data_[Ac6Ni3B36Os9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Ni  1.9100  1.3500  0.7400
  B  2.0400  0.8500  0.4100
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.1765]
_cell_length_b [8.1765]
_cell_length_c [14.1161]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ac2Ni(B4Os)3]
_chemical_formula_sum '[Ac6 Ni3 B36 Os9]'
_cell_volume [817.2903]
_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  0.3107  1
  Ni  Ni1  3  0.0000  0.0000  0.0000  1
  B  B2  18  0.0604  0.5302  0.6413  1
  B  B3  18  0.0959  0.5480  0.7615  1
  Os  Os4  9  0.0000  0.5000  0.5000  1
]