data_[Li12P4Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  P  2.1900  1.0000  0.5500
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.2387]
_cell_length_b [6.1439]
_cell_length_c [6.7478]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.6859]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li6P2Pt]
_chemical_formula_sum '[Li12 P4 Pt2]'
_cell_volume [312.7882]
_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
[
  Li  Li0  8  0.0772  0.2730  0.3512  1.0
  Li  Li1  4  0.2500  0.2500  0.0000  1.0
  P  P2  4  0.2145  0.5000  0.7051  1.0
  Pt  Pt3  2  0.0000  0.0000  0.0000  1.0
]