data_[Pm6B9Pd3Pt36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  B  2.0400  0.8500  0.4100
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.9851]
_cell_length_b [7.9851]
_cell_length_c [17.3660]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Pm2B3PdPt12]
_chemical_formula_sum '[Pm6 B9 Pd3 Pt36]'
_cell_volume [958.9433]
_cell_formula_units_Z [3]
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
[
  Pm  Pm0  6  0.0000  0.0000  0.3967  1
  B  B1  9  0.0000  0.5000  0.5000  1
  Pd  Pd2  3  0.0000  0.0000  0.0000  1
  Pt  Pt3  18  0.0125  0.5062  0.3783  1
  Pt  Pt4  18  0.0581  0.5291  0.8535  1
]