# generated using pymatgen data_Tb2(B2Ir3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.62469383 _cell_length_b 5.62469410 _cell_length_c 8.61012279 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999839 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb2(B2Ir3)3 _chemical_formula_sum 'Tb2 B6 Ir9' _cell_volume 235.90534424 _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 0.00000000 0.00000000 0.70300198 1.0 Tb Tb1 1 0.00000000 0.00000000 0.29699802 1.0 B B2 1 0.66666700 0.33333300 0.00000000 1.0 B B3 1 0.33333300 0.66666700 0.00000000 1.0 B B4 1 0.66666700 0.33333300 0.66748250 1.0 B B5 1 0.33333300 0.66666700 0.66748250 1.0 B B6 1 0.33333300 0.66666700 0.33251750 1.0 B B7 1 0.66666700 0.33333300 0.33251750 1.0 Ir Ir8 1 0.50000000 0.50000000 0.83602466 1.0 Ir Ir9 1 0.50000000 0.00000000 0.83602466 1.0 Ir Ir10 1 0.00000000 0.50000000 0.83602466 1.0 Ir Ir11 1 0.50000000 0.50000000 0.16397534 1.0 Ir Ir12 1 0.50000000 0.00000000 0.16397534 1.0 Ir Ir13 1 0.00000000 0.50000000 0.16397534 1.0 Ir Ir14 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir15 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir16 1 0.00000000 0.50000000 0.50000000 1.0