# generated using pymatgen
data_Er11Th5(CdRu)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.56941629
_cell_length_b   9.62812746
_cell_length_c   9.62812633
_cell_angle_alpha   59.93264581
_cell_angle_beta   60.20150979
_cell_angle_gamma   60.20150946
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er11Th5(CdRu)4
_chemical_formula_sum   'Er11 Th5 Cd4 Ru4'
_cell_volume   628.85028077
_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
  Er  Er0  1  0.18707100  0.81292900  0.81292900  1.0
  Er  Er1  1  0.19321717  0.80817038  0.18613254  1.0
  Er  Er2  1  0.81248191  0.18613254  0.80817038  1.0
  Er  Er3  1  0.19321717  0.18613254  0.80817038  1.0
  Er  Er4  1  0.81248191  0.80817038  0.18613254  1.0
  Er  Er5  1  0.93273688  0.56726312  0.56726312  1.0
  Er  Er6  1  0.56582259  0.93417741  0.93417741  1.0
  Er  Er7  1  0.56279156  0.93553833  0.56398815  1.0
  Er  Er8  1  0.93768297  0.56398815  0.93553833  1.0
  Er  Er9  1  0.56279156  0.56398815  0.93553833  1.0
  Er  Er10  1  0.93768297  0.93553833  0.56398815  1.0
  Th  Th11  1  0.34352038  0.35159605  0.35159605  1.0
  Th  Th12  1  0.34836388  0.34916514  0.95410610  1.0
  Th  Th13  1  0.34836388  0.95410610  0.34916514  1.0
  Th  Th14  1  0.95328752  0.35159605  0.35159605  1.0
  Th  Th15  1  0.81670532  0.18329468  0.18329468  1.0
  Cd  Cd16  1  0.58176599  0.58194118  0.58194118  1.0
  Cd  Cd17  1  0.58074990  0.58552493  0.25297328  1.0
  Cd  Cd18  1  0.58074990  0.25297328  0.58552493  1.0
  Cd  Cd19  1  0.25435065  0.58194118  0.58194118  1.0
  Ru  Ru20  1  0.12743089  0.14757180  0.14757180  1.0
  Ru  Ru21  1  0.14465576  0.14175164  0.56893784  1.0
  Ru  Ru22  1  0.14465576  0.56893784  0.14175164  1.0
  Ru  Ru23  1  0.57742651  0.14757180  0.14757180  1.0