data_[Ba4Zn2Sb10]
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
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [7.0974]
_cell_length_b [7.0974]
_cell_length_c [10.3784]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [Ba2ZnSb5]
_chemical_formula_sum '[Ba4 Zn2 Sb10]'
_cell_volume [522.7914]
_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
[
  Ba  Ba0  4  0.0000  0.5000  0.2580  1
  Zn  Zn1  2  0.0000  0.0000  0.9397  1
  Sb  Sb2  8  0.2252  0.2252  0.5081  1
  Sb  Sb3  2  0.0000  0.0000  0.2351  1
]