data_HfTlCo6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.51
_cell_length_b   6.51
_cell_length_c   10.65
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfTlCo6
_chemical_formula_sum   'Hf4 Tl4 Co24'
_cell_volume   425.3
_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  0.76  0.69  0.0  1.0
  Hf  Hf25  1  0.76  0.31  0.0  1.0
  Hf  Hf26  1  0.0  0.0  0.59  1.0
  Hf  Hf27  1  0.0  0.0  0.05  1.0
  Tl  Tl28  1  0.76  0.66  0.32  1.0
  Tl  Tl29  1  0.76  0.34  0.32  1.0
  Tl  Tl30  1  0.76  0.0  0.64  1.0
  Tl  Tl31  1  0.76  0.0  0.01  1.0
  Co  Co0  1  0.76  0.69  0.64  1.0
  Co  Co1  1  0.66  0.69  0.97  1.0
  Co  Co2  1  0.85  0.31  0.97  1.0
  Co  Co3  1  0.76  0.31  0.64  1.0
  Co  Co4  1  0.85  0.69  0.97  1.0
  Co  Co5  1  0.66  0.31  0.97  1.0
  Co  Co6  1  0.76  0.0  0.0  1.0
  Co  Co7  1  0.87  0.35  0.31  1.0
  Co  Co8  1  0.87  0.65  0.31  1.0
  Co  Co9  1  0.76  0.69  0.01  1.0
  Co  Co10  1  0.64  0.65  0.34  1.0
  Co  Co11  1  0.87  0.35  0.34  1.0
  Co  Co12  1  0.76  0.31  0.01  1.0
  Co  Co13  1  0.87  0.65  0.34  1.0
  Co  Co14  1  0.64  0.35  0.34  1.0
  Co  Co15  1  0.76  0.0  0.32  1.0
  Co  Co16  1  0.85  0.31  0.68  1.0
  Co  Co17  1  0.85  0.69  0.68  1.0
  Co  Co18  1  0.0  0.0  0.0  1.0
  Co  Co19  1  0.64  0.35  0.31  1.0
  Co  Co20  1  0.64  0.65  0.31  1.0
  Co  Co21  1  0.0  0.0  0.32  1.0
  Co  Co22  1  0.66  0.31  0.68  1.0
  Co  Co23  1  0.66  0.69  0.68  1.0

data_HfTlCo6
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.51
_cell_length_b   6.51
_cell_length_c   10.65
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfTlCo6
_chemical_formula_sum   'Hf4 Tl4 Co24'
_cell_volume   425.3
_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  0.0  0.0  0.05  1.0
  Hf  Hf1  1  0.0  0.0  0.59  1.0
  Hf  Hf2  1  0.76  0.31  -0.0  1.0
  Hf  Hf3  1  0.76  0.69  -0.0  1.0
  Tl  Tl4  1  0.76  0.0  0.01  1.0
  Tl  Tl5  1  0.76  0.0  0.64  1.0
  Tl  Tl6  1  0.76  0.34  0.32  1.0
  Tl  Tl7  1  0.76  0.66  0.32  1.0
  Co  Co8  1  0.0  0.0  0.0  1.0
  Co  Co9  1  0.0  0.0  0.32  1.0
  Co  Co10  1  0.64  0.35  0.31  1.0
  Co  Co11  1  0.64  0.35  0.34  1.0
  Co  Co12  1  0.64  0.65  0.31  1.0
  Co  Co13  1  0.64  0.65  0.34  1.0
  Co  Co14  1  0.66  0.31  0.68  1.0
  Co  Co15  1  0.66  0.31  0.97  1.0
  Co  Co16  1  0.66  0.69  0.68  1.0
  Co  Co17  1  0.66  0.69  0.97  1.0
  Co  Co18  1  0.76  0.0  -0.0  1.0
  Co  Co19  1  0.76  0.0  0.32  1.0
  Co  Co20  1  0.76  0.31  0.01  1.0
  Co  Co21  1  0.76  0.31  0.64  1.0
  Co  Co22  1  0.76  0.69  0.01  1.0
  Co  Co23  1  0.76  0.69  0.64  1.0
  Co  Co24  1  0.85  0.31  0.68  1.0
  Co  Co25  1  0.85  0.31  0.97  1.0
  Co  Co26  1  0.85  0.69  0.68  1.0
  Co  Co27  1  0.85  0.69  0.97  1.0
  Co  Co28  1  0.87  0.35  0.31  1.0
  Co  Co29  1  0.87  0.35  0.34  1.0
  Co  Co30  1  0.87  0.65  0.31  1.0
  Co  Co31  1  0.87  0.65  0.34  1.0

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