data_[Np2Mo1Pd9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Np  1.3600  1.7500  1.0000
  Mo  2.1600  1.4500  0.7750
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.0879]
_cell_length_b [4.0879]
_cell_length_c [12.2317]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Np2MoPd9]
_chemical_formula_sum '[Np2 Mo1 Pd9]'
_cell_volume [204.4025]
_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
[
  Np  Np0  2  0.0000  0.0000  0.3278  1
  Mo  Mo1  1  0.0000  0.0000  0.0000  1
  Pd  Pd2  4  0.0000  0.5000  0.1546  1
  Pd  Pd3  2  0.0000  0.5000  0.5000  1
  Pd  Pd4  2  0.5000  0.5000  0.3269  1
  Pd  Pd5  1  0.5000  0.5000  0.0000  1
]