# generated using pymatgen
data_Y3Al12NiRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.75992538
_cell_length_b   8.75992299
_cell_length_c   9.43182308
_cell_angle_alpha   90.32711613
_cell_angle_beta   89.67288516
_cell_angle_gamma   120.29248966
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y3Al12NiRu3
_chemical_formula_sum   'Y6 Al24 Ni2 Ru6'
_cell_volume   624.92802089
_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
  Y  Y0  1  0.19544923  0.38581064  0.24962831  1.0
  Y  Y1  1  0.80455077  0.61418936  0.75037169  1.0
  Y  Y2  1  0.61418936  0.80455077  0.24962831  1.0
  Y  Y3  1  0.38581064  0.19544923  0.75037169  1.0
  Y  Y4  1  0.19166393  0.80833607  0.25043196  1.0
  Y  Y5  1  0.80833607  0.19166393  0.74956804  1.0
  Al  Al6  1  0.33238091  0.66761909  0.01492406  1.0
  Al  Al7  1  0.66761909  0.33238091  0.98507594  1.0
  Al  Al8  1  0.66671374  0.33328626  0.51395015  1.0
  Al  Al9  1  0.33328626  0.66671374  0.48604985  1.0
  Al  Al10  1  0.16259758  0.32669159  0.57725390  1.0
  Al  Al11  1  0.83740242  0.67330841  0.42274610  1.0
  Al  Al12  1  0.67330841  0.83740242  0.57725390  1.0
  Al  Al13  1  0.83618450  0.67262673  0.07677788  1.0
  Al  Al14  1  0.32669159  0.16259758  0.42274610  1.0
  Al  Al15  1  0.16381550  0.32737327  0.92322212  1.0
  Al  Al16  1  0.16286674  0.83713326  0.57776979  1.0
  Al  Al17  1  0.32737327  0.16381550  0.07677788  1.0
  Al  Al18  1  0.83713326  0.16286674  0.42223021  1.0
  Al  Al19  1  0.67262673  0.83618450  0.92322212  1.0
  Al  Al20  1  0.83703903  0.16296097  0.07628625  1.0
  Al  Al21  1  0.16296097  0.83703903  0.92371375  1.0
  Al  Al22  1  0.56116092  0.12091436  0.24609931  1.0
  Al  Al23  1  0.43883908  0.87908564  0.75390069  1.0
  Al  Al24  1  0.87908564  0.43883908  0.24609931  1.0
  Al  Al25  1  0.12091436  0.56116092  0.75390069  1.0
  Al  Al26  1  0.56239413  0.43760587  0.24795148  1.0
  Al  Al27  1  0.43760587  0.56239413  0.75204852  1.0
  Al  Al28  1  0.00067163  0.99932837  0.25023581  1.0
  Al  Al29  1  0.99932837  0.00067163  0.74976419  1.0
  Ni  Ni30  1  0.50000000  0.00000000  0.00000000  1.0
  Ni  Ni31  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