data_Hf2AgW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.36
_cell_length_b   5.36
_cell_length_c   5.36
_cell_angle_alpha   134.8
_cell_angle_beta   134.8
_cell_angle_gamma   65.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2AgW
_chemical_formula_sum   'Hf2 Ag1 W1'
_cell_volume   76.33
_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  0.06  0.0  0.25  1.0
  Hf  Hf2  1  0.0  0.0  0.5  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  W  W3  1  0.0  0.06  0.25  1.0

data_Hf2AgW
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.12
_cell_length_b   4.12
_cell_length_c   5.36
_cell_angle_alpha   112.6
_cell_angle_beta   112.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2AgW
_chemical_formula_sum   'Hf2 Ag1 W1'
_cell_volume   76.33
_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  0.5  0.0  0.5  1.0
  Hf  Hf1  1  0.75  0.0  0.81  1.0
  Ag  Ag2  1  0.0  0.0  0.0  1.0
  W  W3  1  0.81  0.06  0.81  1.0

Hf Hf Ag W