data_[Na4Sc2Ag4Te8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Sc  1.3600  1.6000  0.8850
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.0298]
_cell_length_b [4.1646]
_cell_length_c [8.2109]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.9683]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na2Sc(AgTe2)2]
_chemical_formula_sum '[Na4 Sc2 Ag4 Te8]'
_cell_volume [500.8757]
_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
[
  Na  Na0  4  0.1290  0.0000  0.5891  1.0
  Sc  Sc1  2  0.0000  0.0000  0.0000  1.0
  Ag  Ag2  4  0.1803  0.5000  0.9731  1.0
  Te  Te3  4  0.0034  0.5000  0.2583  1.0
  Te  Te4  4  0.2026  0.0000  0.2221  1.0
]