data_[Sr4Dy4Au4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Dy  1.2200  1.7500  1.1310
  Au  2.5400  1.3500  1.0700
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [12.2576]
_cell_length_b [4.0476]
_cell_length_c [11.1109]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [SrDyAuS3]
_chemical_formula_sum '[Sr4 Dy4 Au4 S12]'
_cell_volume [551.2585]
_cell_formula_units_Z [4]
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  4  0.1839  0.2500  0.4751  1
  Dy  Dy1  4  0.0052  0.7500  0.8305  1
  Au  Au2  4  0.2047  0.7500  0.2339  1
  S  S3  4  0.0349  0.7500  0.3427  1
  S  S4  4  0.1131  0.2500  0.9526  1
  S  S5  4  0.1906  0.7500  0.6815  1
]