# generated using pymatgen data_MgBi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.09436734 _cell_length_b 9.09436734 _cell_length_c 5.73145600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 158.53611642 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgBi2 _chemical_formula_sum 'Mg2 Bi4' _cell_volume 173.45617372 _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 0.55686500 0.44313500 0.25000000 1.0 Mg Mg1 1 0.44313500 0.55686500 0.75000000 1.0 Bi Bi2 1 0.21026500 0.78973500 0.25000000 1.0 Bi Bi3 1 0.90464900 0.09535100 0.25000000 1.0 Bi Bi4 1 0.09535100 0.90464900 0.75000000 1.0 Bi Bi5 1 0.78973500 0.21026500 0.75000000 1.0