data_[K4La4Zn4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  La  1.1000  1.9500  1.1720
  Zn  1.6500  1.3500  0.8800
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [20.7105]
_cell_length_b [4.6861]
_cell_length_c [9.1759]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.3330]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [KLaZnTe3]
_chemical_formula_sum '[K4 La4 Zn4 Te12]'
_cell_volume [866.5250]
_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
[
  K  K0  4  0.1281  0.0000  0.5703  1
  La  La1  4  0.1688  0.0000  0.0778  1
  Zn  Zn2  4  0.0369  0.5000  0.2346  1
  Te  Te3  4  0.1676  0.5000  0.3179  1
  Te  Te4  4  0.1734  0.5000  0.8499  1
  Te  Te5  2  0.0000  0.0000  0.0000  1
  Te  Te6  2  0.0000  0.5000  0.5000  1
]