# generated using pymatgen
data_Ca4Si2IrPt3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61053024
_cell_length_b   5.58394239
_cell_length_c   7.60730814
_cell_angle_alpha   80.62168623
_cell_angle_beta   80.28362244
_cell_angle_gamma   61.56890747
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca4Si2IrPt3
_chemical_formula_sum   'Ca4 Si2 Ir1 Pt3'
_cell_volume   205.63715330
_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  0.96937619  0.72455742  0.15283641  1.0
  Ca  Ca1  1  0.27977555  0.02106042  0.35228032  1.0
  Ca  Ca2  1  0.02737971  0.27612251  0.84771102  1.0
  Ca  Ca3  1  0.72242473  0.97780258  0.64823910  1.0
  Si  Si4  1  0.40993382  0.59622535  0.74371461  1.0
  Si  Si5  1  0.60355061  0.40291385  0.25420953  1.0
  Ir  Ir6  1  0.75644272  0.49059447  0.49684411  1.0
  Pt  Pt7  1  0.49140424  0.75865338  0.99658882  1.0
  Pt  Pt8  1  0.23259946  0.50641067  0.50221604  1.0
  Pt  Pt9  1  0.50711396  0.24565736  0.00536003  1.0