data_[Tb10Tl4Ir4Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Tl  1.6200  1.9000  1.3325
  Ir  2.2000  1.3500  0.7650
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [11.7808]
_cell_length_b [11.7808]
_cell_length_c [3.5399]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Tb5Tl2Ir2Ru]
_chemical_formula_sum '[Tb10 Tl4 Ir4 Ru2]'
_cell_volume [491.2957]
_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  8  0.0669  0.1935  0.5000  1.0
  Tb  Tb1  2  0.0000  0.5000  0.5000  1.0
  Tl  Tl2  4  0.1769  0.6769  0.0000  1.0
  Ir  Ir3  4  0.1356  0.3644  0.0000  1.0
  Ru  Ru4  2  0.0000  0.0000  0.0000  1.0
]