data_HfSc2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82
_cell_length_b   5.82
_cell_length_c   4.69
_cell_angle_alpha   112.67
_cell_angle_beta   112.67
_cell_angle_gamma   34.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfSc2W
_chemical_formula_sum   'Hf1 Sc2 W1'
_cell_volume   82.68
_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  0.0  1.0
  Sc  Sc1  1  0.12  0.0  0.2  1.0
  Sc  Sc2  1  0.09  0.0  0.1  1.0
  W  W3  1  0.61  0.0  0.15  1.0

data_HfSc2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.47
_cell_length_b   4.69
_cell_length_c   5.82
_cell_angle_alpha   112.67
_cell_angle_beta   107.36
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfSc2W
_chemical_formula_sum   'Hf1 Sc2 W1'
_cell_volume   82.68
_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  0.0  1.0
  Sc  Sc1  1  0.0  0.1  0.09  1.0
  Sc  Sc2  1  0.0  0.2  0.12  1.0
  W  W3  1  0.0  0.15  0.61  1.0

Hf Sc Sc W