data_Al2SbW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.62
_cell_length_b   5.82
_cell_length_c   5.82
_cell_angle_alpha   28.82
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2SbW
_chemical_formula_sum   'Al2 Sb1 W1'
_cell_volume   75.46
_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
  Al  Al0  1  0.0  0.0  0.5  1.0
  Al  Al1  1  0.31  0.0  0.06  1.0
  Sb  Sb2  1  0.0  0.0  0.58  1.0
  W  W3  1  0.31  0.0  0.45  1.0

data_Al2SbW
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.9
_cell_length_b   4.62
_cell_length_c   5.82
_cell_angle_alpha   90.0
_cell_angle_beta   104.41
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2SbW
_chemical_formula_sum   'Al2 Sb1 W1'
_cell_volume   75.46
_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
  Al  Al0  1  0.5  0.0  0.5  1.0
  Al  Al1  1  0.94  0.31  0.94  1.0
  Sb  Sb2  1  0.42  0.0  0.42  1.0
  W  W3  1  0.55  0.31  0.55  1.0

Al Al Sb W
Al Al Sb W 0 2 o o o 0 1 o o o 0 3 o o o 1 1 o + - 1 3 o o o 2 3 o o o 