# generated using pymatgen data_Tb12Tc3Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.35109452 _cell_length_b 7.36987005 _cell_length_c 9.17481477 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.99785297 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb12Tc3Ir _chemical_formula_sum 'Tb12 Tc3 Ir1' _cell_volume 429.44318067 _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 0.33182775 0.67497806 0.06599361 1.0 Tb Tb1 1 0.16400405 0.17549506 0.43466687 1.0 Tb Tb2 1 0.66680275 0.32391798 0.56254511 1.0 Tb Tb3 1 0.83397009 0.82516896 0.93617061 1.0 Tb Tb4 1 0.66680275 0.32391798 0.93745489 1.0 Tb Tb5 1 0.83397009 0.82516896 0.56382939 1.0 Tb Tb6 1 0.33182775 0.67497806 0.43400639 1.0 Tb Tb7 1 0.16400405 0.17549506 0.06533313 1.0 Tb Tb8 1 0.87188010 0.54816879 0.25000000 1.0 Tb Tb9 1 0.62745800 0.04449509 0.25000000 1.0 Tb Tb10 1 0.13289448 0.45179752 0.75000000 1.0 Tb Tb11 1 0.36974555 0.95507397 0.75000000 1.0 Tc Tc12 1 0.03372145 0.88685215 0.25000000 1.0 Tc Tc13 1 0.46850753 0.38894869 0.25000000 1.0 Tc Tc14 1 0.96416296 0.11243366 0.75000000 1.0 Ir Ir15 1 0.53842165 0.61311103 0.75000000 1.0