data_[Cs2Co2Hg2Se4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Co  1.8800  1.3500  0.7683
  Hg  2.0000  1.5000  1.2450
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [Pmma]
_cell_length_a [5.8174]
_cell_length_b [7.8170]
_cell_length_c [5.7884]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [51]
_chemical_formula_structural [CsCoHgSe2]
_chemical_formula_sum '[Cs2 Co2 Hg2 Se4]'
_cell_volume [263.2263]
_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  0.2500  0.5000  0.2702  1.0
  Co  Co1  2  0.0000  0.0000  0.0000  1.0
  Hg  Hg2  2  0.2500  0.0000  0.3897  1.0
  Se  Se3  4  0.2500  0.2006  0.8119  1.0
]