data_[Cs4In4As8Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  In  1.7800  1.5500  0.9400
  As  2.1800  1.1500  0.6600
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.0740]
_cell_length_b [4.4372]
_cell_length_c [11.6783]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.4019]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsInAs2Pb]
_chemical_formula_sum '[Cs4 In4 As8 Pb4]'
_cell_volume [753.8176]
_cell_formula_units_Z [4]
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  0.1972  0.0000  0.6429  1.0
  In  In1  4  0.0537  0.0000  0.1730  1.0
  As  As2  4  0.0850  0.5000  0.3282  1.0
  As  As3  4  0.1427  0.0000  0.0459  1.0
  Pb  Pb4  4  0.1193  0.5000  0.8695  1.0
]