# generated using pymatgen
data_Al3Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45907780
_cell_length_b   5.45907780
_cell_length_c   8.94260600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999759
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ru
_chemical_formula_sum   'Al12 Ru4'
_cell_volume   230.79867251
_cell_formula_units_Z   4
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
  Al  Al0  1  0.50000000  0.50000000  0.50000000  1.0
  Al  Al1  1  0.50000000  0.00000000  0.50000000  1.0
  Al  Al2  1  0.00000000  0.50000000  0.50000000  1.0
  Al  Al3  1  0.50000000  0.50000000  0.00000000  1.0
  Al  Al4  1  0.50000000  0.00000000  0.00000000  1.0
  Al  Al5  1  0.00000000  0.50000000  0.00000000  1.0
  Al  Al6  1  0.83645200  0.67290400  0.25000000  1.0
  Al  Al7  1  0.32709600  0.16354800  0.25000000  1.0
  Al  Al8  1  0.83645200  0.16354800  0.25000000  1.0
  Al  Al9  1  0.16354800  0.32709600  0.75000000  1.0
  Al  Al10  1  0.67290400  0.83645200  0.75000000  1.0
  Al  Al11  1  0.16354800  0.83645200  0.75000000  1.0
  Ru  Ru12  1  0.00000000  0.00000000  0.50000000  1.0
  Ru  Ru13  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru14  1  0.33333300  0.66666700  0.25000000  1.0
  Ru  Ru15  1  0.66666700  0.33333300  0.75000000  1.0