data_[Er6Cd3In3Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.9148]
_cell_length_b [4.9148]
_cell_length_c [24.0927]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Er2CdInAu4]
_chemical_formula_sum '[Er6 Cd3 In3 Au12]'
_cell_volume [504.0038]
_cell_formula_units_Z [3]
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
[
  Er  Er0  6  0.0000  0.0000  0.2500  1.0
  Cd  Cd1  3  0.0000  0.0000  0.0000  1.0
  In  In2  3  -0.0000  -0.0000  0.5000  1.0
  Au  Au3  6  0.0000  0.0000  0.1243  1.0
  Au  Au4  6  0.0000  0.0000  0.3749  1.0
]