data_[Ho4Cu4Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Cu  1.9000  1.3500  0.8200
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.5809]
_cell_length_b [3.8574]
_cell_length_c [4.9517]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.7335]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [HoCuAu]
_chemical_formula_sum '[Ho4 Cu4 Au4]'
_cell_volume [236.0996]
_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
[
  Ho  Ho0  4  0.1107  0.0000  0.7988  1.0
  Cu  Cu1  4  0.2323  0.0000  0.3454  1.0
  Au  Au2  4  0.0775  0.5000  0.2709  1.0
]