data_HfNbCo6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.35
_cell_length_b   6.35
_cell_length_c   10.37
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfNbCo6
_chemical_formula_sum   'Hf4 Nb4 Co24'
_cell_volume   394.16
_cell_formula_units_Z   4
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  Hf24  1  0.66  0.42  0.19  1.0
  Hf  Hf25  1  0.66  0.58  0.19  1.0
  Hf  Hf26  1  0.66  0.0  0.78  1.0
  Hf  Hf27  1  0.66  0.0  0.59  1.0
  Nb  Nb28  1  0.66  0.42  0.0  1.0
  Nb  Nb29  1  0.66  0.58  0.0  1.0
  Nb  Nb30  1  0.0  0.0  0.78  1.0
  Nb  Nb31  1  0.0  0.0  0.6  1.0
  Co  Co0  1  0.66  0.38  0.82  1.0
  Co  Co1  1  0.81  0.7  0.1  1.0
  Co  Co2  1  0.52  0.3  0.1  1.0
  Co  Co3  1  0.66  0.62  0.82  1.0
  Co  Co4  1  0.52  0.7  0.1  1.0
  Co  Co5  1  0.81  0.3  0.1  1.0
  Co  Co6  1  0.0  0.0  0.19  1.0
  Co  Co7  1  0.53  0.29  0.51  1.0
  Co  Co8  1  0.53  0.71  0.51  1.0
  Co  Co9  1  0.66  0.38  0.55  1.0
  Co  Co10  1  0.8  0.71  0.86  1.0
  Co  Co11  1  0.53  0.29  0.86  1.0
  Co  Co12  1  0.66  0.62  0.55  1.0
  Co  Co13  1  0.53  0.71  0.86  1.0
  Co  Co14  1  0.8  0.29  0.86  1.0
  Co  Co15  1  0.0  0.0  0.0  1.0
  Co  Co16  1  0.52  0.3  0.27  1.0
  Co  Co17  1  0.52  0.7  0.27  1.0
  Co  Co18  1  0.66  0.0  0.19  1.0
  Co  Co19  1  0.8  0.29  0.51  1.0
  Co  Co20  1  0.8  0.71  0.51  1.0
  Co  Co21  1  0.66  0.0  0.0  1.0
  Co  Co22  1  0.81  0.3  0.27  1.0
  Co  Co23  1  0.81  0.7  0.27  1.0

data_HfNbCo6
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.35
_cell_length_b   6.35
_cell_length_c   10.37
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfNbCo6
_chemical_formula_sum   'Hf4 Nb4 Co24'
_cell_volume   394.16
_cell_formula_units_Z   4
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  0.66  0.0  0.59  1.0
  Hf  Hf1  1  0.66  0.0  0.78  1.0
  Hf  Hf2  1  0.66  0.42  0.19  1.0
  Hf  Hf3  1  0.66  0.58  0.19  1.0
  Nb  Nb4  1  0.0  0.0  0.6  1.0
  Nb  Nb5  1  0.0  0.0  0.78  1.0
  Nb  Nb6  1  0.66  0.42  0.0  1.0
  Nb  Nb7  1  0.66  0.58  0.0  1.0
  Co  Co8  1  0.0  0.0  0.0  1.0
  Co  Co9  1  0.0  0.0  0.19  1.0
  Co  Co10  1  0.52  0.3  0.1  1.0
  Co  Co11  1  0.52  0.3  0.27  1.0
  Co  Co12  1  0.52  0.7  0.1  1.0
  Co  Co13  1  0.52  0.7  0.27  1.0
  Co  Co14  1  0.53  0.29  0.51  1.0
  Co  Co15  1  0.53  0.29  0.86  1.0
  Co  Co16  1  0.53  0.71  0.51  1.0
  Co  Co17  1  0.53  0.71  0.86  1.0
  Co  Co18  1  0.66  0.0  0.0  1.0
  Co  Co19  1  0.66  0.0  0.19  1.0
  Co  Co20  1  0.66  0.38  0.55  1.0
  Co  Co21  1  0.66  0.38  0.82  1.0
  Co  Co22  1  0.66  0.62  0.55  1.0
  Co  Co23  1  0.66  0.62  0.82  1.0
  Co  Co24  1  0.8  0.29  0.51  1.0
  Co  Co25  1  0.8  0.29  0.86  1.0
  Co  Co26  1  0.8  0.71  0.51  1.0
  Co  Co27  1  0.8  0.71  0.86  1.0
  Co  Co28  1  0.81  0.3  0.1  1.0
  Co  Co29  1  0.81  0.3  0.27  1.0
  Co  Co30  1  0.81  0.7  0.1  1.0
  Co  Co31  1  0.81  0.7  0.27  1.0

Hf Hf Hf Hf Nb Nb Nb Nb Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co
Hf Hf Hf Hf Nb Nb Nb Nb Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co Co 0 1 o o o 0 10 o o o 0 13 o o o 0 24 o o o 0 30 o o o 1 9 o o o 1 12 o o o 1 25 o o o 1 31 o o o 2 21 o - o 2 6 + o o 2 3 o o o 2 29 o o + 2 22 o o o 3 16 o - o 3 27 o o o 3 7 + o o 4 5 o o o 4 10 o o o 4 13 o o o 5 9 o o o 5 12 o o o 6 18 - - o 6 7 o o o 6 23 o o + 7 28 - - o 8 19 o o o 8 22 o o o 9 12 o o o 9 14 + + o 9 23 + + o 10 13 o o o 11 18 o o o 11 21 o o o 12 25 o o o 12 26 o + o 12 29 o + o 13 30 o o o 13 26 o o o 13 29 o o o 14 31 - - o 14 26 - o o 14 23 o o o 15 17 o o o 16 20 o o o 17 27 o o o 18 23 + + + 20 28 o o o 21 29 o + + 22 29 o o + 23 29 - o o 24 30 o o o 25 31 o o o 25 26 o + o 26 29 o o o 26 30 o o o 