data_[Ni12Pd6Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.2080]
_cell_length_b [3.7567]
_cell_length_c [8.3610]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.4727]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ni6Pd3Pt]
_chemical_formula_sum '[Ni12 Pd6 Pt2]'
_cell_volume [257.7289]
_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
[
  Ni  Ni0  2  0.0472  0.7500  0.9028  1
  Ni  Ni1  2  0.1441  0.2500  0.7022  1
  Ni  Ni2  2  0.1488  0.7500  0.1993  1
  Ni  Ni3  2  0.2466  0.7500  0.4948  1
  Ni  Ni4  2  0.3458  0.2500  0.2981  1
  Ni  Ni5  2  0.4457  0.7500  0.1023  1
  Pd  Pd6  2  0.2470  0.2500  0.0065  1
  Pd  Pd7  2  0.3493  0.7500  0.8014  1
  Pd  Pd8  2  0.4486  0.2500  0.5998  1
  Pt  Pt9  2  0.0526  0.2500  0.3922  1
]