data_[Ba4Zn4Cd4Sb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Zn  1.6500  1.3500  0.8800
  Cd  1.6900  1.5500  1.0900
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.8470]
_cell_length_b [4.7535]
_cell_length_c [10.0598]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.6090]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [BaZnCdSb2]
_chemical_formula_sum '[Ba4 Zn4 Cd4 Sb8]'
_cell_volume [657.7534]
_cell_formula_units_Z [4]
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
[
  Ba  Ba0  4  0.1766  0.5000  0.7009  1.0
  Zn  Zn1  4  0.1675  0.5000  0.0905  1.0
  Cd  Cd2  4  0.0429  0.0000  0.2250  1.0
  Sb  Sb3  4  0.1239  0.5000  0.3508  1.0
  Sb  Sb4  4  0.1355  0.0000  0.9478  1.0
]