# generated using pymatgen data_Mg6CoB _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.17936200 _cell_length_b 9.38404000 _cell_length_c 10.15871600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6CoB _chemical_formula_sum 'Mg12 Co2 B2' _cell_volume 303.08793498 _cell_formula_units_Z 2 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 Mg Mg0 1 0.00000000 0.66889200 0.12160700 1.0 Mg Mg1 1 0.00000000 0.33110800 0.12160700 1.0 Mg Mg2 1 0.00000000 0.50000000 0.84636200 1.0 Mg Mg3 1 0.50000000 0.77530600 0.87495000 1.0 Mg Mg4 1 0.50000000 0.22469400 0.87495000 1.0 Mg Mg5 1 0.50000000 0.50000000 0.58173900 1.0 Mg Mg6 1 0.00000000 0.16889200 0.62160700 1.0 Mg Mg7 1 0.00000000 0.83110800 0.62160700 1.0 Mg Mg8 1 0.00000000 0.00000000 0.34636200 1.0 Mg Mg9 1 0.50000000 0.27530600 0.37495000 1.0 Mg Mg10 1 0.50000000 0.72469400 0.37495000 1.0 Mg Mg11 1 0.50000000 0.00000000 0.08173900 1.0 Co Co12 1 0.00000000 0.50000000 0.33872100 1.0 Co Co13 1 0.00000000 0.00000000 0.83872100 1.0 B B14 1 0.50000000 0.50000000 0.24006500 1.0 B B15 1 0.50000000 0.00000000 0.74006500 1.0