# generated using pymatgen
data_Ce3Al3CuIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.96606264
_cell_length_b   6.96633214
_cell_length_c   4.19571478
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00346582
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce3Al3CuIr2
_chemical_formula_sum   'Ce3 Al3 Cu1 Ir2'
_cell_volume   176.32462672
_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
  Ce  Ce0  1  0.42409799  0.42235899  0.50000000  1.0
  Ce  Ce1  1  0.57774855  0.00182810  0.50000000  1.0
  Ce  Ce2  1  0.99825885  0.57605019  0.50000000  1.0
  Al  Al3  1  0.77394460  0.76739560  0.00000000  1.0
  Al  Al4  1  0.23282333  0.00674918  0.00000000  1.0
  Al  Al5  1  0.99345404  0.22629696  0.00000000  1.0
  Cu  Cu6  1  0.33285900  0.66570759  0.00000000  1.0
  Ir  Ir7  1  0.66673860  0.33351909  0.00000000  1.0
  Ir  Ir8  1  0.00007406  0.00009431  0.50000000  1.0