data_[B2Pt6Au2]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.8593]
_cell_length_b [5.6967]
_cell_length_c [5.6039]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5181]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [BPt3Au]
_chemical_formula_sum '[B2 Pt6 Au2]'
_cell_volume [150.1752]
_cell_formula_units_Z [2]
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  2  0.3395  0.7500  0.9501  1.0
  Pt  Pt1  4  0.4918  0.5011  0.2537  1.0
  Pt  Pt2  2  0.0338  0.2500  0.9509  1.0
  Au  Au3  2  0.0235  0.2500  0.4530  1.0
]