data_[Tm20Pd8Pt8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [14.6018]
_cell_length_b [7.4200]
_cell_length_c [7.5610]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Tm5(PdPt)2]
_chemical_formula_sum '[Tm20 Pd8 Pt8]'
_cell_volume [819.2037]
_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
[
  Tm  Tm0  16  0.1362  0.1704  0.3331  1.0
  Tm  Tm1  4  0.0000  0.0000  0.0000  1.0
  Pd  Pd2  8  0.2036  0.0000  0.0000  1.0
  Pt  Pt3  8  0.0000  0.1338  0.6339  1.0
]