# generated using pymatgen
data_Th6IrPd7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.17090875
_cell_length_b   8.17090842
_cell_length_c   8.17090762
_cell_angle_alpha   114.54199927
_cell_angle_beta   114.54199201
_cell_angle_gamma   114.54199052
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th6IrPd7
_chemical_formula_sum   'Th6 Ir1 Pd7'
_cell_volume   317.67320574
_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  0.39468929  0.02277316  0.27017493  1.0
  Th  Th1  1  0.02277316  0.27017493  0.39468929  1.0
  Th  Th2  1  0.27017493  0.39468929  0.02277316  1.0
  Th  Th3  1  0.60531071  0.97722684  0.72982507  1.0
  Th  Th4  1  0.97722684  0.72982507  0.60531071  1.0
  Th  Th5  1  0.72982507  0.60531071  0.97722684  1.0
  Ir  Ir6  1  0.00000000  0.00000000  0.00000000  1.0
  Pd  Pd7  1  0.50000000  0.50000000  0.50000000  1.0
  Pd  Pd8  1  0.23467005  0.07232171  0.57918820  1.0
  Pd  Pd9  1  0.07232171  0.57918820  0.23467005  1.0
  Pd  Pd10  1  0.57918820  0.23467005  0.07232171  1.0
  Pd  Pd11  1  0.76532995  0.92767829  0.42081180  1.0
  Pd  Pd12  1  0.92767829  0.42081180  0.76532995  1.0
  Pd  Pd13  1  0.42081180  0.76532995  0.92767829  1.0