# generated using pymatgen data_Tb5Cr3(P3Ir4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.69450745 _cell_length_b 12.69450702 _cell_length_c 3.91566629 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999588 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb5Cr3(P3Ir4)4 _chemical_formula_sum 'Tb5 Cr3 P12 Ir16' _cell_volume 546.47212918 _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 0.00000000 0.81179525 0.00000000 1.0 Tb Tb3 1 0.18820475 0.18820475 0.00000000 1.0 Tb Tb4 1 0.81179525 0.00000000 0.00000000 1.0 Cr Cr5 1 1.00000000 0.45206885 0.50000000 1.0 Cr Cr6 1 0.54793115 0.54793115 0.50000000 1.0 Cr Cr7 1 0.45206885 1.00000000 0.50000000 1.0 P P8 1 0.00000000 0.64088326 0.50000000 1.0 P P9 1 0.35911674 0.35911674 0.50000000 1.0 P P10 1 0.64088326 0.00000000 0.50000000 1.0 P P11 1 0.51786189 0.68689852 0.00000000 1.0 P P12 1 0.31310148 0.83096337 0.00000000 1.0 P P13 1 0.16903663 0.48213811 0.00000000 1.0 P P14 1 0.48213811 0.16903663 0.00000000 1.0 P P15 1 0.68689852 0.51786189 0.00000000 1.0 P P16 1 0.83096337 0.31310148 0.00000000 1.0 P P17 1 1.00000000 0.17745037 0.50000000 1.0 P P18 1 0.82254963 0.82254963 0.50000000 1.0 P P19 1 0.17745037 1.00000000 0.50000000 1.0 Ir Ir20 1 0.50784487 0.86948501 0.00000000 1.0 Ir Ir21 1 0.13051499 0.63835986 0.00000000 1.0 Ir Ir22 1 0.36164014 0.49215513 0.00000000 1.0 Ir Ir23 1 0.49215513 0.36164014 0.00000000 1.0 Ir Ir24 1 0.86948501 0.50784487 0.00000000 1.0 Ir Ir25 1 0.63835986 0.13051499 0.00000000 1.0 Ir Ir26 1 1.00000000 0.28143691 0.00000000 1.0 Ir Ir27 1 0.71856309 0.71856309 0.00000000 1.0 Ir Ir28 1 0.28143691 1.00000000 0.00000000 1.0 Ir Ir29 1 0.62401999 0.80335087 0.50000000 1.0 Ir Ir30 1 0.19664913 0.82066912 0.50000000 1.0 Ir Ir31 1 0.17933088 0.37598001 0.50000000 1.0 Ir Ir32 1 0.37598001 0.17933088 0.50000000 1.0 Ir Ir33 1 0.80335087 0.62401999 0.50000000 1.0 Ir Ir34 1 0.82066912 0.19664913 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.50000000 1.0