data_[Cu14Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.4838]
_cell_length_b [3.7852]
_cell_length_c [5.2608]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.7139]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cu7Pt3]
_chemical_formula_sum '[Cu14 Pt6]'
_cell_volume [261.9231]
_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
[
  Cu  Cu0  4  0.0987  0.5000  0.3027  1.0
  Cu  Cu1  4  0.0993  0.5000  0.8045  1.0
  Cu  Cu2  4  0.1997  0.0000  0.1006  1.0
  Cu  Cu3  2  0.0000  0.0000  0.5000  1.0
  Pt  Pt4  4  0.1965  0.0000  0.6065  1.0
  Pt  Pt5  2  0.0000  0.0000  0.0000  1.0
]