data_[Ce10In12Hg2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  In  1.7800  1.5500  0.9400
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.5884]
_cell_length_b [6.6132]
_cell_length_c [5.9017]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.2692]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce5In6Hg]
_chemical_formula_sum '[Ce10 In12 Hg2]'
_cell_volume [647.4337]
_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
[
  Ce  Ce0  4  0.1635  0.5000  0.6887  1
  Ce  Ce1  4  0.1650  0.0000  0.6971  1
  Ce  Ce2  2  0.0000  0.5000  0.0000  1
  In  In3  8  0.1631  0.2464  0.1917  1
  In  In4  4  0.0000  0.2452  0.5000  1
  Hg  Hg5  2  0.0000  0.0000  0.0000  1
]