# generated using pymatgen data_Tb3Be(SiIr3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.51699857 _cell_length_b 5.51699848 _cell_length_c 14.91491891 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000645 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3Be(SiIr3)2 _chemical_formula_sum 'Tb6 Be2 Si4 Ir12' _cell_volume 393.14905458 _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 0.33333300 0.66666700 0.53723973 1.0 Tb Tb1 1 0.66666700 0.33333300 0.46276027 1.0 Tb Tb2 1 0.66666700 0.33333300 0.03723973 1.0 Tb Tb3 1 0.33333300 0.66666700 0.96276027 1.0 Tb Tb4 1 0.33333300 0.66666700 0.75000000 1.0 Tb Tb5 1 0.66666700 0.33333300 0.25000000 1.0 Be Be6 1 0.00000000 0.00000000 0.25000000 1.0 Be Be7 1 0.00000000 0.00000000 0.75000000 1.0 Si Si8 1 0.33333300 0.66666700 0.25000000 1.0 Si Si9 1 0.66666700 0.33333300 0.75000000 1.0 Si Si10 1 0.00000000 0.00000000 0.00000000 1.0 Si Si11 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir12 1 0.16451589 0.32903177 0.13191362 1.0 Ir Ir13 1 0.83548411 0.67096823 0.86808638 1.0 Ir Ir14 1 0.67096823 0.83548411 0.13191362 1.0 Ir Ir15 1 0.83548411 0.67096823 0.63191362 1.0 Ir Ir16 1 0.32903177 0.16451589 0.86808638 1.0 Ir Ir17 1 0.16451589 0.32903177 0.36808638 1.0 Ir Ir18 1 0.16451589 0.83548411 0.13191362 1.0 Ir Ir19 1 0.32903177 0.16451589 0.63191362 1.0 Ir Ir20 1 0.83548411 0.16451589 0.86808638 1.0 Ir Ir21 1 0.67096823 0.83548411 0.36808638 1.0 Ir Ir22 1 0.83548411 0.16451589 0.63191362 1.0 Ir Ir23 1 0.16451589 0.83548411 0.36808638 1.0