# generated using pymatgen data_Tb5P12Ir16Rh3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.65849581 _cell_length_b 12.65849582 _cell_length_c 3.95111921 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999741 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb5P12Ir16Rh3 _chemical_formula_sum 'Tb5 P12 Ir16 Rh3' _cell_volume 548.29587755 _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 Tb Tb0 1 0.33333300 0.66666700 0.50000000 1.0 Tb Tb1 1 0.66666700 0.33333300 0.50000000 1.0 Tb Tb2 1 1.00000000 0.81372427 0.00000000 1.0 Tb Tb3 1 0.18627573 0.18627573 0.00000000 1.0 Tb Tb4 1 0.81372427 1.00000000 0.00000000 1.0 P P5 1 0.00000000 0.63990518 0.50000000 1.0 P P6 1 0.36009482 0.36009482 0.50000000 1.0 P P7 1 0.63990518 0.00000000 0.50000000 1.0 P P8 1 0.51720688 0.68720390 0.00000000 1.0 P P9 1 0.31279610 0.83000298 0.00000000 1.0 P P10 1 0.16999702 0.48279312 0.00000000 1.0 P P11 1 0.48279312 0.16999702 0.00000000 1.0 P P12 1 0.68720390 0.51720688 0.00000000 1.0 P P13 1 0.83000298 0.31279610 0.00000000 1.0 P P14 1 1.00000000 0.17917608 0.50000000 1.0 P P15 1 0.82082392 0.82082392 0.50000000 1.0 P P16 1 0.17917608 1.00000000 0.50000000 1.0 Ir Ir17 1 0.50722920 0.86677625 0.00000000 1.0 Ir Ir18 1 0.13322375 0.64045395 0.00000000 1.0 Ir Ir19 1 0.35954605 0.49277080 0.00000000 1.0 Ir Ir20 1 0.49277080 0.35954605 0.00000000 1.0 Ir Ir21 1 0.86677625 0.50722920 0.00000000 1.0 Ir Ir22 1 0.64045395 0.13322375 0.00000000 1.0 Ir Ir23 1 0.00000000 0.28229885 0.00000000 1.0 Ir Ir24 1 0.71770115 0.71770115 0.00000000 1.0 Ir Ir25 1 0.28229885 0.00000000 0.00000000 1.0 Ir Ir26 1 0.62524542 0.80576015 0.50000000 1.0 Ir Ir27 1 0.19423985 0.81948527 0.50000000 1.0 Ir Ir28 1 0.18051473 0.37475458 0.50000000 1.0 Ir Ir29 1 0.37475458 0.18051473 0.50000000 1.0 Ir Ir30 1 0.80576015 0.62524542 0.50000000 1.0 Ir Ir31 1 0.81948527 0.19423985 0.50000000 1.0 Ir Ir32 1 0.00000000 0.00000000 0.50000000 1.0 Rh Rh33 1 1.00000000 0.46223994 0.50000000 1.0 Rh Rh34 1 0.53776006 0.53776006 0.50000000 1.0 Rh Rh35 1 0.46223994 1.00000000 0.50000000 1.0