data_[Tl4Pd6Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [4.1593]
_cell_length_b [12.8471]
_cell_length_c [4.0459]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Tl2Pd3Pt]
_chemical_formula_sum '[Tl4 Pd6 Pt2]'
_cell_volume [216.1891]
_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
[
  Tl  Tl0  4  0.0000  0.3452  0.0000  1.0
  Pd  Pd1  4  0.0000  0.1655  0.5000  1.0
  Pd  Pd2  2  0.0000  0.5000  0.5000  1.0
  Pt  Pt3  2  0.0000  0.0000  0.0000  1.0
]