data_[Sm5Y4Cd1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Y  1.2200  1.8000  1.0400
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [3.6564]
_cell_length_b [3.6564]
_cell_length_c [24.0271]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Sm5Y4Cd]
_chemical_formula_sum '[Sm5 Y4 Cd1]'
_cell_volume [321.2255]
_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
[
  Sm  Sm0  2  0.5000  0.5000  0.0852  1.0
  Sm  Sm1  2  0.5000  0.5000  0.2930  1.0
  Sm  Sm2  1  0.5000  0.5000  0.5000  1.0
  Y  Y3  2  0.0000  0.0000  0.1903  1.0
  Y  Y4  2  0.0000  0.0000  0.3967  1.0
  Cd  Cd5  1  0.0000  0.0000  0.0000  1.0
]