data_[Ce1Y2Pu1P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Y  1.2200  1.8000  1.0400
  Pu  1.2800  1.7500  0.9675
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.9690]
_cell_length_b [4.0328]
_cell_length_c [6.9779]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5933]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [CeY2PuP4]
_chemical_formula_sum '[Ce1 Y2 Pu1 P4]'
_cell_volume [184.7537]
_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
[
  Ce  Ce0  1  0.0000  0.5000  0.5000  1
  Y  Y1  1  0.5000  0.0000  0.5000  1
  Y  Y2  1  0.5000  0.5000  0.0000  1
  Pu  Pu3  1  0.0000  0.0000  0.0000  1
  P  P4  2  0.2473  0.5000  0.2462  1
  P  P5  2  0.2501  0.0000  0.7517  1
]