data_[Li8Sc4Au4O16]
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
  Au  2.5400  1.3500  1.0700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.3866]
_cell_length_b [8.3605]
_cell_length_c [6.5692]
_cell_angle_alpha [90.0000]
_cell_angle_beta [128.5552]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li2ScAuO4]
_chemical_formula_sum '[Li8 Sc4 Au4 O16]'
_cell_volume [360.1993]
_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  0.0000  0.5000  0.0000  1.0
  Li  Li1  4  0.2500  0.2500  0.5000  1.0
  Sc  Sc2  4  0.0000  0.0000  0.0000  1.0
  Au  Au3  4  0.2500  0.2500  0.0000  1.0
  O  O4  8  0.0489  0.2477  0.0799  1.0
  O  O5  8  0.2172  0.0090  0.9281  1.0
]