data_[Pr1Nd1B2Pd2Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Nd  1.1400  1.8500  1.2765
  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 [P6/mmm]
_cell_length_a [5.5033]
_cell_length_b [5.5033]
_cell_length_c [7.7013]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [191]
_chemical_formula_structural [PrNdB2(PdPt3)2]
_chemical_formula_sum '[Pr1 Nd1 B2 Pd2 Pt6]'
_cell_volume [201.9953]
_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
[
  Pr  Pr0  1  0.0000  0.0000  0.5000  1
  Nd  Nd1  1  0.0000  0.0000  0.0000  1
  B  B2  2  0.3333  0.6667  0.5000  1
  Pd  Pd3  2  0.3333  0.6667  0.0000  1
  Pt  Pt4  6  0.0000  0.5000  0.3011  1
]