# generated using pymatgen
data_Th2Al18CoNi5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.05082004
_cell_length_b   10.06097566
_cell_length_c   10.05271125
_cell_angle_alpha   42.67472214
_cell_angle_beta   42.69822323
_cell_angle_gamma   42.73039273
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2Al18CoNi5
_chemical_formula_sum   'Th2 Al18 Co1 Ni5'
_cell_volume   423.50929907
_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
  Th  Th0  1  0.16687438  0.16641761  0.16840767  1.0
  Th  Th1  1  0.83453858  0.83362207  0.83257685  1.0
  Al  Al2  1  0.05022385  0.05085582  0.05075419  1.0
  Al  Al3  1  0.70247289  0.49947233  0.29801942  1.0
  Al  Al4  1  0.66520989  0.33385020  0.99960472  1.0
  Al  Al5  1  0.10504136  0.42933947  0.75458358  1.0
  Al  Al6  1  0.42976904  0.75483688  0.10446013  1.0
  Al  Al7  1  0.38512062  0.38612065  0.38451007  1.0
  Al  Al8  1  0.33380499  0.99849775  0.66511615  1.0
  Al  Al9  1  0.61147570  0.61644135  0.61376750  1.0
  Al  Al10  1  0.24568650  0.57340300  0.89484043  1.0
  Al  Al11  1  0.56924054  0.89705233  0.24763507  1.0
  Al  Al12  1  0.50033601  0.29709369  0.70205730  1.0
  Al  Al13  1  0.75425705  0.10401048  0.42941526  1.0
  Al  Al14  1  0.95159710  0.94905453  0.94671748  1.0
  Al  Al15  1  0.29896208  0.70321320  0.50110849  1.0
  Al  Al16  1  0.99938342  0.66574409  0.33403642  1.0
  Al  Al17  1  0.71710129  0.71652130  0.71729123  1.0
  Al  Al18  1  0.28250362  0.28062296  0.28520560  1.0
  Al  Al19  1  0.89862681  0.24433630  0.57183021  1.0
  Co  Co20  1  0.24013023  0.92345483  0.58178833  1.0
  Ni  Ni21  1  0.92246477  0.58196208  0.24026204  1.0
  Ni  Ni22  1  0.75909600  0.41782630  0.07688877  1.0
  Ni  Ni23  1  0.07729441  0.75915270  0.41805851  1.0
  Ni  Ni24  1  0.41749295  0.07667883  0.75829114  1.0
  Ni  Ni25  1  0.58129693  0.24042224  0.92277244  1.0