# generated using pymatgen
data_Nd4AlRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.79449980
_cell_length_b   9.79450002
_cell_length_c   9.79449959
_cell_angle_alpha   60.00000146
_cell_angle_beta   60.00000071
_cell_angle_gamma   59.99999929
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd4AlRu
_chemical_formula_sum   'Nd16 Al4 Ru4'
_cell_volume   664.40331806
_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
  Nd  Nd0  1  0.55485590  0.55485590  0.94514410  1.0
  Nd  Nd1  1  0.18900956  0.81099044  0.18900956  1.0
  Nd  Nd2  1  0.81099044  0.81099044  0.18900956  1.0
  Nd  Nd3  1  0.18900956  0.18900956  0.81099044  1.0
  Nd  Nd4  1  0.40126536  0.79620392  0.40126536  1.0
  Nd  Nd5  1  0.81099044  0.18900956  0.81099044  1.0
  Nd  Nd6  1  0.94514410  0.94514410  0.55485590  1.0
  Nd  Nd7  1  0.81099044  0.18900956  0.18900956  1.0
  Nd  Nd8  1  0.94514410  0.55485590  0.94514410  1.0
  Nd  Nd9  1  0.79620392  0.40126536  0.40126536  1.0
  Nd  Nd10  1  0.55485590  0.94514410  0.94514410  1.0
  Nd  Nd11  1  0.18900956  0.81099044  0.81099044  1.0
  Nd  Nd12  1  0.55485590  0.94514410  0.55485590  1.0
  Nd  Nd13  1  0.40126536  0.40126536  0.40126536  1.0
  Nd  Nd14  1  0.94514410  0.55485590  0.55485590  1.0
  Nd  Nd15  1  0.40126536  0.40126536  0.79620392  1.0
  Al  Al16  1  0.17567636  0.47297292  0.17567636  1.0
  Al  Al17  1  0.17567636  0.17567636  0.47297292  1.0
  Al  Al18  1  0.47297292  0.17567636  0.17567636  1.0
  Al  Al19  1  0.17567636  0.17567636  0.17567636  1.0
  Ru  Ru20  1  0.15985065  0.61338245  0.61338245  1.0
  Ru  Ru21  1  0.61338245  0.61338245  0.15985065  1.0
  Ru  Ru22  1  0.61338245  0.61338245  0.61338245  1.0
  Ru  Ru23  1  0.61338245  0.15985065  0.61338245  1.0