data_[U2Zn8B2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Zn  1.6500  1.3500  0.8800
  B  2.0400  0.8500  0.4100
]
_symmetry_space_group_name_H-M [P6/mmm]
_cell_length_a [5.2891]
_cell_length_b [5.2891]
_cell_length_c [7.6003]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [191]
_chemical_formula_structural [UZn4B]
_chemical_formula_sum '[U2 Zn8 B2]'
_cell_volume [184.1325]
_cell_formula_units_Z [2]
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  1  0.0000  0.0000  0.0000  1
  U  U1  1  0.0000  0.0000  0.5000  1
  Zn  Zn2  6  0.0000  0.5000  0.2168  1
  Zn  Zn3  2  0.3333  0.6667  0.5000  1
  B  B4  2  0.3333  0.6667  0.0000  1
]