# generated using pymatgen
data_NdLu3(AlRu)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97197700
_cell_length_b   6.92646561
_cell_length_c   8.06484829
_cell_angle_alpha   90.56134126
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdLu3(AlRu)4
_chemical_formula_sum   'Nd1 Lu3 Al4 Ru4'
_cell_volume   221.86753918
_cell_formula_units_Z   1
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
  Nd  Nd0  1  0.25000000  0.02943247  0.32266106  1.0
  Lu  Lu1  1  0.25000000  0.53567126  0.17097645  1.0
  Lu  Lu2  1  0.75000000  0.46698657  0.82679524  1.0
  Lu  Lu3  1  0.75000000  0.96606281  0.67939754  1.0
  Al  Al4  1  0.25000000  0.63106824  0.55729576  1.0
  Al  Al5  1  0.75000000  0.36697934  0.45076102  1.0
  Al  Al6  1  0.75000000  0.86205208  0.04996697  1.0
  Al  Al7  1  0.25000000  0.13936996  0.94231030  1.0
  Ru  Ru8  1  0.25000000  0.77134238  0.86622471  1.0
  Ru  Ru9  1  0.75000000  0.24353359  0.12756320  1.0
  Ru  Ru10  1  0.75000000  0.71942968  0.36814165  1.0
  Ru  Ru11  1  0.25000000  0.26807061  0.63790611  1.0