data_[Dy12Hg4N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Hg  2.0000  1.5000  1.2450
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.8388]
_cell_length_b [6.8471]
_cell_length_c [6.8859]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.3447]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Dy6Hg2N]
_chemical_formula_sum '[Dy12 Hg4 N2]'
_cell_volume [455.3004]
_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
[
  Dy  Dy0  8  0.0408  0.2548  0.7849  1.0
  Dy  Dy1  4  0.2426  0.5000  0.6642  1.0
  Hg  Hg2  4  0.2496  0.0000  0.7569  1.0
  N  N3  2  0.0000  0.5000  0.5000  1.0
]