data_[Na12Re2P8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Re  1.9000  1.3500  0.7125
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P6_3mc]
_cell_length_a [9.1535]
_cell_length_b [9.1535]
_cell_length_c [7.1336]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [186]
_chemical_formula_structural [Na6ReP4]
_chemical_formula_sum '[Na12 Re2 P8]'
_cell_volume [517.6201]
_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
[
  Na  Na0  6  0.0637  0.5319  0.1357  1
  Na  Na1  6  0.1478  0.2957  0.4548  1
  Re  Re2  2  0.3333  0.6667  0.7473  1
  P  P3  6  0.1960  0.3921  0.8491  1
  P  P4  2  0.3333  0.6667  0.4264  1
]