! 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  -0.6161294194   0.4520951519   0.8279361681
F    4.8707303396  -0.3298704154  -1.4355091019
F   -3.7314479838  -4.6701898228   0.9023969295
N   -0.5543985418   2.6249363419  -0.8792964061
N    0.1052515360   3.4265348546  -0.0425677828
N    0.8663029988   3.6878208244  -2.1364776994
C   -1.4899971022   1.6355509233  -0.3948937913
C    1.1057227089   0.1787437337   0.1460918792
C   -1.5815612901  -1.1587391855   0.8136257371
C   -0.5676779268   1.1703017090   2.5543468591
C    2.2405440103   0.5939719301   0.8429016070
C   -2.9779234091  -1.1530416533   0.7520183494
C    1.2865315936  -0.4041104659  -1.1112589164
C   -0.9393602361  -2.3955520511   0.9037461639
C    3.5158818711   0.4269425813   0.3212412832
C   -3.7134955924  -2.3289794584   0.7802894027
C    2.5497877578  -0.5807487548  -1.6552424474
C   -1.6527476737  -3.5858734990   0.9348227177
C   -0.0822909740   2.7785152737  -2.1125286261
C    3.6423280825  -0.1598938969  -0.9215876327
C   -3.0307408521  -3.5260614267   0.8730075736
C    0.9379678999   4.0440563354  -0.8440559901
H   -1.8585174546   1.0827465089  -1.2598568821
H   -2.3526166223   2.1355307563   0.0496334821
H   -0.0883171264   0.4844801322   3.2548209938
H   -0.0351020107   2.1206684941   2.5879227465
H   -1.5818618049   1.3484228952   2.9177375160
H    2.1447362431   1.0575541411   1.8169423414
H   -3.5221293489  -0.2182846145   0.6794764174
H    0.4317861848  -0.7396765372  -1.6878708914
H    0.1419304848  -2.4474583691   0.9494990350
H    4.3910925772   0.7471920846   0.8711536584
H   -4.7943322142  -2.3134254894   0.7314669299
H    2.6821442974  -1.0369203865  -2.6274816592
H   -1.1455681416  -4.5392406491   1.0045487176
H   -0.4579593347   2.2191590447  -2.9552578493
H    1.6268390811   4.7876624803  -0.4740756356
*
