data_[Np2Sb4Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Np  1.3600  1.7500  1.0000
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [4.5913]
_cell_length_b [8.8800]
_cell_length_c [5.7365]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [NpSb2Pd3]
_chemical_formula_sum '[Np2 Sb4 Pd6]'
_cell_volume [233.8797]
_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
[
  Np  Np0  2  0.5000  0.4990  0.4998  1
  Sb  Sb1  2  0.0000  0.3058  0.2462  1
  Sb  Sb2  2  0.5000  0.1549  0.7506  1
  Pd  Pd3  2  0.0000  0.0395  0.5175  1
  Pd  Pd4  2  0.0000  0.3336  0.7519  1
  Pd  Pd5  2  0.5000  0.1436  0.2341  1
]