# generated using pymatgen
data_CeSnIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.46741274
_cell_length_b   7.46744905
_cell_length_c   4.07541885
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99963847
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeSnIr
_chemical_formula_sum   'Ce3 Sn3 Ir3'
_cell_volume   196.80987615
_cell_formula_units_Z   3
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  0.41252384  0.41251380  -0.00000000  1.0
  Ce  Ce1  1  0.58747917  0.00000801  -0.00000000  1.0
  Ce  Ce2  1  0.99999602  0.58747852  -0.00000000  1.0
  Sn  Sn3  1  0.00000216  0.25254088  0.50000000  1.0
  Sn  Sn4  1  0.74746030  0.74746188  0.50000000  1.0
  Sn  Sn5  1  0.25254175  -0.00000428  0.50000000  1.0
  Ir  Ir6  1  -0.00000263  0.00000207  0.00000000  1.0
  Ir  Ir7  1  0.66666011  0.33332244  0.50000000  1.0
  Ir  Ir8  1  0.33334029  0.66667567  0.50000000  1.0