data_[Pr4Re2Os2N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Re  1.9000  1.3500  0.7125
  Os  2.2000  1.3000  0.6730
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.5814]
_cell_length_b [5.5945]
_cell_length_c [9.6795]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.2455]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Pr2ReOsN6]
_chemical_formula_sum '[Pr4 Re2 Os2 N12]'
_cell_volume [246.8382]
_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  4  0.2481  0.0278  0.2499  1.0
  Re  Re1  2  0.0000  0.0000  0.5000  1.0
  Os  Os2  2  0.5000  0.0000  0.0000  1.0
  N  N3  4  0.1907  0.2177  0.9738  1.0
  N  N4  4  0.2560  0.7166  0.9737  1.0
  N  N5  4  0.2998  0.0061  0.7492  1.0
]