data_[Dy12Hg2Sb4Te6]
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
  Sb  2.0500  1.4500  0.8300
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.0871]
_cell_length_b [4.3102]
_cell_length_c [8.8393]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.6008]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Dy6HgSb2Te3]
_chemical_formula_sum '[Dy12 Hg2 Sb4 Te6]'
_cell_volume [706.8055]
_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  0.0003  0.0000  0.2405  1
  Dy  Dy1  4  0.1613  0.5000  0.0856  1
  Dy  Dy2  4  0.1697  0.5000  0.5770  1
  Hg  Hg3  2  0.0000  0.5000  0.0000  1
  Sb  Sb4  4  0.1659  0.0000  0.3332  1
  Te  Te5  4  0.1701  0.0000  0.8327  1
  Te  Te6  2  0.0000  0.5000  0.5000  1
]