data_[Pm8Pr4Ti4N16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Pr  1.1300  1.8500  1.0600
  Ti  1.5400  1.4000  0.8517
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.4962]
_cell_length_b [12.0646]
_cell_length_c [12.2502]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Pm2PrTiN4]
_chemical_formula_sum '[Pm8 Pr4 Ti4 N16]'
_cell_volume [516.7213]
_cell_formula_units_Z [4]
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
[
  Pm  Pm0  8  0.0000  0.3695  0.5396  1
  Pr  Pr1  4  0.0000  0.0985  0.7500  1
  Ti  Ti2  4  0.0000  0.1675  0.2500  1
  N  N3  8  0.0000  0.2658  0.1302  1
  N  N4  4  0.0000  0.0000  0.0000  1
  N  N5  4  0.0000  0.4248  0.7500  1
]