data_[Sc6Ag6Pd2O16]
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
  Pd  2.2000  1.4000  0.8462
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.0901]
_cell_length_b [6.3567]
_cell_length_c [7.5753]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.9856]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sc3Ag3PdO8]
_chemical_formula_sum '[Sc6 Ag6 Pd2 O16]'
_cell_volume [442.8076]
_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  4  0.2500  0.2500  0.5000  1.0
  Sc  Sc1  2  0.0000  0.0000  0.5000  1.0
  Ag  Ag2  4  0.2500  0.2500  0.0000  1.0
  Ag  Ag3  2  0.0000  0.0000  0.0000  1.0
  Pd  Pd4  2  0.0000  0.5000  0.5000  1.0
  O  O5  8  0.1443  0.2566  0.6683  1.0
  O  O6  4  0.1010  0.0000  0.3351  1.0
  O  O7  4  0.1027  0.5000  0.3418  1.0
]