%mem=3200mb
%nproc=4
#p B3LYP/genecp scf=(xqc,maxcyc=1000,conver=8)
freq 5D 7F scf=nosym empiricaldispersion=gd3

Bitartekari zentralaren dobletea base handiagoa erabiliz:

1 1
Si 1.34957292 0.00428514 -0.00000009
H 1.72642283 1.43391699 -0.00000009
H 1.76071839 -0.7008241 1.2329017
H 1.76071839 -0.7008241 -1.23290187
Zn -1.0122954 -0.03316025 -0.00000009
N -3.09216932 -0.06385849 -0.00000009
H -3.4709427 -1.01664336 -0.00000009
H -3.491472 0.40401319 0.82031392
H -3.491472 0.40401319 -0.82031409

-H -C -N -O -P -B -S -Al -Cl -F -He -Si 0
6-31+g*
****
-Pd -Os -Au -W -Fe -K -Ti -Cu -Co -Pt -Ag -Cr -V -Sc -Mn -Hf -Ir -I -Br -Ta -Zn -Zr -Mo -Re -Ru -Rh -Ru -Ni -Nb -Xe -Sn -In -Y -Ga -Hg 0
sdd
*******************

-Pd -Os -Au -W -Fe -K -Ti -Cu -Co -Pt -Ag -Cr -V -Sc -Mn -Hf -Ir -I -Br -Ta -Zn -Zr -Mo -Re -Ru -Rh -Ru -Ni -Nb -Xe -Sn -In -Y -Ga -Hg 0
sdd


