data_[Rb12Th9Mg3Te24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Th  1.3000  1.8000  1.0800
  Mg  1.3100  1.5000  0.8600
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [9.0931]
_cell_length_b [9.0931]
_cell_length_c [25.8939]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Rb4Th3MgTe8]
_chemical_formula_sum '[Rb12 Th9 Mg3 Te24]'
_cell_volume [1854.1731]
_cell_formula_units_Z [3]
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  9  0.0000  0.5000  0.5000  1
  Rb  Rb1  3  -0.0000  -0.0000  0.5000  1
  Th  Th2  9  0.0000  0.5000  0.0000  1
  Mg  Mg3  3  -0.0000  -0.0000  0.0000  1
  Te  Te4  18  0.0089  0.5044  0.7334  1
  Te  Te5  6  0.0000  0.0000  0.2630  1
]