data_[Ho4W4N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  W  2.3600  1.3500  0.7667
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [9.5484]
_cell_length_b [5.6281]
_cell_length_c [5.7437]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.2404]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [HoWN3]
_chemical_formula_sum '[Ho4 W4 N12]'
_cell_volume [248.9484]
_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
[
  Ho  Ho0  4  0.0178  0.2624  0.8171  1
  W  W1  4  0.2501  0.2541  0.5310  1
  N  N2  4  0.2033  0.9493  0.2339  1
  N  N3  4  0.2827  0.4555  0.2134  1
  N  N4  4  0.4961  0.1658  0.7047  1
]