data_[Np9Ni24Pd3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Np  1.3600  1.7500  1.0000
  Ni  1.9100  1.3500  0.7400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.9316]
_cell_length_b [4.9316]
_cell_length_c [24.2410]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Np3Ni8Pd]
_chemical_formula_sum '[Np9 Ni24 Pd3]'
_cell_volume [510.5786]
_cell_formula_units_Z [3]
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
[
  Np  Np0  3  0.0000  0.0000  0.3767  1
  Np  Np1  3  0.0000  0.0000  0.5024  1
  Np  Np2  3  0.0000  0.0000  0.9966  1
  Ni  Ni3  9  0.0012  0.5006  0.4387  1
  Ni  Ni4  9  0.1667  0.3333  0.2698  1
  Ni  Ni5  3  0.0000  0.0000  0.1876  1
  Ni  Ni6  3  0.0000  0.0000  0.6875  1
  Pd  Pd7  3  0.0000  0.0000  0.8736  1
]