data_[Rb4Mg4Mn4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Mg  1.3100  1.5000  0.8600
  Mn  1.5500  1.4000  0.6483
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.8153]
_cell_length_b [11.9072]
_cell_length_c [9.3545]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.8047]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [RbMgMnCl5]
_chemical_formula_sum '[Rb4 Mg4 Mn4 Cl20]'
_cell_volume [911.6535]
_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
[
  Rb  Rb0  4  0.0000  0.3383  0.2500  1.0
  Mg  Mg1  4  0.0000  0.0000  0.0000  1.0
  Mn  Mn2  4  0.0000  0.3113  0.7500  1.0
  Cl  Cl3  8  0.1017  0.1974  0.5984  1.0
  Cl  Cl4  8  0.1946  0.4300  0.9297  1.0
  Cl  Cl5  4  0.0000  0.0620  0.2500  1.0
]