# generated using pymatgen
data_Lu3(Al3Ru)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.70429323
_cell_length_b   8.70429281
_cell_length_c   9.42743883
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999784
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu3(Al3Ru)4
_chemical_formula_sum   'Lu6 Al24 Ru8'
_cell_volume   618.57358393
_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  0.19418602  0.38837105  0.25000000  1.0
  Lu  Lu1  1  0.80581398  0.61162895  0.75000000  1.0
  Lu  Lu2  1  0.61162895  0.80581398  0.25000000  1.0
  Lu  Lu3  1  0.38837105  0.19418602  0.75000000  1.0
  Lu  Lu4  1  0.19418602  0.80581398  0.25000000  1.0
  Lu  Lu5  1  0.80581398  0.19418602  0.75000000  1.0
  Al  Al6  1  0.33333300  0.66666700  0.01250337  1.0
  Al  Al7  1  0.66666700  0.33333300  0.98749663  1.0
  Al  Al8  1  0.66666700  0.33333300  0.51250337  1.0
  Al  Al9  1  0.33333300  0.66666700  0.48749663  1.0
  Al  Al10  1  0.16227532  0.32455165  0.57810743  1.0
  Al  Al11  1  0.83772468  0.67544835  0.42189257  1.0
  Al  Al12  1  0.67544835  0.83772468  0.57810743  1.0
  Al  Al13  1  0.83772468  0.67544835  0.07810743  1.0
  Al  Al14  1  0.32455165  0.16227532  0.42189257  1.0
  Al  Al15  1  0.16227532  0.32455165  0.92189257  1.0
  Al  Al16  1  0.16227532  0.83772468  0.57810743  1.0
  Al  Al17  1  0.32455165  0.16227532  0.07810743  1.0
  Al  Al18  1  0.83772468  0.16227532  0.42189257  1.0
  Al  Al19  1  0.67544835  0.83772468  0.92189257  1.0
  Al  Al20  1  0.83772468  0.16227532  0.07810743  1.0
  Al  Al21  1  0.16227532  0.83772468  0.92189257  1.0
  Al  Al22  1  0.56076204  0.12152308  0.25000000  1.0
  Al  Al23  1  0.43923796  0.87847692  0.75000000  1.0
  Al  Al24  1  0.87847692  0.43923796  0.25000000  1.0
  Al  Al25  1  0.12152308  0.56076204  0.75000000  1.0
  Al  Al26  1  0.56076204  0.43923796  0.25000000  1.0
  Al  Al27  1  0.43923796  0.56076204  0.75000000  1.0
  Al  Al28  1  0.00000000  0.00000000  0.25000000  1.0
  Al  Al29  1  0.00000000  0.00000000  0.75000000  1.0
  Ru  Ru30  1  0.50000000  0.00000000  0.00000000  1.0
  Ru  Ru31  1  0.00000000  0.50000000  0.00000000  1.0
  Ru  Ru32  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru33  1  0.50000000  0.50000000  0.00000000  1.0
  Ru  Ru34  1  0.00000000  0.50000000  0.50000000  1.0
  Ru  Ru35  1  0.50000000  0.50000000  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