data_[Ni4Ru12Rh4]
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/m]
_cell_length_a [9.5565]
_cell_length_b [4.2952]
_cell_length_c [7.1530]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.0455]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NiRu3Rh]
_chemical_formula_sum '[Ni4 Ru12 Rh4]'
_cell_volume [274.0241]
_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  4  0.0531  0.5000  0.3766  1
  Ru  Ru1  4  0.1396  0.5000  0.0918  1
  Ru  Ru2  4  0.1707  0.0000  0.5340  1
  Ru  Ru3  4  0.2204  0.5000  0.7687  1
  Rh  Rh4  4  0.0561  0.0000  0.8405  1
]