data_[Li7Ag1Au2]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [4.4517]
_cell_length_b [4.4517]
_cell_length_c [9.8999]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [Li7AgAu2]
_chemical_formula_sum '[Li7 Ag1 Au2]'
_cell_volume [169.9096]
_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
[
  Li  Li0  1  0.0000  0.0000  0.3372  1.0
  Li  Li1  1  0.0000  0.0000  0.7356  1.0
  Li  Li2  1  0.3333  0.6667  0.5504  1.0
  Li  Li3  1  0.3333  0.6667  0.9715  1.0
  Li  Li4  1  0.6667  0.3333  0.1505  1.0
  Li  Li5  1  0.6667  0.3333  0.3950  1.0
  Li  Li6  1  0.6667  0.3333  0.8923  1.0
  Ag  Ag7  1  0.0000  0.0000  0.0538  1.0
  Au  Au8  1  0.3333  0.6667  0.2531  1.0
  Au  Au9  1  0.6667  0.3333  0.6440  1.0
]