data_[Ce4Dy4Pb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Dy  1.2200  1.7500  1.1310
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [9.7705]
_cell_length_b [9.0304]
_cell_length_c [7.2358]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [CeDyPb3]
_chemical_formula_sum '[Ce4 Dy4 Pb12]'
_cell_volume [638.4269]
_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
[
  Ce  Ce0  4  0.0959  0.7500  0.9464  1
  Dy  Dy1  4  0.0000  0.0000  0.5000  1
  Pb  Pb2  8  0.2012  0.0642  0.1592  1
  Pb  Pb3  4  0.1632  0.2500  0.7678  1
]