data_[Pr6Rh2Br2Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Rh  2.2800  1.3500  0.7450
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [9.5880]
_cell_length_b [4.0756]
_cell_length_c [9.8404]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.7584]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Pr3RhBrCl]
_chemical_formula_sum '[Pr6 Rh2 Br2 Cl2]'
_cell_volume [384.0898]
_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
[
  Pr  Pr0  2  0.1682  0.7500  0.8616  1
  Pr  Pr1  2  0.3476  0.2500  0.5728  1
  Pr  Pr2  2  0.4171  0.2500  0.1558  1
  Rh  Rh3  2  0.3733  0.2500  0.8573  1
  Br  Br4  2  0.1047  0.7500  0.1627  1
  Cl  Cl5  2  0.1320  0.7500  0.5713  1
]