# generated using pymatgen
data_Ca9(Pt2Au)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.70236163
_cell_length_b   7.65049159
_cell_length_c   7.69952600
_cell_angle_alpha   70.33601968
_cell_angle_beta   70.04512212
_cell_angle_gamma   70.47573706
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca9(Pt2Au)2
_chemical_formula_sum   'Ca9 Pt4 Au2'
_cell_volume   389.06994129
_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
  Ca  Ca0  1  0.00588917  0.99727043  0.99701494  1.0
  Ca  Ca1  1  0.38831694  0.66707070  0.14768923  1.0
  Ca  Ca2  1  0.19809212  0.19901071  0.19925723  1.0
  Ca  Ca3  1  0.85968139  0.59839900  0.34136823  1.0
  Ca  Ca4  1  0.67034356  0.14673695  0.41068035  1.0
  Ca  Ca5  1  0.32516436  0.84791444  0.60713982  1.0
  Ca  Ca6  1  0.16010276  0.39625217  0.66432571  1.0
  Ca  Ca7  1  0.80497947  0.80625825  0.79281661  1.0
  Ca  Ca8  1  0.59709343  0.33315983  0.83843896  1.0
  Pt  Pt9  1  0.04786588  0.84523064  0.40943880  1.0
  Pt  Pt10  1  0.95450089  0.16713421  0.58648439  1.0
  Pt  Pt11  1  0.41481917  0.04379876  0.83906746  1.0
  Pt  Pt12  1  0.15370679  0.58529123  0.95428434  1.0
  Au  Au13  1  0.83159634  0.41645116  0.04828956  1.0
  Au  Au14  1  0.58784774  0.95002051  0.16370538  1.0