data_[Hf8Zn2Ga10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [I4]
_cell_length_a [8.2022]
_cell_length_b [8.2022]
_cell_length_c [5.5601]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [79]
_chemical_formula_structural [Hf4ZnGa5]
_chemical_formula_sum '[Hf8 Zn2 Ga10]'
_cell_volume [374.0679]
_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  0.0583  0.6814  0.4539  1
  Zn  Zn1  2  0.0000  0.0000  0.2239  1
  Ga  Ga2  8  0.0979  0.7632  0.9537  1
  Ga  Ga3  2  0.0000  0.0000  0.6557  1
]