# generated using pymatgen data_Zr6MnBi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.84040785 _cell_length_b 7.85167911 _cell_length_c 7.85161230 _cell_angle_alpha 120.00129078 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6MnBi2 _chemical_formula_sum 'Zr6 Mn1 Bi2' _cell_volume 205.03297845 _cell_formula_units_Z 1 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 Zr Zr0 1 0.50000000 0.76238323 0.76231136 1.0 Zr Zr1 1 0.50000000 0.00002958 0.23770304 1.0 Zr Zr2 1 0.50000000 0.23763175 -0.00003572 1.0 Zr Zr3 1 0.00000000 0.39337851 0.39334706 1.0 Zr Zr4 1 0.00000000 0.00000644 0.60668633 1.0 Zr Zr5 1 -0.00000000 0.60655267 0.99998801 1.0 Mn Mn6 1 0.00000000 0.00002468 -0.00001230 1.0 Bi Bi7 1 0.50000000 0.66668188 0.33333861 1.0 Bi Bi8 1 0.50000000 0.33330926 0.66667360 1.0