# generated using pymatgen data_CsMg6Sn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.16352700 _cell_length_b 7.89801000 _cell_length_c 11.28101200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CsMg6Sn _chemical_formula_sum 'Cs2 Mg12 Sn2' _cell_volume 460.05758227 _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 Cs Cs0 1 0.50000000 0.50000000 0.88777800 1.0 Cs Cs1 1 0.50000000 0.00000000 0.38777800 1.0 Mg Mg2 1 0.50000000 0.20350900 0.10951200 1.0 Mg Mg3 1 0.50000000 0.79649100 0.10951200 1.0 Mg Mg4 1 0.00000000 0.19533600 0.90186200 1.0 Mg Mg5 1 0.00000000 0.80466400 0.90186200 1.0 Mg Mg6 1 0.00000000 0.50000000 0.13545800 1.0 Mg Mg7 1 0.00000000 0.50000000 0.65390700 1.0 Mg Mg8 1 0.50000000 0.70350900 0.60951200 1.0 Mg Mg9 1 0.50000000 0.29649100 0.60951200 1.0 Mg Mg10 1 0.00000000 0.69533600 0.40186200 1.0 Mg Mg11 1 0.00000000 0.30466400 0.40186200 1.0 Mg Mg12 1 0.00000000 0.00000000 0.63545800 1.0 Mg Mg13 1 0.00000000 0.00000000 0.15390700 1.0 Sn Sn14 1 0.50000000 0.50000000 0.30011400 1.0 Sn Sn15 1 0.50000000 0.00000000 0.80011400 1.0