data_[B8Pt12Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [C2/m]
_cell_length_a [12.6497]
_cell_length_b [3.3216]
_cell_length_c [8.3288]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.4892]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [B2Pt3Rh]
_chemical_formula_sum '[B8 Pt12 Rh4]'
_cell_volume [313.2096]
_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
[
  B  B0  4  0.1161  0.5000  0.3924  1.0
  B  B1  4  0.1262  0.0000  0.8642  1.0
  Pt  Pt2  4  0.0615  0.0000  0.1917  1.0
  Rh  Rh3  4  0.0655  0.5000  0.6878  1.0
  Pt  Pt4  4  0.1839  0.5000  0.0593  1.0
  Pt  Pt5  4  0.1935  0.0000  0.5713  1.0
]