# generated using pymatgen data_ErTaCoB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.36172022 _cell_length_b 8.85528040 _cell_length_c 11.18760793 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErTaCoB6 _chemical_formula_sum 'Er4 Ta4 Co4 B24' _cell_volume 333.04362234 _cell_formula_units_Z 4 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Er Er0 1 0.00000000 0.82289541 0.08633935 1.0 Er Er1 1 0.00000000 0.17710459 0.91366065 1.0 Er Er2 1 0.00000000 0.32289541 0.41366065 1.0 Er Er3 1 0.00000000 0.67710459 0.58633935 1.0 Ta Ta4 1 0.00000000 0.44523313 0.12786898 1.0 Ta Ta5 1 0.00000000 0.55476687 0.87213102 1.0 Ta Ta6 1 0.00000000 0.94523313 0.37213102 1.0 Ta Ta7 1 0.00000000 0.05476687 0.62786898 1.0 Co Co8 1 0.00000000 0.14447152 0.18271176 1.0 Co Co9 1 0.00000000 0.85552848 0.81728824 1.0 Co Co10 1 0.00000000 0.64447152 0.31728824 1.0 Co Co11 1 0.00000000 0.35552848 0.68271176 1.0 B B12 1 0.50000000 0.05411727 0.06663072 1.0 B B13 1 0.50000000 0.94588273 0.93336928 1.0 B B14 1 0.50000000 0.55411727 0.43336928 1.0 B B15 1 0.50000000 0.44588273 0.56663072 1.0 B B16 1 0.50000000 0.25281645 0.08231555 1.0 B B17 1 0.50000000 0.74718355 0.91768445 1.0 B B18 1 0.50000000 0.75281645 0.41768445 1.0 B B19 1 0.50000000 0.24718355 0.58231555 1.0 B B20 1 0.50000000 0.29763333 0.23676194 1.0 B B21 1 0.50000000 0.70236667 0.76323806 1.0 B B22 1 0.50000000 0.79763333 0.26323806 1.0 B B23 1 0.50000000 0.20236667 0.73676194 1.0 B B24 1 0.50000000 0.13035263 0.31832971 1.0 B B25 1 0.50000000 0.86964737 0.68167029 1.0 B B26 1 0.50000000 0.63035263 0.18167029 1.0 B B27 1 0.50000000 0.36964737 0.81832971 1.0 B B28 1 0.50000000 0.48269938 0.28709162 1.0 B B29 1 0.50000000 0.51730062 0.71290838 1.0 B B30 1 0.50000000 0.98269938 0.21290838 1.0 B B31 1 0.50000000 0.01730062 0.78709162 1.0 B B32 1 0.50000000 0.10027701 0.47359316 1.0 B B33 1 0.50000000 0.89972299 0.52640684 1.0 B B34 1 0.50000000 0.60027701 0.02640684 1.0 B B35 1 0.50000000 0.39972299 0.97359316 1.0