data_[Ti12Zn10Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Zn  1.6500  1.3500  0.8800
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.4224]
_cell_length_b [6.3027]
_cell_length_c [13.3034]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Ti6Zn5Rh]
_chemical_formula_sum '[Ti12 Zn10 Rh2]'
_cell_volume [370.8086]
_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  0.0000  0.2483  0.1655  1
  Ti  Ti1  4  0.0000  0.2531  0.5000  1
  Zn  Zn2  4  0.0000  0.0000  0.3333  1
  Zn  Zn3  4  0.0000  0.5000  0.3307  1
  Zn  Zn4  2  0.0000  0.5000  0.0000  1
  Rh  Rh5  2  0.0000  0.0000  0.0000  1
]