data_[Ac6Sc3Mo9O36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Sc  1.3600  1.6000  0.8850
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.3221]
_cell_length_b [7.3221]
_cell_length_c [15.9452]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ac2Sc(MoO4)3]
_chemical_formula_sum '[Ac6 Sc3 Mo9 O36]'
_cell_volume [740.3419]
_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
[
  Ac  Ac0  6  0.0000  0.0000  0.3833  1
  Sc  Sc1  3  0.0000  0.0000  0.0000  1
  Mo  Mo2  9  0.0000  0.5000  0.5000  1
  O  O3  18  0.0403  0.5201  0.3791  1
  O  O4  18  0.0592  0.5296  0.8076  1
]