data_[Cs4Sb4Te8]
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 [P2/c]
_cell_length_a [7.6794]
_cell_length_b [7.6698]
_cell_length_c [14.4503]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.7516]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [CsSbTe2]
_chemical_formula_sum '[Cs4 Sb4 Te8]'
_cell_volume [805.9362]
_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
[
  Cs  Cs0  4  0.3475  0.2631  0.8903  1
  Sb  Sb1  4  0.0688  0.1921  0.1174  1
  Te  Te2  4  0.1441  0.1659  0.6104  1
  Te  Te3  4  0.2651  0.2212  0.3423  1
]