data_[Li4Cu4Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cu  1.9000  1.3500  0.8200
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [4.7118]
_cell_length_b [8.0346]
_cell_length_c [4.6068]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.2727]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [LiCuPt]
_chemical_formula_sum '[Li4 Cu4 Pt4]'
_cell_volume [162.5181]
_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  0.5962  0.0000  1
  Li  Li1  2  0.0000  0.9279  0.0000  1
  Cu  Cu2  2  0.0000  0.0983  0.5000  1
  Cu  Cu3  2  0.0000  0.2626  0.0000  1
  Pt  Pt4  2  0.0000  0.4271  0.5000  1
  Pt  Pt5  2  0.0000  0.7631  0.5000  1
]