# generated using pymatgen
data_Ce3Mg3Hg2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.93764708
_cell_length_b   7.93764815
_cell_length_c   4.08895888
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999382
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce3Mg3Hg2Ir
_chemical_formula_sum   'Ce3 Mg3 Hg2 Ir1'
_cell_volume   223.11410732
_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  0.59807457  0.03182631  0.00000000  1.0
  Ce  Ce1  1  0.96817369  0.56624826  0.00000000  1.0
  Ce  Ce2  1  0.43375174  0.40192543  0.00000000  1.0
  Mg  Mg3  1  0.24830570  0.99558137  0.50000000  1.0
  Mg  Mg4  1  0.00441863  0.25272333  0.50000000  1.0
  Mg  Mg5  1  0.74727667  0.75169430  0.50000000  1.0
  Hg  Hg6  1  0.33333300  0.66666700  0.50000000  1.0
  Hg  Hg7  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir8  1  0.66666700  0.33333300  0.50000000  1.0