data_[Dy1Sc1Br2N1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Sc  1.3600  1.6000  0.8850
  Br  2.9600  1.1500  0.8825
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [3.5517]
_cell_length_b [3.5517]
_cell_length_c [10.1211]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [DyScBr2N]
_chemical_formula_sum '[Dy1 Sc1 Br2 N1]'
_cell_volume [110.5667]
_cell_formula_units_Z [1]
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  1  0.3333  0.6667  0.3804  1
  Sc  Sc1  1  0.6667  0.3333  0.6232  1
  Br  Br2  1  0.3333  0.6667  0.8019  1
  Br  Br3  1  0.6667  0.3333  0.1841  1
  N  N4  1  0.0000  0.0000  0.5104  1
]