data_Al2AgW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24
_cell_length_b   5.24
_cell_length_c   5.24
_cell_angle_alpha   138.25
_cell_angle_beta   138.25
_cell_angle_gamma   60.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2AgW
_chemical_formula_sum   'Al2 Ag1 W1'
_cell_volume   63.17
_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  Al1  1  0.0  0.87  0.26  1.0
  Al  Al2  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.0  0.0  0.53  1.0
  W  W3  1  0.87  0.0  0.26  1.0

data_Al2AgW
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.74
_cell_length_b   3.74
_cell_length_c   5.24
_cell_angle_alpha   110.88
_cell_angle_beta   110.88
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2AgW
_chemical_formula_sum   'Al2 Ag1 W1'
_cell_volume   63.17
_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  0.0  1.0
  Al  Al1  1  0.4  0.26  0.4  1.0
  Ag  Ag2  1  0.53  0.53  0.53  1.0
  W  W3  1  0.26  0.4  0.4  1.0

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