data_Hf3Pb5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.19
_cell_length_b   6.39
_cell_length_c   6.58
_cell_angle_alpha   61.62
_cell_angle_beta   63.55
_cell_angle_gamma   79.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3Pb5
_chemical_formula_sum   'Hf3 Pb5'
_cell_volume   204.66
_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  0.02  0.66  0.15  1.0
  Hf  Hf1  1  0.12  0.3  0.62  1.0
  Hf  Hf2  1  0.5  0.28  0.34  1.0
  Pb  Pb3  1  0.63  0.5  0.49  1.0
  Pb  Pb4  1  0.41  0.79  0.24  1.0
  Pb  Pb5  1  0.14  0.46  0.76  1.0
  Pb  Pb6  1  0.3  0.66  0.03  1.0
  Pb  Pb7  1  0.29  0.35  0.2  1.0

data_Hf3Pb5
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.19
_cell_length_b   6.39
_cell_length_c   6.58
_cell_angle_alpha   61.62
_cell_angle_beta   63.55
_cell_angle_gamma   79.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3Pb5
_chemical_formula_sum   'Hf3 Pb5'
_cell_volume   204.66
_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  0.02  0.66  0.15  1.0
  Hf  Hf1  1  0.12  0.3  0.62  1.0
  Hf  Hf2  1  0.5  0.28  0.34  1.0
  Pb  Pb3  1  0.14  0.46  0.76  1.0
  Pb  Pb4  1  0.29  0.35  0.2  1.0
  Pb  Pb5  1  0.3  0.66  0.03  1.0
  Pb  Pb6  1  0.41  0.79  0.24  1.0
  Pb  Pb7  1  0.63  0.5  0.49  1.0

Hf Hf Hf Pb Pb Pb Pb Pb