# generated using pymatgen
data_Er3Al12NiRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.72416467
_cell_length_b   8.72416329
_cell_length_c   9.39697051
_cell_angle_alpha   90.34618947
_cell_angle_beta   89.65380831
_cell_angle_gamma   120.30421032
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er3Al12NiRu3
_chemical_formula_sum   'Er6 Al24 Ni2 Ru6'
_cell_volume   617.47036921
_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  0.19672888  0.38742515  0.24989488  1.0
  Er  Er1  1  0.80327112  0.61257485  0.75010512  1.0
  Er  Er2  1  0.61257485  0.80327112  0.24989488  1.0
  Er  Er3  1  0.38742515  0.19672888  0.75010512  1.0
  Er  Er4  1  0.19230786  0.80769214  0.25106843  1.0
  Er  Er5  1  0.80769214  0.19230786  0.74893157  1.0
  Al  Al6  1  0.33217552  0.66782448  0.01837970  1.0
  Al  Al7  1  0.66782448  0.33217552  0.98162030  1.0
  Al  Al8  1  0.66675040  0.33324960  0.51628562  1.0
  Al  Al9  1  0.33324960  0.66675040  0.48371438  1.0
  Al  Al10  1  0.16232951  0.32652708  0.57800879  1.0
  Al  Al11  1  0.83767049  0.67347292  0.42199121  1.0
  Al  Al12  1  0.67347292  0.83767049  0.57800879  1.0
  Al  Al13  1  0.83637737  0.67261965  0.07702431  1.0
  Al  Al14  1  0.32652708  0.16232951  0.42199121  1.0
  Al  Al15  1  0.16362263  0.32738035  0.92297569  1.0
  Al  Al16  1  0.16274922  0.83725078  0.57875693  1.0
  Al  Al17  1  0.32738035  0.16362263  0.07702431  1.0
  Al  Al18  1  0.83725078  0.16274922  0.42124307  1.0
  Al  Al19  1  0.67261965  0.83637737  0.92297569  1.0
  Al  Al20  1  0.83713847  0.16286153  0.07651340  1.0
  Al  Al21  1  0.16286153  0.83713847  0.92348660  1.0
  Al  Al22  1  0.56096276  0.12024853  0.24560592  1.0
  Al  Al23  1  0.43903724  0.87975147  0.75439408  1.0
  Al  Al24  1  0.87975147  0.43903724  0.24560592  1.0
  Al  Al25  1  0.12024853  0.56096276  0.75439408  1.0
  Al  Al26  1  0.56242121  0.43757879  0.24789017  1.0
  Al  Al27  1  0.43757879  0.56242121  0.75210983  1.0
  Al  Al28  1  0.00062951  0.99937049  0.25009443  1.0
  Al  Al29  1  0.99937049  0.00062951  0.74990557  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