data_P2Pb5Au3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.43
_cell_length_b   16.7
_cell_length_c   5.32
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P2Pb5Au3
_chemical_formula_sum   'P4 Pb10 Au6'
_cell_volume   571.25
_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
  P  P6  1  0.24  0.68  0.0  1.0
  P  P7  1  0.18  0.02  0.0  1.0
  P  P8  1  0.97  0.33  0.0  1.0
  P  P9  1  0.46  0.37  0.0  1.0
  Pb  Pb10  1  0.0  0.35  0.0  1.0
  Pb  Pb11  1  0.21  0.0  0.0  1.0
  Pb  Pb12  1  0.77  0.75  0.0  1.0
  Pb  Pb13  1  0.66  0.95  0.0  1.0
  Pb  Pb14  1  0.44  0.4  0.0  1.0
  Pb  Pb15  1  0.98  0.3  0.0  1.0
  Pb  Pb16  1  0.97  0.84  0.66  1.0
  Pb  Pb17  1  0.46  0.86  0.66  1.0
  Pb  Pb18  1  0.24  0.49  0.66  1.0
  Pb  Pb19  1  0.18  0.21  0.66  1.0
  Au  Au0  1  0.0  0.0  0.0  1.0
  Au  Au1  1  0.21  0.35  0.0  1.0
  Au  Au2  1  0.08  0.22  0.66  1.0
  Au  Au3  1  0.35  0.48  0.66  1.0
  Au  Au4  1  0.13  0.87  0.66  1.0
  Au  Au5  1  0.29  0.83  0.66  1.0

data_P2Pb5Au3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.32
_cell_length_b   6.43
_cell_length_c   16.7
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P2Pb5Au3
_chemical_formula_sum   'P4 Pb10 Au6'
_cell_volume   571.25
_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
  P  P0  1  -0.0  0.46  0.37  1.0
  P  P1  1  -0.0  0.97  0.33  1.0
  P  P2  1  -0.0  0.24  0.68  1.0
  P  P3  1  -0.0  0.18  0.02  1.0
  Pb  Pb4  1  -0.0  0.66  0.95  1.0
  Pb  Pb5  1  -0.0  0.44  0.4  1.0
  Pb  Pb6  1  -0.0  0.0  0.35  1.0
  Pb  Pb7  1  -0.0  0.98  0.3  1.0
  Pb  Pb8  1  -0.0  0.77  0.75  1.0
  Pb  Pb9  1  0.0  0.21  0.0  1.0
  Pb  Pb10  1  0.66  0.18  0.21  1.0
  Pb  Pb11  1  0.66  0.24  0.49  1.0
  Pb  Pb12  1  0.66  0.46  0.86  1.0
  Pb  Pb13  1  0.66  0.97  0.84  1.0
  Au  Au14  1  -0.0  0.21  0.35  1.0
  Au  Au15  1  0.0  0.0  0.0  1.0
  Au  Au16  1  0.66  0.08  0.22  1.0
  Au  Au17  1  0.66  0.13  0.87  1.0
  Au  Au18  1  0.66  0.29  0.83  1.0
  Au  Au19  1  0.66  0.35  0.48  1.0

P P P P Pb Pb Pb Pb Pb Pb Pb Pb Pb Pb Au Au Au Au Au Au