# generated using pymatgen
data_PAu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13722927
_cell_length_b   5.13722927
_cell_length_c   5.13722927
_cell_angle_alpha   133.28023763
_cell_angle_beta   133.28023763
_cell_angle_gamma   68.21439322
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PAu3
_chemical_formula_sum   'P1 Au3'
_cell_volume   70.59429484
_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
  P  P0  1  0.00000000  0.00000000  0.00000000  1.0
  Au  Au1  1  0.75000000  0.25000000  0.50000000  1.0
  Au  Au2  1  0.25000000  0.75000000  0.50000000  1.0
  Au  Au3  1  0.50000000  0.50000000  0.00000000  1.0