data_[Sr6Al9Cr3Au36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Al  1.6100  1.2500  0.6750
  Cr  1.6600  1.4000  0.9400
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.6906]
_cell_length_b [8.6906]
_cell_length_c [19.8991]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Sr2Al3CrAu12]
_chemical_formula_sum '[Sr6 Al9 Cr3 Au36]'
_cell_volume [1301.5448]
_cell_formula_units_Z [3]
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  6  0.0000  0.0000  0.3859  1
  Al  Al1  9  0.0000  0.5000  0.5000  1
  Cr  Cr2  3  0.0000  0.0000  0.0000  1
  Au  Au3  18  0.0029  0.5015  0.6256  1
  Au  Au4  18  0.0229  0.5114  0.8650  1
]