# generated using pymatgen data_Ce2S3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.09449793 _cell_length_b 7.57198106 _cell_length_c 15.64470777 _cell_angle_alpha 89.87201562 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce2S3 _chemical_formula_sum 'Ce8 S12' _cell_volume 485.03887333 _cell_formula_units_Z 4 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 0.25000000 0.76355437 0.54201429 1.0 Ce Ce1 1 0.75000000 0.23644563 0.45798571 1.0 Ce Ce2 1 0.25000000 0.26316354 0.95767136 1.0 Ce Ce3 1 0.75000000 0.73683646 0.04232864 1.0 Ce Ce4 1 0.25000000 0.63717015 0.29341182 1.0 Ce Ce5 1 0.75000000 0.36282985 0.70658818 1.0 Ce Ce6 1 0.25000000 0.13638221 0.20761762 1.0 Ce Ce7 1 0.75000000 0.86361779 0.79238238 1.0 S S8 1 0.25000000 0.64964907 0.71970570 1.0 S S9 1 0.75000000 0.35035093 0.28029430 1.0 S S10 1 0.25000000 0.15065121 0.77988719 1.0 S S11 1 0.75000000 0.84934879 0.22011281 1.0 S S12 1 0.25000000 0.87314309 0.93172805 1.0 S S13 1 0.75000000 0.12685691 0.06827195 1.0 S S14 1 0.25000000 0.37278657 0.56804540 1.0 S S15 1 0.75000000 0.62721343 0.43195460 1.0 S S16 1 0.75000000 0.98774770 0.60804536 1.0 S S17 1 0.25000000 0.01225230 0.39195464 1.0 S S18 1 0.75000000 0.48773772 0.89196987 1.0 S S19 1 0.25000000 0.51226228 0.10803013 1.0