# generated using pymatgen data_MgBi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.84592329 _cell_length_b 5.84592329 _cell_length_c 6.66617284 _cell_angle_alpha 64.01558801 _cell_angle_beta 64.01558801 _cell_angle_gamma 64.65884723 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgBi2 _chemical_formula_sum 'Mg2 Bi4' _cell_volume 176.05509149 _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 0.58785400 0.41214600 0.75000000 1.0 Mg Mg1 1 0.41214600 0.58785400 0.25000000 1.0 Bi Bi2 1 0.08912800 0.28981300 0.23404400 1.0 Bi Bi3 1 0.71018700 0.91087200 0.26595600 1.0 Bi Bi4 1 0.28981300 0.08912800 0.73404400 1.0 Bi Bi5 1 0.91087200 0.71018700 0.76595600 1.0