data_[Dy12Hg4Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Hg  2.0000  1.5000  1.2450
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.9156]
_cell_length_b [7.3807]
_cell_length_c [12.2323]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.6517]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Dy6Hg2Ru]
_chemical_formula_sum '[Dy12 Hg4 Ru2]'
_cell_volume [519.7361]
_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
[
  Dy  Dy0  4  0.1365  0.5119  0.7476  1.0
  Dy  Dy1  4  0.2289  0.1898  0.5509  1.0
  Dy  Dy2  4  0.3625  0.6894  0.5524  1.0
  Hg  Hg3  4  0.2908  0.5944  0.2519  1.0
  Ru  Ru4  2  0.5000  0.0000  0.5000  1.0
]