data_[Er2Cd4Pd16]
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
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.5669]
_cell_length_b [4.1583]
_cell_length_c [6.4107]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.5313]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Er(CdPd4)2]
_chemical_formula_sum '[Er2 Cd4 Pd16]'
_cell_volume [374.1349]
_cell_formula_units_Z [2]
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  0.5000  0.0000  1.0
  Cd  Cd1  4  0.2248  0.0000  0.6473  1.0
  Pd  Pd2  4  0.0421  0.0000  0.7216  1.0
  Pd  Pd3  4  0.0914  0.5000  0.4605  1.0
  Pd  Pd4  4  0.1382  0.0000  0.1835  1.0
  Pd  Pd5  4  0.1811  0.5000  0.9112  1.0
]