data_[Li8Sc4As4O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sc  1.3600  1.6000  0.8850
  As  2.1800  1.1500  0.6600
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.8827]
_cell_length_b [8.6112]
_cell_length_c [6.9819]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.3696]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li2ScAsO6]
_chemical_formula_sum '[Li8 Sc4 As4 O24]'
_cell_volume [545.4309]
_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
[
  Li  Li0  8  0.1457  0.4493  0.0512  1
  Sc  Sc1  4  0.0000  0.2084  0.2500  1
  As  As2  4  0.0000  0.1260  0.7500  1
  O  O3  8  0.0187  0.2420  0.9579  1
  O  O4  8  0.0833  0.4304  0.2935  1
  O  O5  8  0.1444  0.0057  0.3175  1
]