data_[Li1Cd1In2Br4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.8493]
_cell_length_b [6.9197]
_cell_length_c [6.9700]
_cell_angle_alpha [100.2993]
_cell_angle_beta [118.1504]
_cell_angle_gamma [106.1988]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [LiCd(InBr2)2]
_chemical_formula_sum '[Li1 Cd1 In2 Br4]'
_cell_volume [260.2330]
_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
[
  Li  Li0  1  0.5135  0.4926  0.9892  1.0
  Cd  Cd1  1  0.9772  0.8412  0.8044  1.0
  In  In2  1  0.0041  0.1744  0.1634  1.0
  In  In3  1  0.4629  0.9260  0.4726  1.0
  Br  Br4  1  0.1448  0.5313  0.9701  1.0
  Br  Br5  1  0.4752  0.5099  0.6067  1.0
  Br  Br6  1  0.5092  0.1275  0.0186  1.0
  Br  Br7  1  0.9131  0.7841  0.3621  1.0
]