data_[Tb4Ho12In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ho  1.2300  1.7500  1.0410
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.5957]
_cell_length_b [5.2047]
_cell_length_c [6.8625]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.5009]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TbHo3In]
_chemical_formula_sum '[Tb4 Ho12 In4]'
_cell_volume [592.7310]
_cell_formula_units_Z [4]
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  4  0.1093  0.5000  0.4950  1.0
  Ho  Ho1  4  0.0037  0.0000  0.7512  1.0
  Ho  Ho2  4  0.1097  0.5000  0.0020  1.0
  Ho  Ho3  4  0.2044  0.0000  0.2501  1.0
  In  In4  4  0.1974  0.0000  0.7524  1.0
]