set xlabel "Internuclear distance (bohr) "
set ylabel "Atomization energy (hartree)"
set key font ",15"
set key spacing "1,8"

plot   'data_DFT_vtzE_error' using 1:2 smooth cspline notitle lt 2 , "" using 1:2 w p lt 2  title "FCI/vtz"
replot 'data_DFT_vtzE_error' using 1:3 smooth cspline notitle lt 8 , "" using 1:3 w p lt 8  title "FCI+PBE/vtz" 
replot 'data_DFT_vtzE_error' using 1:4 smooth cspline notitle lt 4 , "" using 1:4 w p lt 4  title "FCI+PBEot/vtz" 
set terminal eps linewidth 6
set output "DFT_vtzE_error.eps"
replot