data_[Na2Sc4Re2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  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 [C2/m]
_cell_length_a [10.6238]
_cell_length_b [5.5923]
_cell_length_c [5.2801]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.3364]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NaSc2ReO6]
_chemical_formula_sum '[Na2 Sc4 Re2 O12]'
_cell_volume [276.1077]
_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
[
  Na  Na0  2  0.0000  0.5000  0.0000  1
  Sc  Sc1  4  0.2374  0.0000  0.1432  1
  Re  Re2  2  0.0000  0.0000  0.5000  1
  O  O3  8  0.1108  0.2400  0.8135  1
  O  O4  4  0.1539  0.0000  0.4045  1
]