data_[Cs10Te8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.8538]
_cell_length_b [6.0319]
_cell_length_c [13.0237]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.0865]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs5Te4]
_chemical_formula_sum '[Cs10 Te8]'
_cell_volume [928.8930]
_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  4  0.1164  0.5000  0.8182  1.0
  Cs  Cs1  4  0.2003  0.0000  0.3738  1.0
  Cs  Cs2  2  0.0000  0.0000  0.0000  1.0
  Te  Te3  4  0.1014  0.0000  0.6216  1.0
  Te  Te4  4  0.1740  0.5000  0.1549  1.0
]