data_[Ti4Cd4N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Cd  1.6900  1.5500  1.0900
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.7070]
_cell_length_b [3.4901]
_cell_length_c [10.5372]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.0151]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TiCdN]
_chemical_formula_sum '[Ti4 Cd4 N4]'
_cell_volume [202.7152]
_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
[
  Ti  Ti0  4  0.1241  0.5000  0.8972  1
  Cd  Cd1  4  0.2126  0.0000  0.6228  1
  N  N2  4  0.2203  0.5000  0.1069  1
]