data_[Ba4Ag8Bi10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ag  1.9300  1.6000  1.0867
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [6.8852]
_cell_length_b [9.6529]
_cell_length_c [10.2993]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Ba2Ag4Bi5]
_chemical_formula_sum '[Ba4 Ag8 Bi10]'
_cell_volume [684.5181]
_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  0.2660  0.0000  1.0
  Ag  Ag1  8  0.0000  0.2635  0.3562  1.0
  Bi  Bi2  8  0.2479  0.0000  0.2222  1.0
  Bi  Bi3  2  0.0000  0.0000  0.5000  1.0
]