data_[Ti64H32Rh32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  H  2.2000  0.2500  0.0000
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Fd-3m]
_cell_length_a [11.7102]
_cell_length_b [11.7102]
_cell_length_c [11.7102]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [227]
_chemical_formula_structural [Ti2HRh]
_chemical_formula_sum '[Ti64 H32 Rh32]'
_cell_volume [1605.7917]
_cell_formula_units_Z [32]
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  48  0.0000  0.0000  0.1868  1
  Ti  Ti1  16  0.1250  0.1250  0.6250  1
  H  H2  16  0.1250  0.1250  0.1250  1
  H  H3  8  0.0000  0.0000  0.0000  1
  H  H4  8  0.0000  0.0000  0.5000  1
  Rh  Rh5  32  0.0949  0.0949  0.4051  1
]