# generated using pymatgen
data_CeAlRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.01384570
_cell_length_b   7.43379199
_cell_length_c   15.58292121
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeAlRu
_chemical_formula_sum   'Ce8 Al8 Ru8'
_cell_volume   464.96466807
_cell_formula_units_Z   8
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  0.75000000  0.94604647  0.21824348  1.0
  Ce  Ce1  1  0.25000000  0.17369491  0.56144065  1.0
  Ce  Ce2  1  0.75000000  0.82629692  0.43857221  1.0
  Ce  Ce3  1  0.75000000  0.44606003  0.28174707  1.0
  Ce  Ce4  1  0.75000000  0.32630509  0.06144065  1.0
  Ce  Ce5  1  0.25000000  0.67370308  0.93857221  1.0
  Ce  Ce6  1  0.25000000  0.05393997  0.78174707  1.0
  Ce  Ce7  1  0.25000000  0.55395353  0.71824348  1.0
  Al  Al8  1  0.75000000  0.50254711  0.56217614  1.0
  Al  Al9  1  0.75000000  0.36845158  0.84680671  1.0
  Al  Al10  1  0.75000000  0.00257368  0.93782786  1.0
  Al  Al11  1  0.75000000  0.86842336  0.65317751  1.0
  Al  Al12  1  0.25000000  0.49742632  0.43782786  1.0
  Al  Al13  1  0.25000000  0.99745289  0.06217614  1.0
  Al  Al14  1  0.25000000  0.63157664  0.15317751  1.0
  Al  Al15  1  0.25000000  0.13154842  0.34680671  1.0
  Ru  Ru16  1  0.75000000  0.73001301  0.82672432  1.0
  Ru  Ru17  1  0.25000000  0.23009163  0.93185633  1.0
  Ru  Ru18  1  0.75000000  0.26990837  0.43185633  1.0
  Ru  Ru19  1  0.25000000  0.76998699  0.32672432  1.0
  Ru  Ru20  1  0.75000000  0.76997515  0.06815784  1.0
  Ru  Ru21  1  0.75000000  0.23002895  0.67326988  1.0
  Ru  Ru22  1  0.25000000  0.26997105  0.17326988  1.0
  Ru  Ru23  1  0.25000000  0.73002485  0.56815784  1.0