# generated using pymatgen data_Ce2MgS4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.32520849 _cell_length_b 7.32520849 _cell_length_c 7.32520849 _cell_angle_alpha 111.32597577 _cell_angle_beta 111.32597577 _cell_angle_gamma 105.82218661 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce2MgS4 _chemical_formula_sum 'Ce4 Mg2 S8' _cell_volume 301.66560480 _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 Ce Ce0 1 0.87500000 0.75423300 0.37923300 1.0 Ce Ce1 1 0.50423300 0.12500000 0.87923300 1.0 Ce Ce2 1 0.37500000 0.49576700 0.62076700 1.0 Ce Ce3 1 0.24576700 0.62500000 0.12076700 1.0 Mg Mg4 1 0.00000000 0.00000000 0.00000000 1.0 Mg Mg5 1 0.75000000 0.25000000 0.50000000 1.0 S S6 1 0.50429600 0.37695300 0.26757500 1.0 S S7 1 0.76327900 0.49570400 0.87265700 1.0 S S8 1 0.10937800 0.23672100 0.73242500 1.0 S S9 1 0.62304700 0.89062200 0.12734300 1.0 S S10 1 0.24570400 0.01327900 0.37265700 1.0 S S11 1 0.98672100 0.35937800 0.23242500 1.0 S S12 1 0.64062200 0.87304700 0.62734300 1.0 S S13 1 0.12695300 0.75429600 0.76757500 1.0