data_[Ba12Tl6Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Tl  1.6200  1.9000  1.3325
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.4381]
_cell_length_b [9.4246]
_cell_length_c [13.4223]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.5463]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ba6Tl3Pt]
_chemical_formula_sum '[Ba12 Tl6 Pt2]'
_cell_volume [928.6143]
_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
[
  Ba  Ba0  4  0.0804  0.0524  0.2468  1
  Ba  Ba1  4  0.2144  0.7018  0.0711  1
  Ba  Ba2  4  0.3687  0.1563  0.0579  1
  Tl  Tl3  4  0.3133  0.1159  0.7561  1
  Tl  Tl4  2  0.5000  0.0000  0.5000  1
  Pt  Pt5  2  0.0000  0.0000  0.0000  1
]