[CIF]
data_CaPAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.54723721
_cell_length_b   3.54723721
_cell_length_c   6.79665150
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaPAu2
_chemical_formula_sum   'Ca1 P1 Au2'
_cell_volume   85.52153059
_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
  Au  Au0  1  1.77361861  1.77361861  6.34871485  1
  Au  Au1  1  0.00000000  0.00000000  1.58426704  1
  Ca  Ca2  1  1.77361861  1.77361861  3.32566798  1
  P  P3  1  0.00000000  0.00000000  5.73297894  1
[/CIF]
