data_[Ag1Bi2I1O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Bi  2.0200  1.6000  1.0350
  I  2.6600  1.4000  1.2733
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0265]
_cell_length_b [5.0688]
_cell_length_c [7.0644]
_cell_angle_alpha [84.5653]
_cell_angle_beta [85.8946]
_cell_angle_gamma [87.3130]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [AgBi2IO8]
_chemical_formula_sum '[Ag1 Bi2 I1 O8]'
_cell_volume [178.5717]
_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
[
  Ag  Ag0  1  0.0000  0.0000  0.5000  1.0
  Bi  Bi1  2  0.4776  0.4915  0.2542  1.0
  I  I2  1  0.0000  0.0000  0.0000  1.0
  O  O3  2  0.1412  0.1515  0.2190  1.0
  O  O4  2  0.1682  0.2458  0.8157  1.0
  O  O5  2  0.3044  0.7606  0.9874  1.0
  O  O6  2  0.3060  0.7102  0.5015  1.0
]