data_[Sr12Rh2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Rh  2.2800  1.3500  0.7450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.5439]
_cell_length_b [12.8766]
_cell_length_c [7.5290]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.6597]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr6RhAu]
_chemical_formula_sum '[Sr12 Rh2 Au2]'
_cell_volume [696.8952]
_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  8  0.2343  0.3390  0.7408  1
  Sr  Sr1  4  0.2460  0.5000  0.2607  1
  Rh  Rh2  2  0.0000  0.5000  0.5000  1
  Au  Au3  2  0.0000  0.0000  0.0000  1
]