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

Bitartekari zentralaren dobletea base handiagoa erabiliz:

0 1
B 1.28850224 0.12431497 -0.16631648
O 2.15272238 -0.47966818 0.69840728
C 3.50112789 -0.08722179 0.32165089
C 3.32319835 0.74969763 -0.97076021
O 1.88411856 0.87002739 -1.14003447
H 4.0918308 -0.99415108 0.16934002
H 3.92886096 0.48810148 1.1478326
H 3.7442248 1.75541299 -0.8937862
H 3.72772698 0.25563834 -1.85890575
In -0.94367877 -0.09198961 0.0050732
Cl -2.29728222 1.32952713 1.24874765
Cl -2.19574897 -1.75436189 -1.02634953

-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


