data_[In6Ag2Te6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [19.9092]
_cell_length_b [9.0240]
_cell_length_c [10.9986]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [In3AgTe3]
_chemical_formula_sum '[In6 Ag2 Te6]'
_cell_volume [1976.0227]
_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
[
  In  In0  4  0.3767  0.0000  0.8288  1
  In  In1  2  0.5000  0.0000  0.5080  1
  Ag  Ag2  2  0.5000  0.0000  0.2560  1
  Te  Te3  4  0.5000  0.1965  0.7244  1
  Te  Te4  2  0.5000  0.0000  0.0014  1
]