data_[Sc2Cd4Ru2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Cd  1.6900  1.5500  1.0900
  Ru  2.2000  1.3000  0.6610
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.4847]
_cell_length_b [5.5928]
_cell_length_c [9.5957]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.7062]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [ScCd2RuO6]
_chemical_formula_sum '[Sc2 Cd4 Ru2 O12]'
_cell_volume [241.9761]
_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  0.0000  1.0
  Cd  Cd1  4  0.2413  0.0437  0.2502  1.0
  Ru  Ru2  2  0.0000  0.0000  0.5000  1.0
  O  O3  4  0.1287  0.2071  0.9433  1.0
  O  O4  4  0.2420  0.6904  0.9480  1.0
  O  O5  4  0.3436  0.0425  0.7410  1.0
]