data_[Sc3Cr6Ga3O18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Cr  1.6600  1.4000  0.9400
  Ga  1.8100  1.3000  0.7600
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [5.1513]
_cell_length_b [5.1513]
_cell_length_c [13.8635]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [ScCr2GaO6]
_chemical_formula_sum '[Sc3 Cr6 Ga3 O18]'
_cell_volume [318.5967]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.1926  1.0
  Cr  Cr1  3  0.0000  0.0000  0.4836  1.0
  Cr  Cr2  3  0.0000  0.0000  0.9852  1.0
  Ga  Ga3  3  0.0000  0.0000  0.6886  1.0
  O  O4  9  0.0014  0.3082  0.0799  1.0
  O  O5  9  0.0167  0.7127  0.5828  1.0
]