data_[Cs2Al8Te14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Al  1.6100  1.2500  0.6750
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [17.0878]
_cell_length_b [7.2589]
_cell_length_c [6.9507]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [CsAl4Te7]
_chemical_formula_sum '[Cs2 Al8 Te14]'
_cell_volume [862.1539]
_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
[
  Cs  Cs0  2  0.0000  0.1725  0.9728  1
  Al  Al1  4  0.1219  0.6692  0.6031  1
  Al  Al2  4  0.2481  0.1814  0.5820  1
  Te  Te3  4  0.1162  0.3296  0.4697  1
  Te  Te4  4  0.1178  0.6760  0.9814  1
  Te  Te5  4  0.2454  0.1735  0.9728  1
  Te  Te6  2  0.0000  0.8507  0.4642  1
]