data_[K2Al2Te2S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Al  1.6100  1.2500  0.6750
  Te  2.1000  1.4000  1.2933
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.8481]
_cell_length_b [7.0603]
_cell_length_c [8.7287]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.2948]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KAlTeS4]
_chemical_formula_sum '[K2 Al2 Te2 S8]'
_cell_volume [402.9428]
_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
[
  K  K0  2  0.2543  0.2500  0.0444  1.0
  Al  Al1  2  0.2643  0.7500  0.3364  1.0
  Te  Te2  2  0.2292  0.2500  0.5021  1.0
  S  S3  4  0.0421  0.5037  0.2913  1.0
  S  S4  2  0.4746  0.7500  0.5937  1.0
  S  S5  2  0.4959  0.7500  0.2047  1.0
]