data_[Ac12Ge12Rh16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Ge  2.0100  1.2500  0.7700
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [I-43d]
_cell_length_a [9.7834]
_cell_length_b [9.7834]
_cell_length_c [9.7834]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [220]
_chemical_formula_structural [Ac3Ge3Rh4]
_chemical_formula_sum '[Ac12 Ge12 Rh16]'
_cell_volume [936.4173]
_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
[
  Ac  Ac0  12  0.0000  0.2500  0.8750  1
  Ge  Ge1  12  0.0000  0.2500  0.3750  1
  Rh  Rh2  16  0.0722  0.4278  0.5722  1
]