# generated using pymatgen
data_Th4Al4CoRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.21314474
_cell_length_b   6.87380975
_cell_length_c   8.21507908
_cell_angle_alpha   89.48029363
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th4Al4CoRu3
_chemical_formula_sum   'Th4 Al4 Co1 Ru3'
_cell_volume   237.90182263
_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  0.25000000  0.04285878  0.31530021  1.0
  Th  Th1  1  0.25000000  0.53578441  0.17961686  1.0
  Th  Th2  1  0.75000000  0.95870193  0.67935621  1.0
  Th  Th3  1  0.75000000  0.45546584  0.82298831  1.0
  Al  Al4  1  0.25000000  0.12818774  0.94733013  1.0
  Al  Al5  1  0.25000000  0.62481033  0.55602339  1.0
  Al  Al6  1  0.75000000  0.88039604  0.05662504  1.0
  Al  Al7  1  0.75000000  0.37386727  0.44269835  1.0
  Co  Co8  1  0.75000000  0.24439974  0.12337161  1.0
  Ru  Ru9  1  0.25000000  0.25300209  0.62462204  1.0
  Ru  Ru10  1  0.25000000  0.75479390  0.87774701  1.0
  Ru  Ru11  1  0.75000000  0.74773491  0.37431882  1.0