data_[Nd16Pd2Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.9980]
_cell_length_b [5.1294]
_cell_length_c [7.0637]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.6619]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd8PdPt2]
_chemical_formula_sum '[Nd16 Pd2 Pt4]'
_cell_volume [642.8663]
_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
[
  Nd  Nd0  4  0.0345  0.0000  0.7740  1.0
  Nd  Nd1  4  0.0884  0.5000  0.4454  1.0
  Nd  Nd2  4  0.1662  0.5000  0.9665  1.0
  Nd  Nd3  4  0.2024  0.0000  0.3343  1.0
  Pd  Pd4  2  0.0000  0.5000  0.0000  1.0
  Pt  Pt5  4  0.1994  0.0000  0.7416  1.0
]