data_[U3Be51Os3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Be  1.5700  1.0500  0.5900
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [7.5006]
_cell_length_b [7.5006]
_cell_length_c [10.8845]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [UBe17Os]
_chemical_formula_sum '[U3 Be51 Os3]'
_cell_volume [530.3115]
_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
[
  U  U0  3  0.0000  0.0000  0.6602  1
  Be  Be1  18  0.0089  0.2982  0.0002  1
  Be  Be2  9  0.0067  0.5034  0.4979  1
  Be  Be3  9  0.0115  0.5058  0.1550  1
  Be  Be4  9  0.0162  0.5081  0.8499  1
  Be  Be5  3  0.0000  0.0000  0.1006  1
  Be  Be6  3  0.0000  0.0000  0.9076  1
  Os  Os7  3  0.0000  0.0000  0.3222  1
]