#!/home/wal/scripts/bin/banewfn
wfn=5050.molden
frag1=e C
frag2=e O
frag3=e Th
frag4=e Eu

[dos]
%process
frag fragindex 1 option ${frag1}
frag fragindex 2 option ${frag2}
frag fragindex 3 option ${frag3}
frag fragindex 4 option ${frag4}
draw
data
plot
end

%command
#!/bin/bash
mv dislin.pdf ${input}_pdos.pdf 
mv DOS_curve.txt ${input}_dos-curve.txt
mv DOS_line.txt ${input}_dos-line.txt
end