data_[Cs10Ga4Bi10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ga  1.8100  1.3000  0.7600
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [20.4655]
_cell_length_b [5.3793]
_cell_length_c [13.6737]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.2312]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs5Ga2Bi5]
_chemical_formula_sum '[Cs10 Ga4 Bi10]'
_cell_volume [1244.5735]
_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  0.1113  0.5000  0.8875  1
  Cs  Cs1  4  0.1381  0.5000  0.2967  1
  Cs  Cs2  2  0.0000  0.0000  0.5000  1
  Ga  Ga3  4  0.1702  0.0000  0.1378  1
  Bi  Bi4  4  0.1862  0.5000  0.6424  1
  Bi  Bi5  4  0.2081  0.0000  0.7827  1
  Bi  Bi6  2  0.0000  0.0000  0.0000  1
]