data_[Nb28Ga2Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nb  1.6000  1.4500  0.8200
  Ga  1.8100  1.3000  0.7600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [6.7391]
_cell_length_b [9.2386]
_cell_length_c [9.1791]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Nb14GaRh]
_chemical_formula_sum '[Nb28 Ga2 Rh2]'
_cell_volume [571.4905]
_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
[
  Nb  Nb0  8  0.0000  0.2452  0.2569  1
  Nb  Nb1  8  0.2423  0.5000  0.2538  1
  Nb  Nb2  4  0.2500  0.2500  0.0000  1
  Nb  Nb3  4  0.2500  0.2500  0.5000  1
  Nb  Nb4  2  0.0000  0.0000  0.0000  1
  Nb  Nb5  2  0.0000  0.5000  0.0000  1
  Ga  Ga6  2  0.0000  0.0000  0.5000  1
  Rh  Rh7  2  0.0000  0.5000  0.5000  1
]