data_[Tb2V2N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  V  1.6300  1.3500  0.7775
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.8648]
_cell_length_b [5.8288]
_cell_length_c [6.3545]
_cell_angle_alpha [112.3496]
_cell_angle_beta [100.6365]
_cell_angle_gamma [90.6315]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TbVN3]
_chemical_formula_sum '[Tb2 V2 N6]'
_cell_volume [129.5994]
_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
[
  Tb  Tb0  2  0.1584  0.3033  0.7430  1.0
  V  V1  2  0.3023  0.1315  0.1585  1.0
  N  N2  2  0.2017  0.9368  0.8334  1.0
  N  N3  2  0.3046  0.4368  0.1699  1.0
  N  N4  2  0.3590  0.0023  0.4212  1.0
]