data_[Pr2Pu2Zr2N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Pu  1.2800  1.7500  0.9675
  Zr  1.3300  1.5500  0.8600
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.9731]
_cell_length_b [3.4973]
_cell_length_c [8.8508]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.7368]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [PrPuZrN3]
_chemical_formula_sum '[Pr2 Pu2 Zr2 N6]'
_cell_volume [211.3344]
_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
[
  Pr  Pr0  2  0.1731  0.7500  0.1450  1
  Pu  Pu1  2  0.0626  0.7500  0.5933  1
  Zr  Zr2  2  0.3546  0.2500  0.8656  1
  N  N3  2  0.1151  0.7500  0.8563  1
  N  N4  2  0.2462  0.2500  0.6154  1
  N  N5  2  0.4243  0.2500  0.1224  1
]