# generated using pymatgen
data_La9Th(Al2Ru3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.61719405
_cell_length_b   8.61153597
_cell_length_c   8.61153561
_cell_angle_alpha   109.29402483
_cell_angle_beta   109.75312173
_cell_angle_gamma   109.34019425
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La9Th(Al2Ru3)2
_chemical_formula_sum   'La9 Th1 Al4 Ru6'
_cell_volume   492.08468722
_cell_formula_units_Z   1
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
  La  La0  1  0.75000000  0.80883411  0.05883411  1.0
  La  La1  1  0.44241830  0.25139779  0.69167960  1.0
  La  La2  1  0.69119264  0.44301959  0.25046042  1.0
  La  La3  1  0.05758270  0.74926229  0.80898048  1.0
  La  La4  1  0.80880736  0.05926778  0.75182595  1.0
  La  La5  1  0.21395744  0.21200745  0.21215404  1.0
  La  La6  1  0.50305976  0.99902269  0.28974499  1.0
  La  La7  1  0.28604256  0.49819860  0.99805001  1.0
  La  La8  1  0.99694124  0.28668623  0.49596493  1.0
  Th  Th9  1  0.25000000  0.69248111  0.44248211  1.0
  Al  Al10  1  0.50050022  0.00295533  0.91225814  1.0
  Al  Al11  1  0.58759133  0.58927763  0.58662830  1.0
  Al  Al12  1  0.91240867  0.49903797  0.00168530  1.0
  Al  Al13  1  0.99950078  0.91175893  0.50245711  1.0
  Ru  Ru14  1  0.25000100  0.11874700  0.86874700  1.0
  Ru  Ru15  1  0.75000000  0.38533930  0.63533930  1.0
  Ru  Ru16  1  0.87314225  0.25315997  0.12177862  1.0
  Ru  Ru17  1  0.12567262  0.85490594  0.26168354  1.0
  Ru  Ru18  1  0.62685675  0.74863637  0.38001572  1.0
  Ru  Ru19  1  0.37432638  0.63600992  0.72923332  1.0