data_[Cs2Dy2Hg2Te6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Dy  1.2200  1.7500  1.1310
  Hg  2.0000  1.5000  1.2450
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [10.0555]
_cell_length_b [4.5674]
_cell_length_c [11.2608]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.0939]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsDyHgTe3]
_chemical_formula_sum '[Cs2 Dy2 Hg2 Te6]'
_cell_volume [482.5253]
_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
[
  Cs  Cs0  2  0.2240  0.2500  0.2561  1.0
  Dy  Dy1  2  0.3278  0.7500  0.8654  1.0
  Hg  Hg2  2  0.0847  0.2500  0.6168  1.0
  Te  Te3  2  0.1153  0.2500  0.8750  1.0
  Te  Te4  2  0.2287  0.7500  0.5550  1.0
  Te  Te5  2  0.4724  0.7500  0.1537  1.0
]