data_[Ho4Re2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Re  1.9000  1.3500  0.7125
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.4280]
_cell_length_b [5.6818]
_cell_length_c [9.1042]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.5212]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ho2ReO6]
_chemical_formula_sum '[Ho4 Re2 O12]'
_cell_volume [244.3282]
_cell_formula_units_Z [2]
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  4  0.1893  0.0842  0.7303  1.0
  Re  Re1  2  0.5000  0.0000  0.5000  1.0
  O  O2  4  0.1549  0.1767  0.4472  1.0
  O  O3  4  0.2581  0.7321  0.3993  1.0
  O  O4  4  0.4516  0.0882  0.2824  1.0
]