data_[K2Zr10Te16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Zr  1.3300  1.5500  0.8600
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [21.2286]
_cell_length_b [3.9736]
_cell_length_c [10.2213]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5710]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [KZr5Te8]
_chemical_formula_sum '[K2 Zr10 Te16]'
_cell_volume [834.4786]
_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
[
  K  K0  2  0.0000  0.5000  0.5000  1
  Zr  Zr1  4  0.1478  0.5000  0.0000  1
  Zr  Zr2  4  0.2096  0.5000  0.3505  1
  Zr  Zr3  2  0.0000  0.0000  0.0000  1
  Te  Te4  4  0.0715  0.5000  0.1908  1
  Te  Te5  4  0.0840  0.0000  0.8067  1
  Te  Te6  4  0.1568  0.0000  0.5043  1
  Te  Te7  4  0.2434  0.0000  0.1587  1
]