data_[Al2Ag6Te6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.1731]
_cell_length_b [8.4848]
_cell_length_c [18.4841]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Al(AgTe)3]
_chemical_formula_sum '[Al2 Ag6 Te6]'
_cell_volume [1438.6583]
_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
[
  Al  Al0  2  0.2131  0.5000  0.5302  1
  Ag  Ag1  4  0.4878  0.2171  0.4974  1
  Ag  Ag2  2  0.3908  0.5000  0.4204  1
  Te  Te3  4  0.2412  0.2229  0.5810  1
  Te  Te4  2  0.0924  0.5000  0.3925  1
]