data_[Li8Si8Pt16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Si  1.9000  1.1000  0.5400
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [13.0092]
_cell_length_b [6.9441]
_cell_length_c [5.3448]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [LiSiPt2]
_chemical_formula_sum '[Li8 Si8 Pt16]'
_cell_volume [482.8357]
_cell_formula_units_Z [8]
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  4  0.1244  0.2500  0.6709  1
  Li  Li1  4  0.1281  0.7500  0.5229  1
  Si  Si2  4  0.0655  0.7500  0.0197  1
  Si  Si3  4  0.1811  0.2500  0.1821  1
  Pt  Pt4  8  0.0342  0.0391  0.2615  1
  Pt  Pt5  8  0.2125  0.5447  0.9514  1
]