data_[Mg2Cd12Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Cd  1.6900  1.5500  1.0900
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.8161]
_cell_length_b [2.9829]
_cell_length_c [10.1763]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.8733]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg(Cd3Pd)2]
_chemical_formula_sum '[Mg2 Cd12 Pd4]'
_cell_volume [374.0982]
_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
[
  Mg  Mg0  2  0.0000  0.0000  0.0000  1.0
  Cd  Cd1  4  0.0271  0.0000  0.7023  1.0
  Cd  Cd2  4  0.1702  0.5000  0.5511  1.0
  Cd  Cd3  4  0.2488  0.0000  0.1249  1.0
  Pd  Pd4  4  0.1305  0.5000  0.2460  1.0
]