data_Al3Ag2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.98
_cell_length_b   11.98
_cell_length_c   4.88
_cell_angle_alpha   93.2
_cell_angle_beta   93.2
_cell_angle_gamma   13.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ag2
_chemical_formula_sum   'Al6 Ag4'
_cell_volume   168.82
_cell_formula_units_Z   2
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  Al4  1  0.75  0.0  0.43  1.0
  Al  Al5  1  0.64  0.0  0.88  1.0
  Al  Al6  1  0.15  0.0  0.4  1.0
  Al  Al7  1  0.0  0.0  0.0  1.0
  Al  Al8  1  0.36  0.0  0.47  1.0
  Al  Al9  1  0.86  0.0  0.98  1.0
  Ag  Ag0  1  0.38  0.0  0.29  1.0
  Ag  Ag1  1  0.17  0.0  0.98  1.0
  Ag  Ag2  1  0.34  0.0  0.89  1.0
  Ag  Ag3  1  0.13  0.0  0.58  1.0

data_Al3Ag2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.92
_cell_length_b   4.88
_cell_length_c   11.98
_cell_angle_alpha   93.2
_cell_angle_beta   96.99
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ag2
_chemical_formula_sum   'Al6 Ag4'
_cell_volume   168.82
_cell_formula_units_Z   2
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  0.0  0.4  0.15  1.0
  Al  Al2  1  0.0  0.43  0.75  1.0
  Al  Al3  1  0.0  0.47  0.36  1.0
  Al  Al4  1  0.0  0.88  0.64  1.0
  Al  Al5  1  0.0  0.98  0.86  1.0
  Ag  Ag6  1  0.0  0.29  0.38  1.0
  Ag  Ag7  1  0.0  0.58  0.13  1.0
  Ag  Ag8  1  0.0  0.89  0.34  1.0
  Ag  Ag9  1  0.0  0.98  0.17  1.0

Al Al Al Al Al Al Ag Ag Ag Ag
Al Al Al Al Al Al Ag Ag Ag Ag 0 1 o o - 0 1 o o o 0 0 + - o 0 5 o o - 0 5 o o o 1 1 + - o 1 5 o o o 2 9 o o o 2 7 o o - 3 5 - o - 3 7 o o - 4 6 o o o 4 8 o o o 6 8 o o - 7 9 o o o 7 8 o o o 