%nproc=4
%mem=6400mb
#p B3LYP/genecp scf=(maxcyc=1000,conver=8)
5D 7F scf=nosym empiricaldispersion=gd3 scrf=pcm

Bitartekari zentralaren dobletea base handiagoa erabiliz:
        
0 1
H -0.107013 -0.369525 -2.157475
H -0.193133 0.417658 -2.137589
Ru -0.021475 -0.000703 -0.319681
S 0.038924 -0.032448 2.046821
S -2.268982 -0.022968 -0.201913
S 1.120489 1.926687 -0.281228
S 1.132689 -1.916427 -0.295811
H 1.368377 0.135259 2.233462
H -2.639451 -0.044116 -1.507658
H 1.301689 2.205416 -1.598698
H 1.317599 -2.181028 -1.616337

-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


