data_[Ba4Mg2Cd20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Mg  1.3100  1.5000  0.8600
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [9.9813]
_cell_length_b [12.3071]
_cell_length_c [6.4820]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [Ba2MgCd10]
_chemical_formula_sum '[Ba4 Mg2 Cd20]'
_cell_volume [796.2512]
_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
[
  Ba  Ba0  4  0.2367  0.9369  0.5000  1
  Mg  Mg1  2  0.0000  0.0000  0.0000  1
  Cd  Cd2  8  0.0772  0.1905  0.2784  1
  Cd  Cd3  4  0.0478  0.3836  0.0000  1
  Cd  Cd4  4  0.1735  0.7995  0.0000  1
  Cd  Cd5  4  0.2296  0.5678  0.0000  1
]