data_[Dy4Br6Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [22.0060]
_cell_length_b [8.5454]
_cell_length_c [6.9078]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [Dy2(BrCl)3]
_chemical_formula_sum '[Dy4 Br6 Cl6]'
_cell_volume [1299.0184]
_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  4  0.0918  0.1560  0.0608  1
  Br  Br1  4  0.1592  0.3717  0.9148  1
  Br  Br2  2  0.0000  0.1137  0.7492  1
  Cl  Cl3  4  0.1402  0.0974  0.3989  1
  Cl  Cl4  2  0.0000  0.3205  0.2007  1
]