data_[Te6Pb18O36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Te  2.1000  1.4000  1.2933
  Pb  2.3300  1.8000  1.1225
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [10.3955]
_cell_length_b [10.3955]
_cell_length_c [11.2783]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Te(PbO2)3]
_chemical_formula_sum '[Te6 Pb18 O36]'
_cell_volume [1055.5079]
_cell_formula_units_Z [6]
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
[
  Te  Te0  3  0.0000  0.0000  0.0000  1.0
  Te  Te1  3  0.0000  0.0000  0.5000  1.0
  Pb  Pb2  18  0.0379  0.2626  0.7063  1.0
  O  O3  18  0.0128  0.1600  0.3979  1.0
  O  O4  18  0.0461  0.1778  0.9033  1.0
]