data_[Nb1Cu5Rh6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nb  1.6000  1.4500  0.8200
  Cu  1.9000  1.3500  0.8200
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.4703]
_cell_length_b [5.6408]
_cell_length_c [6.5895]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.8531]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [NbCu5Rh6]
_chemical_formula_sum '[Nb1 Cu5 Rh6]'
_cell_volume [164.9727]
_cell_formula_units_Z [1]
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
[
  Nb  Nb0  1  0.0000  0.0000  0.0000  1
  Cu  Cu1  2  0.3459  0.5000  0.6701  1
  Cu  Cu2  2  0.3459  0.0000  0.6616  1
  Cu  Cu3  1  0.0000  0.5000  0.0000  1
  Rh  Rh4  4  0.1545  0.2533  0.3345  1
  Rh  Rh5  2  0.5000  0.2535  0.0000  1
]