# generated using pymatgen
data_CeThAl6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.50286073
_cell_length_b   6.50286103
_cell_length_c   4.61525447
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999850
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeThAl6
_chemical_formula_sum   'Ce1 Th1 Al6'
_cell_volume   169.01887874
_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
  Ce  Ce0  1  0.00000000  0.00000000  0.50000000  1.0
  Th  Th1  1  0.66666700  0.33333300  0.00000000  1.0
  Al  Al2  1  0.19319224  0.80680776  0.00000000  1.0
  Al  Al3  1  0.19319224  0.38638549  0.00000000  1.0
  Al  Al4  1  0.61361451  0.80680776  0.00000000  1.0
  Al  Al5  1  0.47228446  0.52771554  0.50000000  1.0
  Al  Al6  1  0.47228446  0.94456692  0.50000000  1.0
  Al  Al7  1  0.05543308  0.52771554  0.50000000  1.0