data_[Ba10Bi4Sb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Bi  2.0200  1.6000  1.0350
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [9.4339]
_cell_length_b [14.5602]
_cell_length_c [5.3326]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [Ba5Bi2Sb]
_chemical_formula_sum '[Ba10 Bi4 Sb2]'
_cell_volume [732.4876]
_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  0.1597  0.7899  0.0000  1
  Ba  Ba1  4  0.1920  0.0850  0.5000  1
  Ba  Ba2  2  0.0000  0.5000  0.0000  1
  Bi  Bi3  4  0.0663  0.3296  0.5000  1
  Sb  Sb4  2  0.0000  0.0000  0.0000  1
]