# generated using pymatgen data_Mg6ZnSn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.06699000 _cell_length_b 6.27645400 _cell_length_c 11.13010300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6ZnSn _chemical_formula_sum 'Mg12 Zn2 Sn2' _cell_volume 353.96765672 _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 0.24732700 0.08196000 1.0 Mg Mg1 1 0.00000000 0.75267300 0.08196000 1.0 Mg Mg2 1 0.00000000 0.00000000 0.33116700 1.0 Mg Mg3 1 0.50000000 0.74340100 0.41074300 1.0 Mg Mg4 1 0.50000000 0.25659900 0.41074300 1.0 Mg Mg5 1 0.50000000 0.00000000 0.16602100 1.0 Mg Mg6 1 0.00000000 0.74732700 0.58196000 1.0 Mg Mg7 1 0.00000000 0.25267300 0.58196000 1.0 Mg Mg8 1 0.00000000 0.50000000 0.83116700 1.0 Mg Mg9 1 0.50000000 0.24340100 0.91074300 1.0 Mg Mg10 1 0.50000000 0.75659900 0.91074300 1.0 Mg Mg11 1 0.50000000 0.50000000 0.66602100 1.0 Zn Zn12 1 0.00000000 0.50000000 0.35408200 1.0 Zn Zn13 1 0.00000000 0.00000000 0.85408200 1.0 Sn Sn14 1 0.50000000 0.50000000 0.16332300 1.0 Sn Sn15 1 0.50000000 0.00000000 0.66332300 1.0