data_HfCuSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.57
_cell_length_b   5.57
_cell_length_c   5.01
_cell_angle_alpha   96.78
_cell_angle_beta   96.78
_cell_angle_gamma   34.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfCuSb2
_chemical_formula_sum   'Hf1 Cu1 Sb2'
_cell_volume   86.57
_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  Hf1  1  0.19  0.0  0.91  1.0
  Cu  Cu0  1  0.23  0.0  0.45  1.0
  Sb  Sb2  1  0.97  0.0  0.58  1.0
  Sb  Sb3  1  0.71  0.0  0.49  1.0

data_HfCuSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.27
_cell_length_b   5.01
_cell_length_c   5.57
_cell_angle_alpha   96.78
_cell_angle_beta   107.05
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfCuSb2
_chemical_formula_sum   'Hf1 Cu1 Sb2'
_cell_volume   86.57
_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  0.91  0.19  1.0
  Cu  Cu1  1  0.0  0.45  0.23  1.0
  Sb  Sb2  1  0.0  0.49  0.71  1.0
  Sb  Sb3  1  0.0  0.58  0.97  1.0

Hf Cu Sb Sb
Hf Cu Sb Sb 0 2 - o o 0 1 o o o 1 2 - o o 2 3 o o o 