data_[Ba3Ho1Bi2O9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ho  1.2300  1.7500  1.0410
  Bi  2.0200  1.6000  1.0350
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.1908]
_cell_length_b [6.1908]
_cell_length_c [7.5822]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Ba3HoBi2O9]
_chemical_formula_sum '[Ba3 Ho1 Bi2 O9]'
_cell_volume [251.6669]
_cell_formula_units_Z [1]
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  2  0.3333  0.6667  0.3329  1.0
  Ba  Ba1  1  0.0000  0.0000  0.0000  1.0
  Ho  Ho2  1  0.0000  0.0000  0.5000  1.0
  Bi  Bi3  2  0.3333  0.6667  0.8285  1.0
  O  O4  6  0.1689  0.3377  0.6688  1.0
  O  O5  3  0.0000  0.5000  0.0000  1.0
]