data_[La8Sm18Cd22]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sm  1.1700  1.8500  1.2290
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [16.1905]
_cell_length_b [23.7297]
_cell_length_c [3.5624]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [La4Sm9Cd11]
_chemical_formula_sum '[La8 Sm18 Cd22]'
_cell_volume [1368.6811]
_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
[
  La  La0  8  0.1668  0.4171  0.5000  1
  Sm  Sm1  8  0.1093  0.0972  0.5000  1
  Sm  Sm2  8  0.1161  0.2732  0.5000  1
  Sm  Sm3  2  0.0000  0.5000  0.5000  1
  Cd  Cd4  8  0.2248  0.1839  0.0000  1
  Cd  Cd5  4  0.0000  0.1872  0.0000  1
  Cd  Cd6  4  0.0000  0.3699  0.0000  1
  Cd  Cd7  4  0.2008  0.0000  0.0000  1
  Cd  Cd8  2  0.0000  0.0000  0.0000  1
]