# elt lat z ielement atwt # alpha b0 b1 b2 b3 alat esub asub # t0 t1 t2 t3 rozero ibar 'Mg' 'hcp' 12 1 24.320 5.5663414489 2.30 1.00 3.00 1.00 3.2000000000 1.55 0.52 1 9.00 -2.00 -9.50 1.00 3 'Sn' 'fcc' 12 1 118.710 6.2000000000 6.20 6.00 6.00 6.00 4.8648946546 3.08 1.00 1 4.50 6.50 -0.183 1.60 3