data_[Rb1Mg30Mn1O32]
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
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [8.6012]
_cell_length_b [8.6012]
_cell_length_c [8.6759]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [RbMg30MnO32]
_chemical_formula_sum '[Rb1 Mg30 Mn1 O32]'
_cell_volume [641.8480]
_cell_formula_units_Z [1]
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  1  0.5000  0.5000  0.0000  1
  Mg  Mg1  8  0.0000  0.2504  0.2540  1
  Mg  Mg2  8  0.2481  0.5000  0.2539  1
  Mg  Mg3  4  0.2502  0.2502  0.0000  1
  Mg  Mg4  4  0.2508  0.2508  0.5000  1
  Mg  Mg5  2  0.0000  0.5000  0.0000  1
  Mg  Mg6  2  0.0000  0.5000  0.5000  1
  Mg  Mg7  1  0.0000  0.0000  0.5000  1
  Mg  Mg8  1  0.5000  0.5000  0.5000  1
  Mn  Mn9  1  0.0000  0.0000  0.0000  1
  O  O10  8  0.2496  0.2496  0.2485  1
  O  O11  4  0.0000  0.2336  0.0000  1
  O  O12  4  0.0000  0.2489  0.5000  1
  O  O13  4  0.0000  0.5000  0.2534  1
  O  O14  4  0.2194  0.5000  0.0000  1
  O  O15  4  0.2439  0.5000  0.5000  1
  O  O16  2  0.0000  0.0000  0.2569  1
  O  O17  2  0.5000  0.5000  0.2791  1
]