data_[Pr4C8Br4O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  C  2.5500  0.7000  0.3000
  Br  2.9600  1.1500  0.8825
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.5948]
_cell_length_b [9.4218]
_cell_length_c [7.8575]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.0408]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [PrC2BrO6]
_chemical_formula_sum '[Pr4 C8 Br4 O24]'
_cell_volume [588.5941]
_cell_formula_units_Z [4]
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  4  0.0000  0.4242  0.7500  1
  C  C1  8  0.2393  0.1405  0.7131  1
  Br  Br2  4  0.0000  0.0990  0.2500  1
  O  O3  8  0.1280  0.4107  0.1210  1
  O  O4  8  0.1448  0.2331  0.7115  1
  O  O5  8  0.2201  0.0828  0.5462  1
]