data_[Ga4H4Rh12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  H  2.2000  0.2500  0.0000
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [I4cm]
_cell_length_a [5.3689]
_cell_length_b [5.3689]
_cell_length_c [8.3376]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [108]
_chemical_formula_structural [GaHRh3]
_chemical_formula_sum '[Ga4 H4 Rh12]'
_cell_volume [240.3329]
_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
[
  Ga  Ga0  4  0.0000  0.5000  0.1551  1.0
  H  H1  4  0.0000  0.0000  0.3878  1.0
  Rh  Rh2  8  0.1935  0.3065  0.4055  1.0
  Rh  Rh3  4  0.0000  0.0000  0.1534  1.0
]