data_[Sr2La10Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  La  1.1000  1.9500  1.1720
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [5.3702]
_cell_length_b [16.1519]
_cell_length_c [7.5430]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [SrLa5Au6]
_chemical_formula_sum '[Sr2 La10 Au12]'
_cell_volume [654.2758]
_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
[
  Sr  Sr0  2  0.0000  0.0000  0.0000  1
  La  La1  4  0.0000  0.3341  0.5000  1
  La  La2  4  0.0000  0.3369  0.0000  1
  La  La3  2  0.0000  0.0000  0.5000  1
  Au  Au4  8  0.0000  0.1729  0.2525  1
  Au  Au5  4  0.0000  0.5000  0.2630  1
]