# generated using pymatgen data_Tb2Lu3Si3Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.07669753 _cell_length_b 7.81622140 _cell_length_c 14.33499171 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb2Lu3Si3Ir _chemical_formula_sum 'Tb8 Lu12 Si12 Ir4' _cell_volume 792.91189344 _cell_formula_units_Z 4 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 0.50776519 0.68132252 0.59423441 1.0 Tb Tb1 1 0.00776519 0.81867748 0.90576559 1.0 Tb Tb2 1 0.49223481 0.31867748 0.09423441 1.0 Tb Tb3 1 0.99223481 0.18132252 0.40576559 1.0 Tb Tb4 1 0.49223481 0.31867748 0.40576559 1.0 Tb Tb5 1 0.99223481 0.18132252 0.09423441 1.0 Tb Tb6 1 0.50776519 0.68132252 0.90576559 1.0 Tb Tb7 1 0.00776519 0.81867748 0.59423441 1.0 Lu Lu8 1 0.68428084 0.17183054 0.62864485 1.0 Lu Lu9 1 0.18428084 0.32816946 0.87135515 1.0 Lu Lu10 1 0.31571916 0.82816946 0.12864485 1.0 Lu Lu11 1 0.81571916 0.67183054 0.37135515 1.0 Lu Lu12 1 0.31571916 0.82816946 0.37135515 1.0 Lu Lu13 1 0.81571916 0.67183054 0.12864485 1.0 Lu Lu14 1 0.68428084 0.17183054 0.87135515 1.0 Lu Lu15 1 0.18428084 0.32816946 0.62864485 1.0 Lu Lu16 1 0.82907358 0.50573775 0.75000000 1.0 Lu Lu17 1 0.32907358 0.99426225 0.75000000 1.0 Lu Lu18 1 0.17092642 0.49426225 0.25000000 1.0 Lu Lu19 1 0.67092642 0.00573775 0.25000000 1.0 Si Si20 1 0.65628134 0.96935088 0.46155600 1.0 Si Si21 1 0.15628134 0.53064912 0.03844400 1.0 Si Si22 1 0.34371866 0.03064912 0.96155600 1.0 Si Si23 1 0.84371866 0.46935088 0.53844400 1.0 Si Si24 1 0.34371866 0.03064912 0.53844400 1.0 Si Si25 1 0.84371866 0.46935088 0.96155600 1.0 Si Si26 1 0.65628134 0.96935088 0.03844400 1.0 Si Si27 1 0.15628134 0.53064912 0.46155600 1.0 Si Si28 1 0.72785739 0.86615620 0.75000000 1.0 Si Si29 1 0.22785739 0.63384380 0.75000000 1.0 Si Si30 1 0.27214261 0.13384380 0.25000000 1.0 Si Si31 1 0.77214261 0.36615620 0.25000000 1.0 Ir Ir32 1 0.47648512 0.39731347 0.75000000 1.0 Ir Ir33 1 0.97648512 0.10268653 0.75000000 1.0 Ir Ir34 1 0.52351488 0.60268653 0.25000000 1.0 Ir Ir35 1 0.02351488 0.89731347 0.25000000 1.0