data_[Dy1Tm2Nb1N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Tm  1.2500  1.7500  1.0950
  Nb  1.6000  1.4500  0.8200
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [5.7738]
_cell_length_b [3.3243]
_cell_length_c [5.7811]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1255]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [DyTm2NbN4]
_chemical_formula_sum '[Dy1 Tm2 Nb1 N4]'
_cell_volume [104.8388]
_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  0.0000  0.5000  0.5000  1.0
  Tm  Tm1  1  0.5000  0.0000  0.5000  1.0
  Tm  Tm2  1  0.5000  0.5000  0.0000  1.0
  Nb  Nb3  1  0.0000  0.0000  0.0000  1.0
  N  N4  2  0.2404  0.5000  0.2368  1.0
  N  N5  2  0.2446  0.0000  0.7627  1.0
]