# generated using pymatgen
data_Th6Mg3Cd20P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.94268057
_cell_length_b   9.96956033
_cell_length_c   9.96956117
_cell_angle_alpha   59.79616134
_cell_angle_beta   59.89145542
_cell_angle_gamma   59.89145362
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th6Mg3Cd20P
_chemical_formula_sum   'Th6 Mg3 Cd20 P1'
_cell_volume   696.55392850
_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  0.79523059  0.79670869  0.20504364  1.0
  Th  Th1  1  0.20476941  0.79495636  0.20329131  1.0
  Th  Th2  1  0.79487923  0.20326844  0.20326844  1.0
  Th  Th3  1  0.20476941  0.20329131  0.79495636  1.0
  Th  Th4  1  0.79523059  0.20504364  0.79670869  1.0
  Th  Th5  1  0.20512077  0.79673156  0.79673156  1.0
  Mg  Mg6  1  0.00000000  0.00000000  0.50000000  1.0
  Mg  Mg7  1  0.00000000  0.50000000  0.00000000  1.0
  Mg  Mg8  1  0.50000000  0.50000000  0.50000000  1.0
  Cd  Cd9  1  0.83424793  0.83317699  0.50339712  1.0
  Cd  Cd10  1  0.83424793  0.50339712  0.83317699  1.0
  Cd  Cd11  1  0.50554371  0.83191868  0.83191868  1.0
  Cd  Cd12  1  0.83519832  0.83181798  0.83181798  1.0
  Cd  Cd13  1  0.16575207  0.16682301  0.49660288  1.0
  Cd  Cd14  1  0.16575207  0.49660288  0.16682301  1.0
  Cd  Cd15  1  0.49445629  0.16808132  0.16808132  1.0
  Cd  Cd16  1  0.16480168  0.16818202  0.16818202  1.0
  Cd  Cd17  1  0.62482996  0.62017898  0.13724846  1.0
  Cd  Cd18  1  0.62482996  0.13724846  0.62017898  1.0
  Cd  Cd19  1  0.13702675  0.62262042  0.62262042  1.0
  Cd  Cd20  1  0.62238619  0.61992918  0.61992918  1.0
  Cd  Cd21  1  0.37517004  0.37982102  0.86275154  1.0
  Cd  Cd22  1  0.37517004  0.86275154  0.37982102  1.0
  Cd  Cd23  1  0.86297325  0.37737958  0.37737958  1.0
  Cd  Cd24  1  0.37761381  0.38007082  0.38007082  1.0
  Cd  Cd25  1  0.50000000  0.00000000  0.50000000  1.0
  Cd  Cd26  1  0.00000000  0.50000000  0.50000000  1.0
  Cd  Cd27  1  0.50000000  0.50000000  0.00000000  1.0
  Cd  Cd28  1  0.50000000  0.00000000  0.00000000  1.0
  P  P29  1  0.00000000  0.00000000  0.00000000  1.0