data_[Ho12Tl4O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Tl  1.6200  1.9000  1.3325
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [8.9189]
_cell_length_b [11.2174]
_cell_length_c [5.6372]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ho3TlO6]
_chemical_formula_sum '[Ho12 Tl4 O24]'
_cell_volume [563.9912]
_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
[
  Ho  Ho0  8  0.1972  0.1057  0.9742  1.0
  Ho  Ho1  4  0.0000  0.4011  0.9179  1.0
  Tl  Tl2  4  0.0000  0.1819  0.4818  1.0
  O  O3  8  0.1604  0.4799  0.1946  1.0
  O  O4  8  0.1697  0.2694  0.7083  1.0
  O  O5  4  0.0000  0.0218  0.7152  1.0
  O  O6  4  0.0000  0.2196  0.1162  1.0
]