data_HfTi2Tc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.43
_cell_length_b   5.43
_cell_length_c   4.63
_cell_angle_alpha   114.45
_cell_angle_beta   114.45
_cell_angle_gamma   34.55
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfTi2Tc
_chemical_formula_sum   'Hf1 Ti2 Tc1'
_cell_volume   69.6
_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  0.98  0.0  0.98  1.0
  Ti  Ti2  1  0.26  0.0  0.13  1.0
  Ti  Ti3  1  0.09  0.0  0.13  1.0
  Tc  Tc1  1  0.21  0.0  0.0  1.0

data_HfTi2Tc
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.22
_cell_length_b   4.63
_cell_length_c   5.43
_cell_angle_alpha   114.45
_cell_angle_beta   107.27
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfTi2Tc
_chemical_formula_sum   'Hf1 Ti2 Tc1'
_cell_volume   69.6
_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  0.0  0.98  0.98  1.0
  Ti  Ti1  1  0.0  0.13  0.09  1.0
  Ti  Ti2  1  0.0  0.13  0.26  1.0
  Tc  Tc3  1  0.0  0.0  0.21  1.0

Hf Ti Ti Tc