data_[Rb4Na4Pb4Se8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Na  0.9300  1.8000  1.1600
  Pb  2.3300  1.8000  1.1225
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.2659]
_cell_length_b [4.8630]
_cell_length_c [9.8691]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.2733]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [RbNaPbSe2]
_chemical_formula_sum '[Rb4 Na4 Pb4 Se8]'
_cell_volume [775.9885]
_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
[
  Rb  Rb0  4  0.1809  0.5000  0.6683  1.0
  Na  Na1  4  0.1895  0.5000  0.0554  1.0
  Pb  Pb2  4  0.0598  0.0000  0.1965  1.0
  Se  Se3  4  0.1283  0.0000  0.9344  1.0
  Se  Se4  4  0.1451  0.5000  0.3230  1.0
]