data_[Tb4In5Ir2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  In  1.7800  1.5500  0.9400
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.7625]
_cell_length_b [3.6257]
_cell_length_c [9.8203]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.0623]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Tb4In5Ir2]
_chemical_formula_sum '[Tb4 In5 Ir2]'
_cell_volume [275.6939]
_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  2  0.1729  0.5000  0.8491  1.0
  Tb  Tb1  2  0.2165  0.5000  0.4443  1.0
  In  In2  2  0.1763  0.0000  0.1512  1.0
  In  In3  2  0.4524  0.0000  0.6763  1.0
  In  In4  1  0.5000  0.0000  0.0000  1.0
  Ir  Ir5  2  0.0749  0.0000  0.6409  1.0
]