data_[Cu3Pt5]
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 [P1]
_cell_length_a [4.7168]
_cell_length_b [4.7205]
_cell_length_c [5.4735]
_cell_angle_alpha [73.2302]
_cell_angle_beta [89.9877]
_cell_angle_gamma [80.3760]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Cu3Pt5]
_chemical_formula_sum '[Cu3 Pt5]'
_cell_volume [114.8954]
_cell_formula_units_Z [1]
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  1  0.0000  0.0025  0.9974  1.0
  Cu  Cu1  1  0.2471  0.4994  0.8752  1.0
  Cu  Cu2  1  0.7525  0.4967  0.6281  1.0
  Pt  Pt3  1  0.2487  0.5026  0.3783  1.0
  Pt  Pt4  1  0.4976  0.0011  0.2470  1.0
  Pt  Pt5  1  0.4995  0.9977  0.7528  1.0
  Pt  Pt6  1  0.7556  0.5017  0.1140  1.0
  Pt  Pt7  1  0.9990  0.9983  0.5072  1.0
]