data_[Ta2Cd4Co2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Cd  1.6900  1.5500  1.0900
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [3.9351]
_cell_length_b [3.9351]
_cell_length_c [8.9662]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [139]
_chemical_formula_structural [TaCd2Co]
_chemical_formula_sum '[Ta2 Cd4 Co2]'
_cell_volume [138.8391]
_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
[
  Ta  Ta0  2  0.0000  0.0000  0.0000  1
  Cd  Cd1  4  0.0000  0.5000  0.2500  1
  Co  Co2  2  0.0000  0.0000  0.5000  1
]