%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
C 1.00381977 -0.2655926 0.00533686
N 1.64009891 -1.44970087 -0.00939288
C 3.0151366 -1.26787812 -0.01652843
C 3.22419836 0.08128804 -0.00601546
N 1.96865092 0.67056126 0.00748551
H 3.71373974 -2.08993153 -0.02839753
H 4.13886587 0.65343921 -0.00697842
H 1.08731797 -2.30285655 -0.01321943
H 1.70021413 1.65095856 0.01836321
Pt -0.93027899 0.03381802 0.02116041
F -2.90471528 0.33946829 0.03739693
F -0.92002511 0.04705856 -1.96334301
F -0.89230866 0.01289633 2.00529819
F -0.50597424 1.98541458 0.03493332
F -1.11467739 -1.95495368 0.00545748

-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


