data_[Li4Zn12Au4]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.6647]
_cell_length_b [6.7913]
_cell_length_c [9.2708]
_cell_angle_alpha [90.0000]
_cell_angle_beta [133.7463]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [LiZn3Au]
_chemical_formula_sum '[Li4 Zn12 Au4]'
_cell_volume [303.1347]
_cell_formula_units_Z [4]
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  0.3600  0.1223  0.8131  1
  Zn  Zn1  4  0.0192  0.1263  0.2832  1
  Zn  Zn2  4  0.2147  0.0923  0.0482  1
  Zn  Zn3  4  0.4311  0.6334  0.8732  1
  Au  Au4  4  0.1999  0.6681  0.0424  1
]