data_[Cs2Y10Te16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Y  1.2200  1.8000  1.0400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [22.6557]
_cell_length_b [4.4116]
_cell_length_c [10.8840]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.0339]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsY5Te8]
_chemical_formula_sum '[Cs2 Y10 Te16]'
_cell_volume [1055.3745]
_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
  Y  Y1  4  0.1560  0.5000  0.9691  1
  Y  Y2  4  0.2048  0.5000  0.3443  1
  Y  Y3  2  0.0000  0.0000  0.0000  1
  Te  Te4  4  0.0760  0.5000  0.1614  1
  Te  Te5  4  0.0832  0.0000  0.8127  1
  Te  Te6  4  0.1647  0.0000  0.4983  1
  Te  Te7  4  0.2342  0.0000  0.1551  1
]