# generated using pymatgen
data_Ca5Pt2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.97313509
_cell_length_b   8.97313552
_cell_length_c   8.97313497
_cell_angle_alpha   129.25433425
_cell_angle_beta   129.25433917
_cell_angle_gamma   74.60167957
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca5Pt2Au
_chemical_formula_sum   'Ca10 Pt4 Au2'
_cell_volume   422.11307467
_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
  Ca  Ca0  1  0.46706628  0.96706628  0.15950056  1.0
  Ca  Ca1  1  0.19243428  0.69243428  0.15950056  1.0
  Ca  Ca2  1  0.53293372  0.03293372  0.84049944  1.0
  Ca  Ca3  1  0.03293372  0.19243428  0.50000000  1.0
  Ca  Ca4  1  0.69243428  0.53293372  0.50000000  1.0
  Ca  Ca5  1  0.96706628  0.80756572  0.50000000  1.0
  Ca  Ca6  1  0.00000000  0.00000000  0.00000000  1.0
  Ca  Ca7  1  0.50000000  0.50000000  0.00000000  1.0
  Ca  Ca8  1  0.80756572  0.30756572  0.84049944  1.0
  Ca  Ca9  1  0.30756572  0.46706628  0.50000000  1.0
  Pt  Pt10  1  0.12754630  0.62754630  0.75509060  1.0
  Pt  Pt11  1  0.62754630  0.87245370  0.50000000  1.0
  Pt  Pt12  1  0.37245370  0.12754630  0.50000000  1.0
  Pt  Pt13  1  0.87245370  0.37245370  0.24490940  1.0
  Au  Au14  1  0.75000000  0.75000000  0.00000000  1.0
  Au  Au15  1  0.25000000  0.25000000  0.00000000  1.0