data_[Nb4Co1Sn1N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nb  1.6000  1.4500  0.8200
  Co  1.8800  1.3500  0.7683
  Sn  1.9600  1.4500  0.8300
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [3.1708]
_cell_length_b [3.1708]
_cell_length_c [13.2992]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Nb4CoSnN2]
_chemical_formula_sum '[Nb4 Co1 Sn1 N2]'
_cell_volume [115.7927]
_cell_formula_units_Z [1]
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
[
  Nb  Nb0  2  0.0000  0.0000  0.1428  1
  Nb  Nb1  2  0.6667  0.3333  0.3223  1
  Co  Co2  1  0.6667  0.3333  0.0000  1
  Sn  Sn3  1  0.0000  0.0000  0.5000  1
  N  N4  2  0.3333  0.6667  0.2326  1
]