data_[Hf4Zn3Ga1]
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 [Pmm2]
_cell_length_a [3.3132]
_cell_length_b [4.1298]
_cell_length_c [10.8680]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Hf4Zn3Ga]
_chemical_formula_sum '[Hf4 Zn3 Ga1]'
_cell_volume [148.7075]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.1680  1.0
  Hf  Hf1  1  0.0000  0.5000  0.8323  1.0
  Hf  Hf2  1  0.5000  0.0000  0.6658  1.0
  Hf  Hf3  1  0.5000  0.5000  0.3352  1.0
  Zn  Zn4  1  0.0000  0.0000  0.4318  1.0
  Zn  Zn5  1  0.0000  0.5000  0.5686  1.0
  Zn  Zn6  1  0.5000  0.0000  0.9298  1.0
  Ga  Ga7  1  0.5000  0.5000  0.0685  1.0
]