data_[Hf10Zr4Ga8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Zr  1.3300  1.5500  0.8600
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [2.9841]
_cell_length_b [6.5601]
_cell_length_c [25.0441]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Hf5(ZrGa2)2]
_chemical_formula_sum '[Hf10 Zr4 Ga8]'
_cell_volume [490.2593]
_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
[
  Hf  Hf0  8  0.0000  0.2696  0.6060  1
  Hf  Hf1  2  0.0000  0.0000  0.0000  1
  Zr  Zr2  4  0.0000  0.5000  0.2877  1
  Ga  Ga3  4  0.0000  0.1719  0.5000  1
  Ga  Ga4  4  0.0000  0.5000  0.1766  1
]