data_[Ni4Ru4Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Ru  2.2000  1.3000  0.6610
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [7.9462]
_cell_length_b [4.5849]
_cell_length_c [5.0860]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.2443]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [NiRuRh]
_chemical_formula_sum '[Ni4 Ru4 Rh4]'
_cell_volume [156.7174]
_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
[
  Ni  Ni0  2  0.0000  0.0714  0.5000  1.0
  Ni  Ni1  2  0.0000  0.9082  0.0000  1.0
  Ru  Ru2  4  0.1697  0.5762  0.5006  1.0
  Rh  Rh3  4  0.1674  0.4057  0.9983  1.0
]