data_[Sm16Dy4Hg4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Dy  1.2200  1.7500  1.1310
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.8852]
_cell_length_b [14.0847]
_cell_length_c [6.4499]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0418]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Sm4DyHg]
_chemical_formula_sum '[Sm16 Dy4 Hg4]'
_cell_volume [763.0124]
_cell_formula_units_Z [4]
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
[
  Sm  Sm0  8  0.0992  0.1888  0.0471  1
  Sm  Sm1  8  0.2169  0.3831  0.3759  1
  Dy  Dy2  4  0.0000  0.4080  0.7500  1
  Hg  Hg3  4  0.0000  0.0012  0.7500  1
]