data_[Rb6Pr4Bi2Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Pr  1.1300  1.8500  1.0600
  Bi  2.0200  1.6000  1.0350
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.0980]
_cell_length_b [14.0230]
_cell_length_c [8.9855]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.4912]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Rb3Pr2BiTe6]
_chemical_formula_sum '[Rb6 Pr4 Bi2 Te12]'
_cell_volume [973.1950]
_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
[
  Rb  Rb0  4  0.0000  0.1671  0.5000  1.0
  Rb  Rb1  2  0.0000  0.5000  0.5000  1.0
  Pr  Pr2  4  0.0000  0.3334  0.0000  1.0
  Bi  Bi3  2  0.0000  0.0000  0.0000  1.0
  Te  Te4  8  0.2331  0.1649  0.2045  1.0
  Te  Te5  4  0.2385  0.5000  0.2047  1.0
]