data_[Cs2Rb4Mn2Br12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Rb  0.8200  2.3500  1.6600
  Mn  1.5500  1.4000  0.6483
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.0244]
_cell_length_b [8.8050]
_cell_length_c [13.5762]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.2269]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [CsRb2MnBr6]
_chemical_formula_sum '[Cs2 Rb4 Mn2 Br12]'
_cell_volume [802.4028]
_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
[
  Cs  Cs0  2  0.5000  0.0000  0.0000  1.0
  Rb  Rb1  4  0.2920  0.5695  0.7589  1.0
  Mn  Mn2  2  0.0000  0.0000  0.5000  1.0
  Br  Br3  4  0.0790  0.5651  0.1990  1.0
  Br  Br4  4  0.2504  0.2394  0.0912  1.0
  Br  Br5  4  0.2873  0.6557  0.0351  1.0
]