data_[La10Ag2Te16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [9.5828]
_cell_length_b [9.5828]
_cell_length_c [9.8420]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [La5AgTe8]
_chemical_formula_sum '[La10 Ag2 Te16]'
_cell_volume [903.7962]
_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
[
  La  La0  8  0.1268  0.2481  0.1182  1.0
  La  La1  2  0.0000  0.0000  0.5000  1.0
  Ag  Ag2  2  0.0000  0.5000  0.7500  1.0
  Te  Te3  8  0.0691  0.1854  0.7923  1.0
  Te  Te4  8  0.0792  0.3207  0.4366  1.0
]