# generated using pymatgen
data_Lu3Al12Ir3Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.70951847
_cell_length_b   8.70951819
_cell_length_c   9.38217776
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000852
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu3Al12Ir3Ru
_chemical_formula_sum   'Lu6 Al24 Ir6 Ru2'
_cell_volume   616.34308336
_cell_formula_units_Z   2
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
  Lu  Lu0  1  0.80576746  0.19423254  0.75000000  1.0
  Lu  Lu1  1  0.19423254  0.80576746  0.25000000  1.0
  Lu  Lu2  1  0.38846408  0.19423254  0.75000000  1.0
  Lu  Lu3  1  0.61153592  0.80576746  0.25000000  1.0
  Lu  Lu4  1  0.80576746  0.61153592  0.75000000  1.0
  Lu  Lu5  1  0.19423254  0.38846408  0.25000000  1.0
  Al  Al6  1  0.66666700  0.33333300  0.97073452  1.0
  Al  Al7  1  0.33333300  0.66666700  0.02926548  1.0
  Al  Al8  1  0.33333300  0.66666700  0.47073452  1.0
  Al  Al9  1  0.66666700  0.33333300  0.52926548  1.0
  Al  Al10  1  0.83685408  0.16314592  0.42236928  1.0
  Al  Al11  1  0.16314592  0.83685408  0.57763072  1.0
  Al  Al12  1  0.32629283  0.16314592  0.42236928  1.0
  Al  Al13  1  0.16314592  0.83685408  0.92236928  1.0
  Al  Al14  1  0.67370717  0.83685408  0.57763072  1.0
  Al  Al15  1  0.83685408  0.16314592  0.07763072  1.0
  Al  Al16  1  0.83685408  0.67370717  0.42236928  1.0
  Al  Al17  1  0.67370717  0.83685408  0.92236928  1.0
  Al  Al18  1  0.16314592  0.32629283  0.57763072  1.0
  Al  Al19  1  0.32629283  0.16314592  0.07763072  1.0
  Al  Al20  1  0.16314592  0.32629283  0.92236928  1.0
  Al  Al21  1  0.83685408  0.67370717  0.07763072  1.0
  Al  Al22  1  0.43752731  0.56247269  0.75000000  1.0
  Al  Al23  1  0.56247269  0.43752731  0.25000000  1.0
  Al  Al24  1  0.12494537  0.56247269  0.75000000  1.0
  Al  Al25  1  0.87505463  0.43752731  0.25000000  1.0
  Al  Al26  1  0.43752731  0.87505463  0.75000000  1.0
  Al  Al27  1  0.56247269  0.12494537  0.25000000  1.0
  Al  Al28  1  0.00000000  0.00000000  0.75000000  1.0
  Al  Al29  1  0.00000000  0.00000000  0.25000000  1.0
  Ir  Ir30  1  0.50000000  0.50000000  0.00000000  1.0
  Ir  Ir31  1  0.00000000  0.50000000  0.00000000  1.0
  Ir  Ir32  1  0.50000000  0.50000000  0.50000000  1.0
  Ir  Ir33  1  0.50000000  0.00000000  0.00000000  1.0
  Ir  Ir34  1  0.00000000  0.50000000  0.50000000  1.0
  Ir  Ir35  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru36  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru37  1  0.00000000  0.00000000  0.50000000  1.0