data_Hf3Tc5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.69
_cell_length_b   7.69
_cell_length_c   7.69
_cell_angle_alpha   96.68
_cell_angle_beta   96.68
_cell_angle_gamma   140.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3Tc5
_chemical_formula_sum   'Hf6 Tc10'
_cell_volume   274.28
_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  1  0.24  0.88  0.62  1.0
  Hf  Hf1  1  0.0  0.0  0.93  1.0
  Hf  Hf2  1  0.12  0.24  0.62  1.0
  Hf  Hf3  1  0.99  0.88  0.0  1.0
  Hf  Hf4  1  0.0  0.0  0.31  1.0
  Hf  Hf5  1  0.88  0.24  0.0  1.0
  Tc  Tc6  1  0.58  0.76  0.0  1.0
  Tc  Tc7  1  0.65  0.54  0.62  1.0
  Tc  Tc8  1  0.0  0.11  0.31  1.0
  Tc  Tc9  1  0.65  0.69  0.0  1.0
  Tc  Tc10  1  0.58  0.47  0.62  1.0
  Tc  Tc11  1  0.54  0.65  0.0  1.0
  Tc  Tc12  1  0.47  0.42  0.62  1.0
  Tc  Tc13  1  0.11  0.0  0.31  1.0
  Tc  Tc14  1  0.47  0.58  0.0  1.0
  Tc  Tc15  1  0.54  0.35  0.62  1.0

data_Hf3Tc5
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.25
_cell_length_b   7.69
_cell_length_c   7.69
_cell_angle_alpha   83.32
_cell_angle_beta   70.06
_cell_angle_gamma   70.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3Tc5
_chemical_formula_sum   'Hf6 Tc10'
_cell_volume   274.28
_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  1  0.0  0.0  0.07  1.0
  Hf  Hf1  1  0.0  0.0  0.69  1.0
  Hf  Hf2  1  0.24  0.64  -0.0  1.0
  Hf  Hf3  1  0.24  0.89  0.38  1.0
  Hf  Hf4  1  0.88  0.11  -0.0  1.0
  Hf  Hf5  1  0.88  0.36  0.38  1.0
  Tc  Tc6  1  0.0  0.11  0.69  1.0
  Tc  Tc7  1  0.11  0.89  0.69  1.0
  Tc  Tc8  1  0.35  0.18  0.38  1.0
  Tc  Tc9  1  0.42  0.05  0.38  1.0
  Tc  Tc10  1  0.47  0.11  0.38  1.0
  Tc  Tc11  1  0.54  0.11  0.38  1.0
  Tc  Tc12  1  0.58  0.89  -0.0  1.0
  Tc  Tc13  1  0.65  0.89  -0.0  1.0
  Tc  Tc14  1  0.69  0.95  -0.0  1.0
  Tc  Tc15  1  0.76  0.82  -0.0  1.0

Hf Hf Hf Hf Hf Hf Tc Tc Tc Tc Tc Tc Tc Tc Tc Tc