data_AlP2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.65
_cell_length_b   3.65
_cell_length_c   7.52
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   128.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlP2Au
_chemical_formula_sum   'Al1 P2 Au1'
_cell_volume   78.42
_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  0.84  1.0
  P  P2  1  0.0  0.0  0.28  1.0
  P  P3  1  0.58  0.0  0.79  1.0
  Au  Au1  1  0.58  0.0  0.89  1.0

data_AlP2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.17
_cell_length_b   3.65
_cell_length_c   7.52
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   115.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlP2Au
_chemical_formula_sum   'Al1 P2 Au1'
_cell_volume   78.42
_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  0.84  1.0
  P  P1  1  0.0  0.0  0.28  1.0
  P  P2  1  0.0  0.58  0.79  1.0
  Au  Au3  1  0.0  0.58  0.89  1.0

Al P P Au