data_[Sc24Tl8H4O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Tl  1.6200  1.9000  1.3325
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [9.0147]
_cell_length_b [9.0147]
_cell_length_c [9.0147]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [225]
_chemical_formula_structural [Sc6Tl2HO]
_chemical_formula_sum '[Sc24 Tl8 H4 O4]'
_cell_volume [732.5746]
_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
[
  Sc  Sc0  24  0.0000  0.0000  0.2497  1.0
  Tl  Tl1  8  0.2500  0.2500  0.2500  1.0
  H  H2  4  0.0000  0.0000  0.0000  1.0
  O  O3  4  0.0000  0.0000  0.5000  1.0
]