data_[Cs4Sn6Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Sn  1.9600  1.4500  0.8300
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.0616]
_cell_length_b [5.2315]
_cell_length_c [8.6126]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.4099]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs2Sn3Bi2]
_chemical_formula_sum '[Cs4 Sn6 Bi4]'
_cell_volume [557.2687]
_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
[
  Cs  Cs0  4  0.1511  0.0000  0.7873  1.0
  Sn  Sn1  4  0.0931  0.5000  0.4084  1.0
  Sn  Sn2  2  0.0000  0.5000  0.0000  1.0
  Bi  Bi3  4  0.1569  0.0000  0.2772  1.0
]