# generated using pymatgen
data_CaTh11(GePd)12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.40269600
_cell_length_b   7.56702322
_cell_length_c   23.45224456
_cell_angle_alpha   89.89080501
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaTh11(GePd)12
_chemical_formula_sum   'Ca1 Th11 Ge12 Pd12'
_cell_volume   781.31721209
_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
  Ca  Ca0  1  0.25000000  0.74952566  0.49997991  1.0
  Th  Th1  1  0.25000000  0.75209722  0.33620272  1.0
  Th  Th2  1  0.75000000  0.25309821  0.66537974  1.0
  Th  Th3  1  0.75000000  0.24927695  0.16668354  1.0
  Th  Th4  1  0.25000000  0.75005879  0.83237743  1.0
  Th  Th5  1  0.25000000  0.74992723  0.16762633  1.0
  Th  Th6  1  0.75000000  0.25138049  0.83335057  1.0
  Th  Th7  1  0.75000000  0.24617983  0.33462051  1.0
  Th  Th8  1  0.25000000  0.74774744  0.66373719  1.0
  Th  Th9  1  0.25000000  0.75060571  0.00001881  1.0
  Th  Th10  1  0.75000000  0.25014436  0.00002990  1.0
  Th  Th11  1  0.75000000  0.24982747  0.50000682  1.0
  Ge  Ge12  1  0.25000000  0.08401662  0.07832354  1.0
  Ge  Ge13  1  0.75000000  0.91581335  0.92017853  1.0
  Ge  Ge14  1  0.75000000  0.58540281  0.41300709  1.0
  Ge  Ge15  1  0.25000000  0.41653482  0.58522956  1.0
  Ge  Ge16  1  0.25000000  0.08432737  0.24650623  1.0
  Ge  Ge17  1  0.75000000  0.91665393  0.75251359  1.0
  Ge  Ge18  1  0.75000000  0.58323199  0.24759208  1.0
  Ge  Ge19  1  0.25000000  0.41570356  0.75366310  1.0
  Ge  Ge20  1  0.25000000  0.08292950  0.41511040  1.0
  Ge  Ge21  1  0.75000000  0.91405495  0.58698296  1.0
  Ge  Ge22  1  0.75000000  0.58475365  0.07982768  1.0
  Ge  Ge23  1  0.25000000  0.41663946  0.92194631  1.0
  Pd  Pd24  1  0.25000000  0.41799040  0.25361053  1.0
  Pd  Pd25  1  0.75000000  0.58206450  0.74662487  1.0
  Pd  Pd26  1  0.75000000  0.91780122  0.25315029  1.0
  Pd  Pd27  1  0.25000000  0.08201304  0.74643255  1.0
  Pd  Pd28  1  0.25000000  0.41776581  0.42127689  1.0
  Pd  Pd29  1  0.75000000  0.57877754  0.58069081  1.0
  Pd  Pd30  1  0.75000000  0.91820971  0.08685966  1.0
  Pd  Pd31  1  0.25000000  0.08239748  0.91339810  1.0
  Pd  Pd32  1  0.25000000  0.41836288  0.08639522  1.0
  Pd  Pd33  1  0.75000000  0.58224407  0.91325936  1.0
  Pd  Pd34  1  0.75000000  0.92058349  0.41901415  1.0
  Pd  Pd35  1  0.25000000  0.08186048  0.57839205  1.0