# generated using pymatgen data_Ce2Nd3P12Ru19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.53505933 _cell_length_b 12.53505885 _cell_length_c 4.00111338 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999868 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce2Nd3P12Ru19 _chemical_formula_sum 'Ce2 Nd3 P12 Ru19' _cell_volume 544.45785338 _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 Ce Ce0 1 0.33333300 0.66666700 0.00000000 1.0 Ce Ce1 1 0.66666700 0.33333300 0.00000000 1.0 Nd Nd2 1 0.18494378 0.18494378 0.50000000 1.0 Nd Nd3 1 0.81505622 1.00000000 0.50000000 1.0 Nd Nd4 1 0.00000000 0.81505622 0.50000000 1.0 P P5 1 0.81220706 0.81220706 0.00000000 1.0 P P6 1 0.18779294 1.00000000 0.00000000 1.0 P P7 1 1.00000000 0.18779294 0.00000000 1.0 P P8 1 0.17228699 0.47560895 0.50000000 1.0 P P9 1 0.52439105 0.69667904 0.50000000 1.0 P P10 1 0.30332096 0.82771301 0.50000000 1.0 P P11 1 0.69667904 0.52439105 0.50000000 1.0 P P12 1 0.82771301 0.30332096 0.50000000 1.0 P P13 1 0.47560895 0.17228699 0.50000000 1.0 P P14 1 0.37439419 0.37439419 0.00000000 1.0 P P15 1 0.62560581 0.00000000 0.00000000 1.0 P P16 1 0.00000000 0.62560581 0.00000000 1.0 Ru Ru17 1 0.55403943 0.55403943 0.00000000 1.0 Ru Ru18 1 0.44596057 1.00000000 0.00000000 1.0 Ru Ru19 1 1.00000000 0.44596057 0.00000000 1.0 Ru Ru20 1 0.71488349 0.71488349 0.50000000 1.0 Ru Ru21 1 0.28511651 1.00000000 0.50000000 1.0 Ru Ru22 1 1.00000000 0.28511651 0.50000000 1.0 Ru Ru23 1 0.18501283 0.38000259 0.00000000 1.0 Ru Ru24 1 0.61999741 0.80501024 0.00000000 1.0 Ru Ru25 1 0.19498976 0.81498717 0.00000000 1.0 Ru Ru26 1 0.80501024 0.61999741 0.00000000 1.0 Ru Ru27 1 0.81498717 0.19498976 0.00000000 1.0 Ru Ru28 1 0.38000259 0.18501283 0.00000000 1.0 Ru Ru29 1 0.36844020 0.49461261 0.50000000 1.0 Ru Ru30 1 0.50538739 0.87382759 0.50000000 1.0 Ru Ru31 1 0.12617241 0.63155980 0.50000000 1.0 Ru Ru32 1 0.87382759 0.50538739 0.50000000 1.0 Ru Ru33 1 0.63155980 0.12617241 0.50000000 1.0 Ru Ru34 1 0.49461261 0.36844020 0.50000000 1.0 Ru Ru35 1 0.00000000 0.00000000 0.00000000 1.0