data_Hf2VW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.55
_cell_length_b   5.55
_cell_length_c   5.55
_cell_angle_alpha   145.56
_cell_angle_beta   129.88
_cell_angle_gamma   62.23
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2VW
_chemical_formula_sum   'Hf2 V1 W1'
_cell_volume   73.6
_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  0.0  0.63  1.0
  Hf  Hf1  1  0.0  0.35  0.44  1.0
  V  V2  1  0.0  0.0  0.26  1.0
  W  W3  1  0.64  0.0  0.17  1.0

data_Hf2VW
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.29
_cell_length_b   4.71
_cell_length_c   5.55
_cell_angle_alpha   115.06
_cell_angle_beta   107.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2VW
_chemical_formula_sum   'Hf2 V1 W1'
_cell_volume   73.6
_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  0.63  0.63  1.0
  Hf  Hf1  1  0.65  0.09  0.09  1.0
  V  V2  1  0.0  0.26  0.26  1.0
  W  W3  1  0.0  0.17  0.53  1.0

Hf Hf V W
Hf Hf V W 0 3 - o o 0 2 o o o 1 2 o o o 2 3 - o o 