data_[Sr6Sb6Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Sb  2.0500  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.7638]
_cell_length_b [4.7638]
_cell_length_c [27.6188]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [SrSbAu]
_chemical_formula_sum '[Sr6 Sb6 Au6]'
_cell_volume [542.8084]
_cell_formula_units_Z [6]
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  3  0.0000  0.0000  0.4370  1.0
  Sr  Sr1  3  0.0000  0.0000  0.5973  1.0
  Sb  Sb2  3  0.0000  0.0000  0.0207  1.0
  Sb  Sb3  3  0.0000  0.0000  0.8491  1.0
  Au  Au4  3  0.0000  0.0000  0.1909  1.0
  Au  Au5  3  0.0000  0.0000  0.7086  1.0
]