# generated using pymatgen data_Ce3ZrSb5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.54163277 _cell_length_b 9.54056971 _cell_length_c 6.37285419 _cell_angle_alpha 89.99879108 _cell_angle_beta 89.99960450 _cell_angle_gamma 119.99810886 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce3ZrSb5 _chemical_formula_sum 'Ce6 Zr2 Sb10' _cell_volume 502.42344372 _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 0.61590761 0.00001590 0.24998752 1.0 Ce Ce1 1 0.38412985 0.00001754 0.75000058 1.0 Ce Ce2 1 -0.00000813 0.61588582 0.24999323 1.0 Ce Ce3 1 0.99999378 0.38410955 0.75000490 1.0 Ce Ce4 1 0.38410675 0.38411027 0.25001313 1.0 Ce Ce5 1 0.61585298 0.61587299 0.74998180 1.0 Zr Zr6 1 -0.00000366 0.00001769 -0.00000943 1.0 Zr Zr7 1 0.00000058 0.00001290 0.50000271 1.0 Sb Sb8 1 0.26155466 0.99998351 0.25011256 1.0 Sb Sb9 1 0.73844796 0.00001248 0.74989281 1.0 Sb Sb10 1 -0.00000644 0.26148633 0.25006759 1.0 Sb Sb11 1 -0.00001267 0.73840198 0.74993659 1.0 Sb Sb12 1 0.73842051 0.73842927 0.24986071 1.0 Sb Sb13 1 0.26155467 0.26158144 0.75015869 1.0 Sb Sb14 1 0.33335378 0.66668158 0.00006788 1.0 Sb Sb15 1 0.66668682 0.33333843 0.00006388 1.0 Sb Sb16 1 0.66669305 0.33337327 0.49993428 1.0 Sb Sb17 1 0.33332689 0.66667004 0.49993257 1.0