%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:

0 1
Si 1.2326357 -0.00369255 -0.20025956
H 1.79474431 1.36044496 -0.48716683
H 2.3312828 -0.68765245 0.56391296
H 1.25224222 -0.68541483 -1.53947743
Ag -0.9257375 0.00133292 0.90711447
C -2.86189561 0.00587741 1.90093215
N -3.62140721 -1.0509687 2.29053947
C -4.80968668 -0.66883045 2.90065377
C -4.80671393 0.69081839 2.89951041
N -3.61677739 1.06671637 2.28875583
H -5.53442354 -1.3764629 3.27251841
H -5.52835064 1.402235 3.27018493
H -3.32821174 -2.00625654 2.13974256
H -3.31935179 2.02044676 2.13632872

-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


