data_[Er4Cd1Rh5]
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
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.3872]
_cell_length_b [3.3872]
_cell_length_c [16.5184]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Er4CdRh5]
_chemical_formula_sum '[Er4 Cd1 Rh5]'
_cell_volume [189.5123]
_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
[
  Er  Er0  2  0.0000  0.0000  0.1910  1
  Er  Er1  2  0.0000  0.0000  0.3971  1
  Cd  Cd2  1  0.0000  0.0000  0.0000  1
  Rh  Rh3  2  0.5000  0.5000  0.0961  1
  Rh  Rh4  2  0.5000  0.5000  0.2968  1
  Rh  Rh5  1  0.5000  0.5000  0.5000  1
]