%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
S 1.28893435 -0.13757169 -1.12190558
C 2.16569818 -1.41897763 -0.29388276
C 3.19621575 -0.90887092 0.42135356
C 3.26997624 0.54008049 0.3712998
C 2.29364144 1.10208666 -0.38049601
H 1.80076158 -2.4330347 -0.37661078
H 3.87273716 -1.51988075 1.01043448
H 4.00839244 1.1186664 0.91728103
H 2.03637848 2.1403705 -0.53498444
Pt -0.83854946 -0.00114645 -0.03701085
F -2.57932585 0.09649767 0.8191209
F -1.66751863 0.1380424 -1.82678142
F 0.05613605 -0.14277585 1.72058182
F -0.63810369 1.97093157 0.01316595
F -0.92561612 -1.98079316 -0.13951106

-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


