data_[Ba2Tc4Sb2N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Tc  1.9000  1.3500  0.7417
  Sb  2.0500  1.4500  0.8300
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.7724]
_cell_length_b [5.3291]
_cell_length_c [7.9704]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.3135]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [BaTc2SbN2]
_chemical_formula_sum '[Ba2 Tc4 Sb2 N4]'
_cell_volume [267.9827]
_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
[
  Ba  Ba0  2  0.3075  0.2500  0.6399  1
  Tc  Tc1  4  0.1312  0.5006  0.1887  1
  Sb  Sb2  2  0.2450  0.7500  0.9412  1
  N  N3  2  0.0840  0.7500  0.3428  1
  N  N4  2  0.3422  0.2500  0.2901  1
]