# generated using pymatgen
data_Y3ThCdIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.75248670
_cell_length_b   9.75248641
_cell_length_c   9.75248634
_cell_angle_alpha   60.00000024
_cell_angle_beta   60.00000124
_cell_angle_gamma   59.99999983
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y3ThCdIr
_chemical_formula_sum   'Y12 Th4 Cd4 Ir4'
_cell_volume   655.89010290
_cell_formula_units_Z   4
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  0.81098694  0.18901306  0.18901306  1.0
  Y  Y1  1  0.18901306  0.81098694  0.81098694  1.0
  Y  Y2  1  0.18901306  0.81098694  0.18901306  1.0
  Y  Y3  1  0.81098694  0.18901306  0.81098694  1.0
  Y  Y4  1  0.18901306  0.18901306  0.81098694  1.0
  Y  Y5  1  0.81098694  0.81098694  0.18901306  1.0
  Y  Y6  1  0.93661098  0.56338902  0.56338902  1.0
  Y  Y7  1  0.56338902  0.93661098  0.93661098  1.0
  Y  Y8  1  0.56338902  0.93661098  0.56338902  1.0
  Y  Y9  1  0.93661098  0.56338902  0.93661098  1.0
  Y  Y10  1  0.56338902  0.56338902  0.93661098  1.0
  Y  Y11  1  0.93661098  0.93661098  0.56338902  1.0
  Th  Th12  1  0.34943012  0.34943012  0.34943012  1.0
  Th  Th13  1  0.34943012  0.34943012  0.95170863  1.0
  Th  Th14  1  0.34943012  0.95170863  0.34943012  1.0
  Th  Th15  1  0.95170863  0.34943012  0.34943012  1.0
  Cd  Cd16  1  0.58295102  0.58295102  0.58295102  1.0
  Cd  Cd17  1  0.58295102  0.58295102  0.25114894  1.0
  Cd  Cd18  1  0.58295102  0.25114894  0.58295102  1.0
  Cd  Cd19  1  0.25114894  0.58295102  0.58295102  1.0
  Ir  Ir20  1  0.14348122  0.14348122  0.14348122  1.0
  Ir  Ir21  1  0.14348122  0.14348122  0.56955734  1.0
  Ir  Ir22  1  0.14348122  0.56955734  0.14348122  1.0
  Ir  Ir23  1  0.56955734  0.14348122  0.14348122  1.0