# generated using pymatgen data_KNd6RhI12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.99101612 _cell_length_b 9.99101439 _cell_length_c 9.99101444 _cell_angle_alpha 105.84274376 _cell_angle_beta 105.84272775 _cell_angle_gamma 105.84273313 _symmetry_Int_Tables_number 1 _chemical_formula_structural KNd6RhI12 _chemical_formula_sum 'K1 Nd6 Rh1 I12' _cell_volume 855.43394746 _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 K K0 1 0.50000000 0.50000000 0.50000000 1.0 Nd Nd1 1 0.90315957 0.98072371 0.69696847 1.0 Nd Nd2 1 0.98072371 0.69696847 0.90315957 1.0 Nd Nd3 1 0.69696847 0.90315957 0.98072371 1.0 Nd Nd4 1 0.09684043 0.01927629 0.30303153 1.0 Nd Nd5 1 0.01927629 0.30303153 0.09684043 1.0 Nd Nd6 1 0.30303153 0.09684043 0.01927629 1.0 Rh Rh7 1 0.00000000 0.00000000 0.00000000 1.0 I I8 1 0.55837041 0.87751780 0.64365132 1.0 I I9 1 0.87751780 0.64365132 0.55837041 1.0 I I10 1 0.64365132 0.55837041 0.87751780 1.0 I I11 1 0.44162959 0.12248220 0.35634868 1.0 I I12 1 0.12248220 0.35634868 0.44162959 1.0 I I13 1 0.35634868 0.44162959 0.12248220 1.0 I I14 1 0.67524128 0.22684338 0.07594099 1.0 I I15 1 0.22684338 0.07594099 0.67524128 1.0 I I16 1 0.07594099 0.67524128 0.22684338 1.0 I I17 1 0.32475872 0.77315662 0.92405901 1.0 I I18 1 0.77315662 0.92405901 0.32475872 1.0 I I19 1 0.92405901 0.32475872 0.77315662 1.0