data_[Cs2Sb6Te14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Sb  2.0500  1.4500  0.8300
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.1338]
_cell_length_b [10.5271]
_cell_length_c [7.4685]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.5129]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsSb3Te7]
_chemical_formula_sum '[Cs2 Sb6 Te14]'
_cell_volume [880.3156]
_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  0.5000  0.5000  1
  Sb  Sb1  4  0.0000  0.2063  0.0000  1
  Sb  Sb2  2  0.0000  0.0000  0.5000  1
  Te  Te3  8  0.1518  0.2111  0.7938  1
  Te  Te4  4  0.1521  0.0000  0.2977  1
  Te  Te5  2  0.0000  0.5000  0.0000  1
]