# generated using pymatgen
data_Y9Th11(Ir2Ru)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.16124531
_cell_length_b   11.11286462
_cell_length_c   6.41412132
_cell_angle_alpha   89.92311224
_cell_angle_beta   89.70812366
_cell_angle_gamma   90.17925359
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y9Th11(Ir2Ru)4
_chemical_formula_sum   'Y9 Th11 Ir8 Ru4'
_cell_volume   795.55037830
_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
  Y  Y0  1  0.79811649  0.58866530  0.60687638  1.0
  Y  Y1  1  0.90999227  0.71290265  0.10652960  1.0
  Y  Y2  1  0.91024875  0.29204233  0.60837185  1.0
  Y  Y3  1  0.08152647  0.71185710  0.60840624  1.0
  Y  Y4  1  0.08942259  0.28464588  0.11096649  1.0
  Y  Y5  1  0.99818785  0.00202132  0.49446794  1.0
  Y  Y6  1  0.99961645  0.99988145  0.99442778  1.0
  Y  Y7  1  0.50023487  0.49967128  0.02209781  1.0
  Y  Y8  1  0.50338162  0.50071554  0.52265222  1.0
  Th  Th9  1  0.29148142  0.08789018  0.38851683  1.0
  Th  Th10  1  0.29055510  0.90756468  0.88778710  1.0
  Th  Th11  1  0.70886774  0.09220519  0.88962893  1.0
  Th  Th12  1  0.70902547  0.90932853  0.38769804  1.0
  Th  Th13  1  0.59315572  0.78854094  0.88985505  1.0
  Th  Th14  1  0.59131312  0.21308551  0.39014499  1.0
  Th  Th15  1  0.40853092  0.78601800  0.38883299  1.0
  Th  Th16  1  0.40773252  0.21191133  0.89001978  1.0
  Th  Th17  1  0.19819300  0.41224318  0.60600047  1.0
  Th  Th18  1  0.19852325  0.58783927  0.10619140  1.0
  Th  Th19  1  0.80316981  0.41460755  0.10411210  1.0
  Ir  Ir20  1  0.84346952  0.15441645  0.24257865  1.0
  Ir  Ir21  1  0.84149098  0.85101723  0.74423375  1.0
  Ir  Ir22  1  0.15739524  0.15042162  0.74201837  1.0
  Ir  Ir23  1  0.15539720  0.84724994  0.24241723  1.0
  Ir  Ir24  1  0.65252210  0.34276236  0.76618718  1.0
  Ir  Ir25  1  0.65222369  0.65880801  0.25517142  1.0
  Ir  Ir26  1  0.34908481  0.34052409  0.26790470  1.0
  Ir  Ir27  1  0.34670911  0.65649960  0.76272163  1.0
  Ru  Ru28  1  0.49953831  0.99983919  0.12357544  1.0
  Ru  Ru29  1  0.50012763  0.99855446  0.62319404  1.0
  Ru  Ru30  1  0.00668091  0.49685911  0.86947659  1.0
  Ru  Ru31  1  0.00408507  0.49941274  0.35693799  1.0