data_[Ti10Ni10Sb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Ni  1.9100  1.3500  0.7400
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [9.2068]
_cell_length_b [9.2068]
_cell_length_c [5.9245]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [Ti5Ni5Sb4]
_chemical_formula_sum '[Ti10 Ni10 Sb8]'
_cell_volume [502.1868]
_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  8  0.0903  0.2253  0.2468  1
  Ti  Ti1  2  0.0000  0.5000  0.7500  1
  Ni  Ni2  8  0.1046  0.7020  0.5063  1
  Ni  Ni3  2  0.0000  0.0000  0.0000  1
  Sb  Sb4  8  0.0951  0.1976  0.7473  1
]