
O   -0.4940676822   1.3420337494   1.2000410320
N    1.8260995310   2.0062545709  -0.3848353231
N    2.1399779901   2.8644503315   0.5891635766
N    3.8799516372   1.5195085472   0.1415449173
C   -1.8042375373   0.9541460594  -0.7910401550
C   -0.4148974473   0.9430523618  -0.1499323688
C    0.4921273809   1.9225114420  -0.9277711268
C   -3.7671267135   1.1162417133   1.6271751322
C   -2.6859591783  -1.6387515396   0.7826662553
C   -4.6213813007  -0.1104254018  -1.0398729822
C    0.2252677738  -0.4326288484  -0.1785118481
C    0.2609785006  -1.1603893059  -1.3658809891
C    0.8534481721  -0.9690680335   0.9406146934
C    0.8852474011  -2.3953726380  -1.4401341947
C    1.4817260443  -2.2059468245   0.8880141667
C    2.8652655360   1.2071489694  -0.6275413392
C    1.4841815033  -2.8996865604  -0.3031071497
C    3.3750251790   2.5363223167   0.8637876032
H   -2.1250018521   1.9963064986  -0.9197083891
H   -1.7667014616   0.5497817330  -1.8058045403
H    0.0630804289   2.9246774119  -0.9126288034
H    0.5641376564   1.6193342430  -1.9715284838
H   -4.6961984539   0.7178469452   2.0413603368
H   -3.9643484803   2.1477506002   1.3271067791
H   -3.0371645614   1.1424712643   2.4370125000
H   -1.9245209902  -1.5902860919   1.5617421947
H   -2.2916397498  -2.2644212814  -0.0200179431
H   -3.5530081799  -2.1535615681   1.2042731977
H   -5.4927291625  -0.5600977587  -0.5587704526
H   -4.3552083492  -0.7440035935  -1.8886889778
H   -4.9351189901   0.8557604952  -1.4410538139
H   -0.9306806322   2.2005327931   1.2389916817
H   -0.1971477690  -0.7697077246  -2.2653023178
H    0.8634267647  -0.4320804497   1.8775994506
H    0.9035628293  -2.9518170522  -2.3678001175
H    1.9634959343  -2.6172485422   1.7652579920
H    2.8493990974   0.4341140601  -1.3796344795
H    3.9413023836   3.0592166265   1.6184961814
*