data_[Nd3B2Pt9Rh1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  B  2.0400  0.8500  0.4100
  Pt  2.2800  1.3500  0.8050
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.7623]
_cell_length_b [5.7623]
_cell_length_c [9.5365]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Nd3B2Pt9Rh]
_chemical_formula_sum '[Nd3 B2 Pt9 Rh1]'
_cell_volume [274.2284]
_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
[
  Nd  Nd0  2  0.3333  0.6667  0.5956  1
  Nd  Nd1  1  0.0000  0.0000  0.0000  1
  B  B2  2  0.3333  0.6667  0.1473  1
  Pt  Pt3  6  0.1624  0.3247  0.2767  1
  Pt  Pt4  3  0.0000  0.5000  0.0000  1
  Rh  Rh5  1  0.0000  0.0000  0.5000  1
]