data_[Nd20Zn8Hg8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Zn  1.6500  1.3500  0.8800
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [17.3492]
_cell_length_b [7.6373]
_cell_length_c [7.7993]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Nd5(ZnHg)2]
_chemical_formula_sum '[Nd20 Zn8 Hg8]'
_cell_volume [1033.4153]
_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
[
  Nd  Nd0  16  0.1354  0.1836  0.6785  1
  Nd  Nd1  4  0.0000  0.0000  0.0000  1
  Zn  Zn2  8  0.0000  0.1149  0.3802  1
  Hg  Hg3  8  0.2198  0.0000  0.0000  1
]