data_[Li4Pt4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pt  2.2800  1.3500  0.8050
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [5.2622]
_cell_length_b [8.8641]
_cell_length_c [5.0676]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.2188]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [LiPtO3]
_chemical_formula_sum '[Li4 Pt4 O12]'
_cell_volume [220.3521]
_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
[
  Li  Li0  2  0.0000  0.6367  0.0000  1
  Li  Li1  2  0.0000  0.9958  0.0000  1
  Pt  Pt2  2  0.0000  0.1760  0.5000  1
  Pt  Pt3  2  0.0000  0.8355  0.5000  1
  O  O4  4  0.2112  0.0065  0.7397  1
  O  O5  4  0.2243  0.8203  0.2568  1
  O  O6  4  0.2384  0.1819  0.2697  1
]