data_[Mn9B12Pb3O36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  B  2.0400  0.8500  0.4100
  Pb  2.3300  1.8000  1.1225
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R32]
_cell_length_a [9.6798]
_cell_length_b [9.6798]
_cell_length_c [7.8365]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [155]
_chemical_formula_structural [Mn3B4PbO12]
_chemical_formula_sum '[Mn9 B12 Pb3 O36]'
_cell_volume [635.8915]
_cell_formula_units_Z [3]
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
[
  Mn  Mn0  9  0.0000  0.5496  0.0000  1.0
  B  B1  9  0.0000  0.4456  0.5000  1.0
  B  B2  3  0.0000  0.0000  0.5000  1.0
  Pb  Pb3  3  0.0000  0.0000  0.0000  1.0
  O  O4  18  0.0247  0.2157  0.1966  1.0
  O  O5  9  0.0000  0.5910  0.5000  1.0
  O  O6  9  0.0000  0.8568  0.5000  1.0
]