data_[Sr2U1Re1N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  U  1.3800  1.7500  0.9913
  Re  1.9000  1.3500  0.7125
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.1022]
_cell_length_b [4.1022]
_cell_length_c [8.4307]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Sr2UReN6]
_chemical_formula_sum '[Sr2 U1 Re1 N6]'
_cell_volume [141.8708]
_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
[
  Sr  Sr0  2  0.0000  0.0000  0.2692  1
  U  U1  1  0.5000  0.5000  0.0000  1
  Re  Re2  1  0.5000  0.5000  0.5000  1
  N  N3  2  0.0000  0.5000  0.0000  1
  N  N4  2  0.0000  0.5000  0.5000  1
  N  N5  2  0.5000  0.5000  0.2677  1
]