data_[Ba2Sr2Lu2Bi2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sr  0.9500  2.0000  1.3200
  Lu  1.2700  1.7500  1.0010
  Bi  2.0200  1.6000  1.0350
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pc]
_cell_length_a [6.0189]
_cell_length_b [6.0483]
_cell_length_c [10.4268]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.3411]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [7]
_chemical_formula_structural [BaSrLuBiO6]
_chemical_formula_sum '[Ba2 Sr2 Lu2 Bi2 O12]'
_cell_volume [309.6280]
_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  2  0.7476  0.2634  0.7505  1.0
  Sr  Sr1  2  0.2614  0.2131  0.2505  1.0
  Lu  Lu2  2  0.5014  0.2533  0.0008  1.0
  Bi  Bi3  2  0.9996  0.2529  0.4994  1.0
  O  O4  2  0.1911  0.2270  0.7471  1.0
  O  O5  2  0.2511  0.4669  0.0418  1.0
  O  O6  2  0.2975  0.0206  0.5324  1.0
  O  O7  2  0.6763  0.4625  0.4578  1.0
  O  O8  2  0.7373  0.0156  0.9661  1.0
  O  O9  2  0.8367  0.2602  0.2537  1.0
]