# generated using pymatgen
data_Ce4Th(ReB3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.48249977
_cell_length_b   5.48250042
_cell_length_c   8.70040749
_cell_angle_alpha   71.63486649
_cell_angle_beta   71.63487708
_cell_angle_gamma   59.99999330
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce4Th(ReB3)2
_chemical_formula_sum   'Ce4 Th1 Re2 B6'
_cell_volume   210.95861602
_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  0.74916817  0.74916817  0.75249349  1.0
  Ce  Ce1  1  0.25083183  0.25083183  0.24750651  1.0
  Ce  Ce2  1  0.58416549  0.58416549  0.24750352  1.0
  Ce  Ce3  1  0.41583451  0.41583451  0.75249648  1.0
  Th  Th4  1  0.00000000  0.00000000  0.00000000  1.0
  Re  Re5  1  0.88867200  0.88867200  0.33398399  1.0
  Re  Re6  1  0.11132800  0.11132800  0.66601701  1.0
  B  B7  1  0.50000000  0.17134998  0.50000000  1.0
  B  B8  1  0.82865002  0.50000000  0.50000000  1.0
  B  B9  1  0.17134998  0.82865002  0.50000000  1.0
  B  B10  1  0.17134998  0.50000000  0.50000000  1.0
  B  B11  1  0.82865002  0.17134998  0.50000000  1.0
  B  B12  1  0.50000000  0.82865002  0.50000000  1.0