data_[Ni2Sn12Rh6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Sn  1.9600  1.4500  0.8300
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.9656]
_cell_length_b [6.5696]
_cell_length_c [10.6580]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.7509]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ni(Sn2Rh)3]
_chemical_formula_sum '[Ni2 Sn12 Rh6]'
_cell_volume [410.1881]
_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
[
  Ni  Ni0  2  0.0000  0.0000  0.0000  1.0
  Sn  Sn1  4  0.0741  0.0066  0.2579  1.0
  Sn  Sn2  4  0.2363  0.1691  0.5847  1.0
  Sn  Sn3  4  0.3935  0.6446  0.5660  1.0
  Rh  Rh4  4  0.2915  0.6605  0.2608  1.0
  Rh  Rh5  2  0.5000  0.0000  0.5000  1.0
]