data_[Ti4Ru4Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Ru  2.2000  1.3000  0.6610
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [3.7570]
_cell_length_b [3.9923]
_cell_length_c [11.9982]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [TiRuPt]
_chemical_formula_sum '[Ti4 Ru4 Pt4]'
_cell_volume [179.9632]
_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
[
  Ti  Ti0  2  0.0000  0.0000  0.6286  1.0
  Ti  Ti1  2  0.0000  0.0000  0.9374  1.0
  Ru  Ru2  2  0.5000  0.0000  0.1183  1.0
  Ru  Ru3  2  0.5000  0.0000  0.7833  1.0
  Pt  Pt4  2  0.0000  0.0000  0.2831  1.0
  Pt  Pt5  2  0.5000  0.0000  0.4527  1.0
]