data_[Sr3Sb1As2Au6]
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
  As  2.1800  1.1500  0.6600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.5489]
_cell_length_b [6.5489]
_cell_length_c [8.6091]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Sr3Sb(AsAu3)2]
_chemical_formula_sum '[Sr3 Sb1 As2 Au6]'
_cell_volume [319.7596]
_cell_formula_units_Z [1]
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  0.3333  0.6667  0.6531  1
  Sr  Sr1  1  0.0000  0.0000  0.0000  1
  Sb  Sb2  1  0.0000  0.0000  0.5000  1
  As  As3  2  0.3333  0.6667  0.0702  1
  Au  Au4  6  0.1774  0.3548  0.2847  1
]