# elt lat z ielement atwt # alpha b0 b1 b2 b3 alat esub asub # t0 t1 t2 t3 rozero ibar 'Co' 'hcp' 12 1 58.933 5.2356147485 3.50 0.00 0.00 4.00 2.5000000000 4.41 0.90 1 3.00 5.00 -1.00 1.00 3 'Cr' 'bcc' 8 1 51.960 5.5800716432 6.49 1.00 6.00 1.00 2.8809778433 4.10 0.52 1 2.00 6.80 -8.00 1.00 3