data_[Sm6Y4Cd6]
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 [Immm]
_cell_length_a [3.7791]
_cell_length_b [5.4728]
_cell_length_c [22.4728]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Sm3Y2Cd3]
_chemical_formula_sum '[Sm6 Y4 Cd6]'
_cell_volume [464.7902]
_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
[
  Sm  Sm0  4  0.0000  0.0000  0.3772  1.0
  Sm  Sm1  2  0.0000  0.5000  0.5000  1.0
  Y  Y2  4  0.0000  0.5000  0.2663  1.0
  Cd  Cd3  4  0.0000  0.0000  0.1191  1.0
  Cd  Cd4  2  0.0000  0.5000  0.0000  1.0
]