data_[Y16Tl4Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Tl  1.6200  1.9000  1.3325
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.1002]
_cell_length_b [5.0908]
_cell_length_c [6.7596]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.4579]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Y8Tl2Pt]
_chemical_formula_sum '[Y16 Tl4 Pt2]'
_cell_volume [639.2229]
_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
[
  Y  Y0  4  0.0198  0.0000  0.7800  1.0
  Y  Y1  4  0.0890  0.5000  0.4544  1.0
  Y  Y2  4  0.1480  0.5000  0.9894  1.0
  Y  Y3  4  0.2116  0.0000  0.3230  1.0
  Tl  Tl4  4  0.1837  0.0000  0.7570  1.0
  Pt  Pt5  2  0.0000  0.5000  0.0000  1.0
]