data_[Li8Ge12Pt16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ge  2.0100  1.2500  0.7700
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [5.7610]
_cell_length_b [14.7432]
_cell_length_c [7.1246]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Li2Ge3Pt4]
_chemical_formula_sum '[Li8 Ge12 Pt16]'
_cell_volume [605.1298]
_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  8  0.0000  0.0908  0.5947  1.0
  Ge  Ge1  8  0.2500  0.2388  0.2500  1.0
  Ge  Ge2  4  0.0000  0.0000  0.0000  1.0
  Pt  Pt3  8  0.0000  0.1747  0.9681  1.0
  Pt  Pt4  8  0.2500  0.0680  0.2500  1.0
]