data_[B8Pt12Rh12]
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 [Cmcm]
_cell_length_a [3.6109]
_cell_length_b [10.5966]
_cell_length_c [11.0673]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [B2(PtRh)3]
_chemical_formula_sum '[B8 Pt12 Rh12]'
_cell_volume [423.4673]
_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  8  0.0000  0.1912  0.1167  1.0
  Pt  Pt1  8  0.0000  0.0093  0.6253  1.0
  Rh  Rh2  8  0.0000  0.3460  0.5032  1.0
  Rh  Rh3  4  0.0000  0.3423  0.2500  1.0
  Pt  Pt4  4  0.0000  0.3505  0.7500  1.0
]