data_[Dy2In6Br14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  In  1.7800  1.5500  0.9400
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.0441]
_cell_length_b [10.4341]
_cell_length_c [7.5284]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1502]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [DyIn3Br7]
_chemical_formula_sum '[Dy2 In6 Br14]'
_cell_volume [819.5262]
_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  2  0.4825  0.5000  0.9674  1
  In  In1  4  0.4903  0.2781  0.4816  1
  In  In2  2  0.0206  0.5000  0.0473  1
  Br  Br3  4  0.1329  0.1954  0.1921  1
  Br  Br4  4  0.3330  0.3067  0.7448  1
  Br  Br5  2  0.1364  0.0000  0.7342  1
  Br  Br6  2  0.3376  0.5000  0.2185  1
  Br  Br7  2  0.4854  0.0000  0.4457  1
]