# generated using pymatgen
data_Nd3(Al3Ru)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.84932084
_cell_length_b   8.84933502
_cell_length_c   9.64182369
_cell_angle_alpha   90.00003077
_cell_angle_beta   90.00001162
_cell_angle_gamma   119.99975887
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3(Al3Ru)4
_chemical_formula_sum   'Nd6 Al24 Ru8'
_cell_volume   653.90017032
_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
  Nd  Nd0  1  0.19297354  0.38595219  0.25001886  1.0
  Nd  Nd1  1  0.80702217  0.61403548  0.74998151  1.0
  Nd  Nd2  1  0.61404862  0.80702672  0.25002152  1.0
  Nd  Nd3  1  0.38596900  0.19298390  0.74998059  1.0
  Nd  Nd4  1  0.19297588  0.80702241  0.25001918  1.0
  Nd  Nd5  1  0.80701803  0.19298759  0.74998169  1.0
  Al  Al6  1  0.33333429  0.66666215  0.00276497  1.0
  Al  Al7  1  0.66666535  0.33332980  0.99722632  1.0
  Al  Al8  1  0.66666637  0.33333344  0.50276976  1.0
  Al  Al9  1  0.33333136  0.66665825  0.49723228  1.0
  Al  Al10  1  0.16245323  0.32490706  0.57525974  1.0
  Al  Al11  1  0.83754647  0.67509744  0.42476014  1.0
  Al  Al12  1  0.67508480  0.83754615  0.57526577  1.0
  Al  Al13  1  0.83754010  0.67509220  0.07525156  1.0
  Al  Al14  1  0.32490849  0.16245630  0.42475752  1.0
  Al  Al15  1  0.16245980  0.32491196  0.92473141  1.0
  Al  Al16  1  0.16245969  0.83754634  0.57526158  1.0
  Al  Al17  1  0.32490688  0.16245545  0.07524956  1.0
  Al  Al18  1  0.83754487  0.16245437  0.42475969  1.0
  Al  Al19  1  0.67508574  0.83754755  0.92472884  1.0
  Al  Al20  1  0.83754568  0.16245636  0.07524824  1.0
  Al  Al21  1  0.16245984  0.83754543  0.92473208  1.0
  Al  Al22  1  0.56256413  0.12512762  0.25001027  1.0
  Al  Al23  1  0.43743838  0.87487121  0.74998661  1.0
  Al  Al24  1  0.87486270  0.43743212  0.25001244  1.0
  Al  Al25  1  0.12513806  0.56256496  0.74998859  1.0
  Al  Al26  1  0.56255922  0.43743463  0.25001226  1.0
  Al  Al27  1  0.43743869  0.56255993  0.74998834  1.0
  Al  Al28  1  0.00000037  -0.00000165  0.25000401  1.0
  Al  Al29  1  0.00000024  0.00000585  0.74999663  1.0
  Ru  Ru30  1  0.50000956  0.00001839  -0.00001617  1.0
  Ru  Ru31  1  -0.00001911  0.49999183  -0.00001619  1.0
  Ru  Ru32  1  0.50000875  0.00001696  0.50001232  1.0
  Ru  Ru33  1  0.50001185  0.49998914  -0.00001429  1.0
  Ru  Ru34  1  -0.00002008  0.49999115  0.50001676  1.0
  Ru  Ru35  1  0.50001166  0.49998907  0.50001489  1.0
  Ru  Ru36  1  -0.00000232  0.00000035  -0.00000726  1.0
  Ru  Ru37  1  -0.00000231  -0.00000010  0.50000798  1.0