data_[Li2Dy2In4Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [P2_1/c]
_cell_length_a [7.5536]
_cell_length_b [7.8952]
_cell_length_c [13.1213]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.6707]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [LiDy(InBr3)2]
_chemical_formula_sum '[Li2 Dy2 In4 Br12]'
_cell_volume [643.5685]
_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
[
  Li  Li0  2  0.5000  0.0000  0.0000  1.0
  Dy  Dy1  2  0.0000  0.0000  0.5000  1.0
  In  In2  4  0.2769  0.0771  0.2558  1.0
  Br  Br3  4  0.1631  0.0156  0.7529  1.0
  Br  Br4  4  0.2422  0.7046  0.5443  1.0
  Br  Br5  4  0.3443  0.1998  0.5430  1.0
]