data_[Sc4Ag4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Ag  1.9300  1.6000  1.0867
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [8.0598]
_cell_length_b [10.1719]
_cell_length_c [3.2205]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [ScAgO3]
_chemical_formula_sum '[Sc4 Ag4 O12]'
_cell_volume [264.0234]
_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
[
  Sc  Sc0  4  0.2500  0.2500  0.5000  1.0
  Ag  Ag1  2  0.0000  0.0000  0.0000  1.0
  Ag  Ag2  2  0.0000  0.5000  0.0000  1.0
  O  O3  8  0.1743  0.1386  0.0000  1.0
  O  O4  4  0.0000  0.3638  0.5000  1.0
]