data_Hf2AlV
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04
_cell_length_b   5.04
_cell_length_c   5.04
_cell_angle_alpha   130.31
_cell_angle_beta   128.81
_cell_angle_gamma   74.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2AlV
_chemical_formula_sum   'Hf2 Al1 V1'
_cell_volume   73.99
_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  0.0  0.18  0.99  1.0
  Hf  Hf2  1  0.12  0.0  0.02  1.0
  Al  Al0  1  0.0  0.0  0.0  1.0
  V  V3  1  0.0  0.0  0.02  1.0

data_Hf2AlV
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.23
_cell_length_b   4.35
_cell_length_c   5.04
_cell_angle_alpha   115.6
_cell_angle_beta   114.85
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2AlV
_chemical_formula_sum   'Hf2 Al1 V1'
_cell_volume   73.99
_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  0.02  0.91  1.0
  Hf  Hf1  1  0.82  0.82  0.82  1.0
  Al  Al2  1  0.0  0.0  0.0  1.0
  V  V3  1  0.0  0.02  0.02  1.0

Hf Hf Al V