data_[Tl8Pd8Pt4]
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 [Cmc2_1]
_cell_length_a [4.2574]
_cell_length_b [15.4758]
_cell_length_c [5.8014]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Tl2Pd2Pt]
_chemical_formula_sum '[Tl8 Pd8 Pt4]'
_cell_volume [382.2400]
_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
[
  Tl  Tl0  4  0.0000  0.2057  0.1383  1.0
  Tl  Tl1  4  0.0000  0.4228  0.9488  1.0
  Pd  Pd2  4  0.0000  0.0107  0.1892  1.0
  Pd  Pd3  4  0.0000  0.1746  0.6504  1.0
  Pt  Pt4  4  0.0000  0.3912  0.4390  1.0
]