data_[Ac12Be6Ga6O36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Be  1.5700  1.0500  0.5900
  Ga  1.8100  1.3000  0.7600
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [5.4699]
_cell_length_b [5.4699]
_cell_length_c [27.5872]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ac2BeGaO6]
_chemical_formula_sum '[Ac12 Be6 Ga6 O36]'
_cell_volume [714.8113]
_cell_formula_units_Z [6]
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
[
  Ac  Ac0  6  0.0000  0.0000  0.1286  1
  Ac  Ac1  6  0.0000  0.0000  0.2897  1
  Be  Be2  3  -0.0000  -0.0000  0.5000  1
  Be  Be3  3  0.0000  0.0000  0.0000  1
  Ga  Ga4  6  0.0000  0.0000  0.4117  1
  O  O5  18  0.0114  0.5057  0.7064  1
  O  O6  18  0.0123  0.5061  0.1260  1
]