data_[Nd10U2P12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  U  1.3800  1.7500  0.9913
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1371]
_cell_length_b [12.3634]
_cell_length_c [7.1303]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4918]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd5UP6]
_chemical_formula_sum '[Nd10 U2 P12]'
_cell_volume [593.1126]
_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  0.0000  0.1696  0.5000  1
  Nd  Nd1  4  0.0000  0.3340  0.0000  1
  Nd  Nd2  2  0.0000  0.5000  0.5000  1
  U  U3  2  0.0000  0.0000  0.0000  1
  P  P4  8  0.2397  0.1594  0.2414  1
  P  P5  4  0.2373  0.0000  0.7590  1
]