%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
O 1.54401147 -0.12995859 0.21193402
H 1.91796973 0.29430875 0.99813579
Sn -0.47068516 -0.02960007 0.04536501
C -1.02765277 2.06981622 -0.03086083
C -1.33106793 -1.0155771 1.78065194
C -0.81861095 -1.08310487 -1.80735377
H -0.47806055 2.57542948 -0.83158168
H -2.10105852 2.18365575 -0.22066208
H -0.79343984 2.56687932 0.91687638
H -0.93042389 -2.03034735 1.8732513
H -1.09224284 -0.46437484 2.69677309
H -2.42178705 -1.0792179 1.6942985
H -0.29022317 -0.5834043 -2.62549097
H -0.44291009 -2.10832712 -1.72979827
H -1.88627691 -1.11864408 -2.0498688

-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


