data_[Li2Ag6Te8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [11.0628]
_cell_length_b [4.9883]
_cell_length_c [8.2531]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [LiAg3Te4]
_chemical_formula_sum '[Li2 Ag6 Te8]'
_cell_volume [455.4471]
_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
[
  Li  Li0  2  0.0000  0.5590  0.0187  1.0
  Ag  Ag1  4  0.2193  0.7424  0.5215  1.0
  Ag  Ag2  2  0.0000  0.0913  0.5055  1.0
  Te  Te3  4  0.2284  0.7582  0.8616  1.0
  Te  Te4  2  0.0000  0.0730  0.8469  1.0
  Te  Te5  2  0.0000  0.5789  0.3475  1.0
]