data_[Cd4Fe2Tc2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Fe  1.8300  1.4000  0.8525
  Tc  1.9000  1.3500  0.7417
]
_symmetry_space_group_name_H-M [I-4m2]
_cell_length_a [4.1518]
_cell_length_b [4.1518]
_cell_length_c [7.7490]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [119]
_chemical_formula_structural [Cd2FeTc]
_chemical_formula_sum '[Cd4 Fe2 Tc2]'
_cell_volume [133.5743]
_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
[
  Cd  Cd0  2  0.0000  0.0000  0.0000  1
  Cd  Cd1  2  0.0000  0.5000  0.7500  1
  Fe  Fe2  2  0.0000  0.0000  0.5000  1
  Tc  Tc3  2  0.0000  0.5000  0.2500  1
]