data_[Sc2Re4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  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 [7.5755]
_cell_length_b [4.8671]
_cell_length_c [5.6655]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.8046]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Sc(ReO3)2]
_chemical_formula_sum '[Sc2 Re4 O12]'
_cell_volume [206.9565]
_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
[
  Sc  Sc0  2  0.5000  0.0000  0.5000  1.0
  Re  Re1  4  0.1503  0.0087  0.1292  1.0
  O  O2  4  0.0701  0.7307  0.3418  1.0
  O  O3  4  0.2472  0.2164  0.4221  1.0
  O  O4  4  0.3829  0.6754  0.6743  1.0
]