data_[K2Sc2Zn2O6]
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
  Zn  1.6500  1.3500  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.3915]
_cell_length_b [3.2462]
_cell_length_c [9.4602]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.3409]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KScZnO3]
_chemical_formula_sum '[K2 Sc2 Zn2 O6]'
_cell_volume [186.3068]
_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  2  0.2987  0.2500  0.3004  1.0
  Sc  Sc1  2  0.3114  0.7500  0.8915  1.0
  Zn  Zn2  2  0.1153  0.2500  0.6111  1.0
  O  O3  2  0.0965  0.2500  0.8156  1.0
  O  O4  2  0.2218  0.7500  0.5398  1.0
  O  O5  2  0.4565  0.7500  0.1101  1.0
]