data_[Rb8Hf4In4Te20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Hf  1.3000  1.5500  0.8500
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.1776]
_cell_length_b [22.0770]
_cell_length_c [15.9348]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Rb2HfInTe5]
_chemical_formula_sum '[Rb8 Hf4 In4 Te20]'
_cell_volume [1469.6519]
_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  0.0000  0.1311  0.6926  1.0
  Rb  Rb1  4  0.0000  0.1343  0.3196  1.0
  Hf  Hf2  4  0.0000  0.2077  0.0227  1.0
  In  In3  4  0.0000  0.4343  0.4248  1.0
  Te  Te4  4  0.0000  0.0678  0.0453  1.0
  Te  Te5  4  0.0000  0.2983  0.6458  1.0
  Te  Te6  4  0.0000  0.3048  0.3895  1.0
  Te  Te7  4  0.0000  0.3325  0.0076  1.0
  Te  Te8  4  0.0000  0.4972  0.2762  1.0
]