data_Al2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.94
_cell_length_b   6.94
_cell_length_c   3.41
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2Pt
_chemical_formula_sum   'Al6 Pt3'
_cell_volume   142.36
_cell_formula_units_Z   3
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  0.9  0.0  0.7  1.0
  Al  Al1  1  0.05  0.64  0.7  1.0
  Al  Al2  1  0.52  0.37  0.7  1.0
  Al  Al3  1  0.29  0.0  0.0  1.0
  Al  Al4  1  0.86  0.71  0.0  1.0
  Al  Al5  1  0.33  0.3  0.0  1.0
  Pt  Pt6  1  0.0  0.01  0.7  1.0
  Pt  Pt7  1  0.47  0.0  0.7  1.0
  Pt  Pt8  1  0.0  0.0  0.0  1.0

data_Al2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.41
_cell_length_b   6.94
_cell_length_c   6.94
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2Pt
_chemical_formula_sum   'Al6 Pt3'
_cell_volume   142.36
_cell_formula_units_Z   3
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  0.29  0.0  1.0
  Al  Al1  1  0.0  0.33  0.3  1.0
  Al  Al2  1  0.0  0.86  0.71  1.0
  Al  Al3  1  0.7  0.05  0.64  1.0
  Al  Al4  1  0.7  0.52  0.37  1.0
  Al  Al5  1  0.7  0.9  0.0  1.0
  Pt  Pt6  1  0.0  0.0  0.0  1.0
  Pt  Pt7  1  0.7  0.0  0.01  1.0
  Pt  Pt8  1  0.7  0.47  0.0  1.0

Al Al Al Al Al Al Pt Pt Pt