data_[La12Co2Hg6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Co  1.8800  1.3500  0.7683
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.7748]
_cell_length_b [9.2567]
_cell_length_c [12.7110]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.0365]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [La6CoHg3]
_chemical_formula_sum '[La12 Co2 Hg6]'
_cell_volume [605.2165]
_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
[
  La  La0  4  0.0871  0.1853  0.5554  1.0
  La  La1  4  0.1703  0.5139  0.7235  1.0
  La  La2  4  0.4963  0.6496  0.5561  1.0
  Co  Co3  2  0.0000  0.0000  0.0000  1.0
  Hg  Hg4  4  0.2961  0.6413  0.2417  1.0
  Hg  Hg5  2  0.5000  0.0000  0.5000  1.0
]