ATOMIC_SPECIES
Al 26.98 al.lda.lps blps

LATTICE_CONSTANT
7.50241114482312  // add lattice constant

LATTICE_VECTORS
0.000000000000    0.500000000000    0.500000000000    
0.500000000000    0.000000000000    0.500000000000    
0.500000000000    0.500000000000    0.000000000000    

ATOMIC_POSITIONS
Direct

Al
0
1
    0.000000000000    0.000000000000    0.000000000000 1 1 1 
