data_[Ba8Li6Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Li  0.9800  1.4500  0.9000
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.7327]
_cell_length_b [4.6268]
_cell_length_c [7.8087]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.9479]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba4Li3Pt2]
_chemical_formula_sum '[Ba8 Li6 Pt4]'
_cell_volume [609.4881]
_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  0.0608  0.5000  0.8219  1
  Ba  Ba1  4  0.2343  0.0000  0.7003  1
  Li  Li2  4  0.1014  0.0000  0.2750  1
  Li  Li3  2  0.0000  0.0000  0.5000  1
  Pt  Pt4  4  0.1140  0.5000  0.4586  1
]