data_[Ce8V4Tc4N20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  V  1.6300  1.3500  0.7775
  Tc  1.9000  1.3500  0.7417
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.4252]
_cell_length_b [13.2220]
_cell_length_c [9.6197]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ce2VTcN5]
_chemical_formula_sum '[Ce8 V4 Tc4 N20]'
_cell_volume [435.6555]
_cell_formula_units_Z [4]
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
[
  Ce  Ce0  4  0.0000  0.1241  0.6830  1
  Ce  Ce1  4  0.0000  0.1380  0.3031  1
  V  V2  4  0.0000  0.4482  0.4623  1
  Tc  Tc3  4  0.0000  0.2010  0.0052  1
  N  N4  4  0.0000  0.0456  0.0497  1
  N  N5  4  0.0000  0.2957  0.6509  1
  N  N6  4  0.0000  0.3101  0.3721  1
  N  N7  4  0.0000  0.3587  0.0063  1
  N  N8  4  0.0000  0.4984  0.2914  1
]