data_[Ti4Fe2Co2N8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Fe  1.8300  1.4000  0.8525
  Co  1.8800  1.3500  0.7683
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [4.3611]
_cell_length_b [4.3611]
_cell_length_c [9.0278]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [Ti2FeCoN4]
_chemical_formula_sum '[Ti4 Fe2 Co2 N8]'
_cell_volume [171.6971]
_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
[
  Ti  Ti0  2  0.0000  0.0000  0.5000  1
  Ti  Ti1  2  0.0000  0.5000  0.7500  1
  Fe  Fe2  2  0.0000  0.5000  0.2500  1
  Co  Co3  2  0.0000  0.0000  0.0000  1
  N  N4  8  0.2286  0.2546  0.1270  1
]