data_[Ti8Ga8Sn4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Ga  1.8100  1.3000  0.7600
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [5.9426]
_cell_length_b [12.8144]
_cell_length_c [5.5644]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.9405]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Ti2Ga2Sn]
_chemical_formula_sum '[Ti8 Ga8 Sn4]'
_cell_volume [367.1844]
_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  0.0000  0.0099  0.2500  1
  Ti  Ti1  4  0.0000  0.3966  0.7500  1
  Ga  Ga2  8  0.0462  0.2007  0.0144  1
  Sn  Sn3  4  0.0000  0.3932  0.2500  1
]