data_[Y6Mg4Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Mg  1.3100  1.5000  0.8600
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.8726]
_cell_length_b [5.0650]
_cell_length_c [6.7311]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.0773]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Y3(MgCd)2]
_chemical_formula_sum '[Y6 Mg4 Cd4]'
_cell_volume [369.7393]
_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
[
  Y  Y0  4  0.1129  0.5000  0.7005  1
  Y  Y1  2  0.0000  0.0000  0.0000  1
  Mg  Mg2  4  0.1924  0.5000  0.1894  1
  Cd  Cd3  4  0.1196  0.0000  0.4320  1
]