data_[Na2Dy2Ga4Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Dy  1.2200  1.7500  1.1310
  Ga  1.8100  1.3000  0.7600
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.4012]
_cell_length_b [8.1246]
_cell_length_c [12.8839]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.5461]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [NaDy(GaBr3)2]
_chemical_formula_sum '[Na2 Dy2 Ga4 Br12]'
_cell_volume [653.0740]
_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
[
  Na  Na0  2  0.5000  0.0000  0.0000  1.0
  Dy  Dy1  2  0.0000  0.0000  0.5000  1.0
  Ga  Ga2  4  0.3069  0.0895  0.2872  1.0
  Br  Br3  4  0.1076  0.0541  0.7426  1.0
  Br  Br4  4  0.2520  0.7126  0.5777  1.0
  Br  Br5  4  0.3617  0.1777  0.5448  1.0
]