# generated using pymatgen
data_Ce2AlRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.81510347
_cell_length_b   7.81510297
_cell_length_c   9.85634116
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999791
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce2AlRu
_chemical_formula_sum   'Ce12 Al6 Ru6'
_cell_volume   521.33370703
_cell_formula_units_Z   6
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  -0.00000000  0.57805324  0.49791432  1.0
  Ce  Ce1  1  0.57805324  0.00000000  0.49791432  1.0
  Ce  Ce2  1  0.42194676  0.42194676  0.49791432  1.0
  Ce  Ce3  1  0.00000000  0.42194676  -0.00208568  1.0
  Ce  Ce4  1  0.42194676  1.00000000  -0.00208568  1.0
  Ce  Ce5  1  0.57805324  0.57805324  -0.00208568  1.0
  Ce  Ce6  1  0.00000000  0.74475413  0.17970609  1.0
  Ce  Ce7  1  0.74475413  1.00000000  0.17970609  1.0
  Ce  Ce8  1  0.25524587  0.25524587  0.17970609  1.0
  Ce  Ce9  1  -0.00000000  0.25524587  0.67970609  1.0
  Ce  Ce10  1  0.25524587  0.00000000  0.67970609  1.0
  Ce  Ce11  1  0.74475413  0.74475413  0.67970609  1.0
  Al  Al12  1  0.66666700  0.33333300  0.26411554  1.0
  Al  Al13  1  0.33333300  0.66666700  0.26411554  1.0
  Al  Al14  1  0.33333300  0.66666700  0.76411554  1.0
  Al  Al15  1  0.66666700  0.33333300  0.76411554  1.0
  Al  Al16  1  0.00000000  -0.00000000  0.42726385  1.0
  Al  Al17  1  0.00000000  -0.00000000  0.92726385  1.0
  Ru  Ru18  1  0.00000000  0.34500865  0.34208960  1.0
  Ru  Ru19  1  0.34500865  1.00000000  0.34208960  1.0
  Ru  Ru20  1  0.65499135  0.65499135  0.34208960  1.0
  Ru  Ru21  1  -0.00000000  0.65499135  0.84208960  1.0
  Ru  Ru22  1  0.65499135  0.00000000  0.84208960  1.0
  Ru  Ru23  1  0.34500865  0.34500865  0.84208960  1.0