data_[K8Sc2Pd6O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Sc  1.3600  1.6000  0.8850
  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 [13.2283]
_cell_length_b [6.2160]
_cell_length_c [6.8220]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.5880]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [K4ScPd3O8]
_chemical_formula_sum '[K8 Sc2 Pd6 O16]'
_cell_volume [482.8984]
_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
[
  K  K0  4  0.2500  0.2500  0.0000  1.0
  K  K1  2  0.0000  0.0000  0.0000  1.0
  K  K2  2  0.0000  0.5000  0.0000  1.0
  Sc  Sc3  2  0.0000  0.0000  0.5000  1.0
  Pd  Pd4  4  0.2500  0.2500  0.5000  1.0
  Pd  Pd5  2  0.0000  0.5000  0.5000  1.0
  O  O6  8  0.0286  0.2529  0.7241  1.0
  O  O7  4  0.1827  0.5000  0.6051  1.0
  O  O8  4  0.1962  0.0000  0.6137  1.0
]