data_[Li12Zn6Ag2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Zn  1.6500  1.3500  0.8800
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Pnnm]
_cell_length_a [7.8728]
_cell_length_b [9.6687]
_cell_length_c [4.6470]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [58]
_chemical_formula_structural [Li6Zn3Ag]
_chemical_formula_sum '[Li12 Zn6 Ag2]'
_cell_volume [353.7301]
_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  0.1630  0.0919  0.5000  1.0
  Li  Li1  4  0.1639  0.4103  0.5000  1.0
  Li  Li2  4  0.1731  0.7473  0.5000  1.0
  Zn  Zn3  4  0.0104  0.7439  0.0000  1.0
  Zn  Zn4  2  0.0000  0.5000  0.0000  1.0
  Ag  Ag5  2  0.0000  0.0000  0.0000  1.0
]