data_[La16Tc2N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tc  1.9000  1.3500  0.7417
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.7659]
_cell_length_b [8.1043]
_cell_length_c [6.5302]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.5118]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La8TcN2]
_chemical_formula_sum '[La16 Tc2 N4]'
_cell_volume [727.1626]
_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
[
  La  La0  8  0.0958  0.2219  0.7496  1
  La  La1  4  0.1533  0.5000  0.2498  1
  La  La2  4  0.1792  0.0000  0.2610  1
  Tc  Tc3  2  0.0000  0.0000  0.0000  1
  N  N4  4  0.1917  0.0000  0.6309  1
]