data_[K4Sc4P8O24]
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
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [7.3763]
_cell_length_b [10.8004]
_cell_length_c [8.0664]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.7170]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [KSc(PO3)2]
_chemical_formula_sum '[K4 Sc4 P8 O24]'
_cell_volume [639.4310]
_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
[
  K  K0  4  0.0000  0.4036  0.7500  1.0
  Sc  Sc1  4  0.0000  0.1660  0.2500  1.0
  P  P2  8  0.1276  0.1255  0.6849  1.0
  O  O3  8  0.0760  0.1684  0.5054  1.0
  O  O4  8  0.1772  0.0134  0.2024  1.0
  O  O5  8  0.2206  0.2920  0.2270  1.0
]