data_[Pr2Mn2Br2O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Mn  1.5500  1.4000  0.6483
  Br  2.9600  1.1500  0.8825
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.7098]
_cell_length_b [4.2078]
_cell_length_c [7.9368]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.7054]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [PrMnBrO2]
_chemical_formula_sum '[Pr2 Mn2 Br2 O4]'
_cell_volume [223.3287]
_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  0.1905  0.7500  0.6234  1.0
  Mn  Mn1  2  0.0592  0.7500  0.1357  1.0
  Br  Br2  2  0.4518  0.7500  0.2816  1.0
  O  O3  2  0.0397  0.2500  0.6162  1.0
  O  O4  2  0.0473  0.7500  0.8747  1.0
]