data_[B2Pd3Pt1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [Pm]
_cell_length_a [4.7567]
_cell_length_b [3.1776]
_cell_length_c [5.1822]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.1461]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [B2Pd3Pt]
_chemical_formula_sum '[B2 Pd3 Pt1]'
_cell_volume [78.3120]
_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
[
  B  B0  1  0.5023  0.0000  0.5035  1
  B  B1  1  0.9929  0.5000  0.9963  1
  Pd  Pd2  1  0.2501  0.0000  0.1575  1
  Pd  Pd3  1  0.2533  0.5000  0.6540  1
  Pd  Pd4  1  0.7460  0.5000  0.3444  1
  Pt  Pt5  1  0.7554  0.0000  0.8443  1
]