data_[Ag2Te4I3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.3980]
_cell_length_b [6.9431]
_cell_length_c [11.2097]
_cell_angle_alpha [73.6356]
_cell_angle_beta [86.2826]
_cell_angle_gamma [75.0805]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Ag2Te4I3]
_chemical_formula_sum '[Ag2 Te4 I3]'
_cell_volume [317.3473]
_cell_formula_units_Z [1]
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
[
  Ag  Ag0  2  0.4160  0.2144  0.2797  1
  Te  Te1  2  0.0944  0.6610  0.8764  1
  Te  Te2  2  0.1273  0.7803  0.5619  1
  I  I3  2  0.4750  0.2622  0.6770  1
  I  I4  1  0.0000  0.0000  0.0000  1
]