data_[Cs10Te4Se10]
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
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.7546]
_cell_length_b [5.4660]
_cell_length_c [14.9825]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5540]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs5Te2Se5]
_chemical_formula_sum '[Cs10 Te4 Se10]'
_cell_volume [931.7480]
_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  0.1846  0.5000  0.0669  1
  Cs  Cs1  4  0.2214  0.0000  0.6594  1
  Cs  Cs2  2  0.0000  0.5000  0.5000  1
  Te  Te3  4  0.0292  0.0000  0.2073  1
  Se  Se4  4  0.0494  0.5000  0.7987  1
  Se  Se5  4  0.1129  0.0000  0.3924  1
  Se  Se6  2  0.0000  0.0000  0.0000  1
]