data_[Ti24Ga10H4]
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
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.6427]
_cell_length_b [5.7117]
_cell_length_c [7.4877]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.7646]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ti12Ga5H2]
_chemical_formula_sum '[Ti24 Ga10 H4]'
_cell_volume [583.1889]
_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  0.1440  0.2534  0.0442  1
  Ti  Ti1  8  0.1467  0.2632  0.4421  1
  Ti  Ti2  4  0.0076  0.5000  0.7399  1
  Ti  Ti3  4  0.0097  0.0000  0.8266  1
  Ga  Ga4  4  0.2068  0.0000  0.7485  1
  Ga  Ga5  4  0.2119  0.5000  0.7492  1
  Ga  Ga6  2  0.0000  0.0000  0.5000  1
  H  H7  4  0.0000  0.2690  0.0000  1
]