data_[Tb2Tm4Ir4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Tm  1.2500  1.7500  1.0950
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.4524]
_cell_length_b [4.3820]
_cell_length_c [10.2934]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.1720]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Tb(TmIr)2]
_chemical_formula_sum '[Tb2 Tm4 Ir4]'
_cell_volume [244.0108]
_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  2  0.4016  0.7500  0.2098  1.0
  Tm  Tm1  2  0.1079  0.7500  0.8833  1.0
  Tm  Tm2  2  0.2501  0.7500  0.5295  1.0
  Ir  Ir3  2  0.2295  0.2500  0.3598  1.0
  Ir  Ir4  2  0.3429  0.2500  0.0245  1.0
]