data_[Li4Sc2Ag16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sc  1.3600  1.6000  0.8850
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.9129]
_cell_length_b [4.1205]
_cell_length_c [6.5760]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.7913]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2ScAg8]
_chemical_formula_sum '[Li4 Sc2 Ag16]'
_cell_volume [386.8568]
_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  4  0.2214  0.0000  0.6429  1.0
  Sc  Sc1  2  0.0000  0.5000  0.0000  1.0
  Ag  Ag2  4  0.0451  0.0000  0.7262  1.0
  Ag  Ag3  4  0.0973  0.5000  0.4592  1.0
  Ag  Ag4  4  0.1419  0.0000  0.1951  1.0
  Ag  Ag5  4  0.1830  0.5000  0.9154  1.0
]