data_[La4Pr12Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [5.4358]
_cell_length_b [17.1671]
_cell_length_c [7.2668]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [LaPr3Cd]
_chemical_formula_sum '[La4 Pr12 Cd4]'
_cell_volume [678.1181]
_cell_formula_units_Z [4]
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  4  0.0000  0.3877  0.5087  1.0
  Pr  Pr1  4  0.0000  0.0042  0.7529  1.0
  Pr  Pr2  4  0.0000  0.2085  0.2587  1.0
  Pr  Pr3  4  0.0000  0.3920  0.0016  1.0
  Cd  Cd4  4  0.0000  0.1961  0.7557  1.0
]