data_[Cu1Pd7Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.9167]
_cell_length_b [5.6717]
_cell_length_c [7.4776]
_cell_angle_alpha [100.5498]
_cell_angle_beta [109.0162]
_cell_angle_gamma [90.2967]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CuPd7Au4]
_chemical_formula_sum '[Cu1 Pd7 Au4]'
_cell_volume [193.3387]
_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  0.0000  0.0000  1
  Pd  Pd1  2  0.1660  0.9175  0.6732  1
  Pd  Pd2  2  0.3286  0.3294  0.3265  1
  Pd  Pd3  2  0.4984  0.2446  0.0016  1
  Pd  Pd4  1  0.0000  0.5000  0.0000  1
  Au  Au5  2  0.1716  0.4184  0.6685  1
  Au  Au6  2  0.3278  0.8364  0.3279  1
]