data_[Sc4Bi4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Bi  2.0200  1.6000  1.0350
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.3182]
_cell_length_b [3.9565]
_cell_length_c [6.5911]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.3374]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [ScBiO3]
_chemical_formula_sum '[Sc4 Bi4 O12]'
_cell_volume [293.3545]
_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
[
  Sc  Sc0  4  0.1334  0.0000  0.9199  1
  Bi  Bi1  4  0.1258  0.5000  0.3559  1
  O  O2  4  0.0481  0.0000  0.1993  1
  O  O3  4  0.1674  0.5000  0.0145  1
  O  O4  4  0.1818  0.0000  0.6194  1
]