data_[Zn4Cd2Te2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Cd  1.6900  1.5500  1.0900
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.0702]
_cell_length_b [7.7855]
_cell_length_c [4.0052]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.2681]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zn2CdTe]
_chemical_formula_sum '[Zn4 Cd2 Te2]'
_cell_volume [181.7056]
_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
[
  Zn  Zn0  4  0.2500  0.2500  0.0000  1
  Cd  Cd1  2  0.0000  0.5000  0.5000  1
  Te  Te2  2  0.0000  0.0000  0.5000  1
]