data_Hf2GaFe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.1
_cell_length_b   5.35
_cell_length_c   5.35
_cell_angle_alpha   36.24
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2GaFe
_chemical_formula_sum   'Hf2 Ga1 Fe1'
_cell_volume   69.24
_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  Hf2  1  0.0  0.0  0.19  1.0
  Hf  Hf3  1  0.05  0.0  0.11  1.0
  Ga  Ga1  1  0.05  0.0  0.25  1.0
  Fe  Fe0  1  0.0  0.0  0.62  1.0

data_Hf2GaFe
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.33
_cell_length_b   4.1
_cell_length_c   5.35
_cell_angle_alpha   90.0
_cell_angle_beta   108.12
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2GaFe
_chemical_formula_sum   'Hf2 Ga1 Fe1'
_cell_volume   69.24
_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  0.81  0.0  0.81  1.0
  Hf  Hf1  1  0.89  0.05  0.89  1.0
  Ga  Ga2  1  0.75  0.05  0.75  1.0
  Fe  Fe3  1  0.38  0.0  0.38  1.0

Hf Hf Ga Fe