# generated using pymatgen
data_ThC2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.98410632
_cell_length_b   3.98410626
_cell_length_c   6.72802253
_cell_angle_alpha   78.43256648
_cell_angle_beta   78.43256639
_cell_angle_gamma   64.78592760
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThC2
_chemical_formula_sum   'Th2 C4'
_cell_volume   93.85557279
_cell_formula_units_Z   2
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  0.78893855  0.21106145  0.25000000  1.0
  Th  Th1  1  0.21106145  0.78893855  0.75000000  1.0
  C  C2  1  0.16835257  0.43293710  0.44690387  1.0
  C  C3  1  0.56706290  0.83164743  0.05309613  1.0
  C  C4  1  0.43293710  0.16835257  0.94690387  1.0
  C  C5  1  0.83164743  0.56706290  0.55309613  1.0