# generated using pymatgen data_Tb3Co(Si3Ir4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.93605955 _cell_length_b 11.26978245 _cell_length_c 12.79528494 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3Co(Si3Ir4)2 _chemical_formula_sum 'Tb6 Co2 Si12 Ir16' _cell_volume 567.58009223 _cell_formula_units_Z 2 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 0.00000000 0.50000000 0.52774431 1.0 Tb Tb1 1 0.50000000 0.00000000 0.47225569 1.0 Tb Tb2 1 0.50000000 0.81722832 0.20216949 1.0 Tb Tb3 1 0.50000000 0.18277168 0.20216949 1.0 Tb Tb4 1 0.00000000 0.68277168 0.79783051 1.0 Tb Tb5 1 0.00000000 0.31722832 0.79783051 1.0 Co Co6 1 0.00000000 0.50000000 0.98212530 1.0 Co Co7 1 0.50000000 0.00000000 0.01787470 1.0 Si Si8 1 0.50000000 0.50000000 0.88094437 1.0 Si Si9 1 0.00000000 0.00000000 0.11905563 1.0 Si Si10 1 0.50000000 0.50000000 0.34029267 1.0 Si Si11 1 0.00000000 0.00000000 0.65970733 1.0 Si Si12 1 0.50000000 0.30611768 0.61763209 1.0 Si Si13 1 0.50000000 0.69388232 0.61763209 1.0 Si Si14 1 0.00000000 0.19388232 0.38236791 1.0 Si Si15 1 0.00000000 0.80611768 0.38236791 1.0 Si Si16 1 0.50000000 0.85408284 0.89906915 1.0 Si Si17 1 0.50000000 0.14591716 0.89906915 1.0 Si Si18 1 0.00000000 0.64591716 0.10093085 1.0 Si Si19 1 0.00000000 0.35408284 0.10093085 1.0 Ir Ir20 1 0.50000000 0.50000000 0.15358208 1.0 Ir Ir21 1 0.00000000 0.00000000 0.84641792 1.0 Ir Ir22 1 0.50000000 0.50000000 0.69532064 1.0 Ir Ir23 1 0.00000000 0.00000000 0.30467936 1.0 Ir Ir24 1 0.50000000 0.33428116 0.98799127 1.0 Ir Ir25 1 0.50000000 0.66571884 0.98799127 1.0 Ir Ir26 1 0.00000000 0.16571884 0.01200873 1.0 Ir Ir27 1 0.00000000 0.83428116 0.01200873 1.0 Ir Ir28 1 0.50000000 0.30165083 0.42990063 1.0 Ir Ir29 1 0.50000000 0.69834917 0.42990063 1.0 Ir Ir30 1 0.00000000 0.19834917 0.57009937 1.0 Ir Ir31 1 0.00000000 0.80165083 0.57009937 1.0 Ir Ir32 1 0.50000000 0.87797652 0.71401765 1.0 Ir Ir33 1 0.50000000 0.12202348 0.71401765 1.0 Ir Ir34 1 0.00000000 0.62202348 0.28598235 1.0 Ir Ir35 1 0.00000000 0.37797652 0.28598235 1.0