# generated using pymatgen
data_Er3(Al3Ru)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.73682261
_cell_length_b   8.73683200
_cell_length_c   9.46278422
_cell_angle_alpha   89.99992903
_cell_angle_beta   90.00006469
_cell_angle_gamma   119.99988486
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er3(Al3Ru)4
_chemical_formula_sum   'Er6 Al24 Ru8'
_cell_volume   625.54358585
_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
  Er  Er0  1  0.19334752  0.38669142  0.24999546  1.0
  Er  Er1  1  0.80665388  0.61330938  0.75000442  1.0
  Er  Er2  1  0.61330831  0.80665284  0.24999616  1.0
  Er  Er3  1  0.38669134  0.19334660  0.75000446  1.0
  Er  Er4  1  0.19334624  0.80665431  0.24999413  1.0
  Er  Er5  1  0.80665576  0.19334542  0.75000446  1.0
  Al  Al6  1  0.33333311  0.66666765  0.00984371  1.0
  Al  Al7  1  0.66666653  0.33333229  0.99015567  1.0
  Al  Al8  1  0.66666634  0.33333229  0.50985383  1.0
  Al  Al9  1  0.33333267  0.66666837  0.49014673  1.0
  Al  Al10  1  0.16229536  0.32458942  0.57707985  1.0
  Al  Al11  1  0.83770508  0.67541059  0.42292015  1.0
  Al  Al12  1  0.67540983  0.83770443  0.57707980  1.0
  Al  Al13  1  0.83770564  0.67541046  0.07707954  1.0
  Al  Al14  1  0.32458953  0.16229513  0.42292065  1.0
  Al  Al15  1  0.16229338  0.32458919  0.92292049  1.0
  Al  Al16  1  0.16229455  0.83770538  0.57707857  1.0
  Al  Al17  1  0.32458951  0.16229408  0.07707937  1.0
  Al  Al18  1  0.83770547  0.16229444  0.42292067  1.0
  Al  Al19  1  0.67540995  0.83770599  0.92292114  1.0
  Al  Al20  1  0.83770479  0.16229491  0.07707994  1.0
  Al  Al21  1  0.16229457  0.83770513  0.92291968  1.0
  Al  Al22  1  0.56074092  0.12147913  0.25000214  1.0
  Al  Al23  1  0.43926008  0.87852176  0.74999840  1.0
  Al  Al24  1  0.87852212  0.43926007  0.25000159  1.0
  Al  Al25  1  0.12147850  0.56074029  0.74999824  1.0
  Al  Al26  1  0.56074244  0.43925794  0.25000117  1.0
  Al  Al27  1  0.43925800  0.56074169  0.74999928  1.0
  Al  Al28  1  -0.00000056  -0.00000044  0.25000272  1.0
  Al  Al29  1  0.00000015  -0.00000063  0.74999827  1.0
  Ru  Ru30  1  0.50000177  -0.00000009  -0.00000022  1.0
  Ru  Ru31  1  0.00000028  0.49999872  -0.00000007  1.0
  Ru  Ru32  1  0.50000005  -0.00000000  0.50000005  1.0
  Ru  Ru33  1  0.49999973  0.49999981  -0.00000070  1.0
  Ru  Ru34  1  -0.00000102  0.50000018  0.49999996  1.0
  Ru  Ru35  1  0.49999982  0.49999999  0.50000056  1.0
  Ru  Ru36  1  -0.00000039  0.00000096  0.00000045  1.0
  Ru  Ru37  1  -0.00000022  -0.00000007  0.49999932  1.0