# generated using pymatgen data_Mg3Sn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.31580400 _cell_length_b 5.18597400 _cell_length_c 5.44106000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg3Sn _chemical_formula_sum 'Mg3 Sn1' _cell_volume 93.56269035 _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 Mg Mg0 1 0.00000000 0.00000000 0.66699300 1.0 Mg Mg1 1 0.00000000 0.50000000 0.33352000 1.0 Mg Mg2 1 0.50000000 0.50000000 0.83317200 1.0 Sn Sn3 1 0.50000000 0.00000000 0.16631600 1.0