data_[Na8Tc8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Tc  1.9000  1.3500  0.7417
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [10.9514]
_cell_length_b [10.9514]
_cell_length_c [2.6403]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [NaTc]
_chemical_formula_sum '[Na8 Tc8]'
_cell_volume [316.6560]
_cell_formula_units_Z [8]
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  4  0.0000  0.2518  0.0000  1
  Na  Na1  4  0.2626  0.2626  0.5000  1
  Tc  Tc2  4  0.1084  0.5000  0.5000  1
  Tc  Tc3  4  0.3400  0.5000  0.0000  1
]