data_[Pu8Tc2N14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pu  1.2800  1.7500  0.9675
  Tc  1.9000  1.3500  0.7417
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.6276]
_cell_length_b [3.8121]
_cell_length_c [8.9863]
_cell_angle_alpha [90.0000]
_cell_angle_beta [133.2464]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pu4TcN7]
_chemical_formula_sum '[Pu8 Tc2 N14]'
_cell_volume [315.1015]
_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
[
  Pu  Pu0  4  0.0842  0.5000  0.3766  1
  Pu  Pu1  4  0.2408  0.0000  0.8271  1
  Tc  Tc2  2  0.0000  0.0000  0.0000  1
  N  N3  4  0.1015  0.0000  0.8957  1
  N  N4  4  0.1282  0.5000  0.6820  1
  N  N5  4  0.2013  0.0000  0.5458  1
  N  N6  2  0.0000  0.5000  0.0000  1
]