data_[Tb6Ho6Pt6]
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
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [4.7224]
_cell_length_b [12.1188]
_cell_length_c [7.9747]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [TbHoPt]
_chemical_formula_sum '[Tb6 Ho6 Pt6]'
_cell_volume [456.3888]
_cell_formula_units_Z [6]
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  0.5000  0.2090  0.9249  1.0
  Tb  Tb1  2  0.5000  0.0000  0.3479  1.0
  Ho  Ho2  4  0.0000  0.1366  0.6305  1.0
  Ho  Ho3  2  0.0000  0.0000  0.0208  1.0
  Pt  Pt4  4  0.0000  0.1589  0.2835  1.0
  Pt  Pt5  2  0.5000  0.0000  0.7334  1.0
]