data_HfFe2Tc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.08
_cell_length_b   5.08
_cell_length_c   5.08
_cell_angle_alpha   144.51
_cell_angle_beta   129.54
_cell_angle_gamma   63.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfFe2Tc
_chemical_formula_sum   'Hf1 Fe2 Tc1'
_cell_volume   58.06
_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  0.17  0.32  1.0
  Fe  Fe0  1  0.0  0.17  0.02  1.0
  Fe  Fe1  1  0.0  0.0  0.37  1.0
  Tc  Tc3  1  0.0  0.0  0.27  1.0

data_HfFe2Tc
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.1
_cell_length_b   4.33
_cell_length_c   5.08
_cell_angle_alpha   115.23
_cell_angle_beta   107.75
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfFe2Tc
_chemical_formula_sum   'Hf1 Fe2 Tc1'
_cell_volume   58.06
_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  0.68  0.84  0.84  1.0
  Fe  Fe1  1  0.63  0.63  0.63  1.0
  Fe  Fe2  1  0.98  0.15  0.15  1.0
  Tc  Tc3  1  0.73  0.73  0.73  1.0

Hf Fe Fe Tc