# generated using pymatgen
data_Th2FeC2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.80008050
_cell_length_b   3.80008116
_cell_length_c   6.79820875
_cell_angle_alpha   106.22983827
_cell_angle_beta   106.22984752
_cell_angle_gamma   90.00001010
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2FeC2
_chemical_formula_sum   'Th2 Fe1 C2'
_cell_volume   90.17621771
_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  0.64547116  0.64547116  0.29094631  1.0
  Th  Th1  1  0.35452684  0.35452684  0.70905369  1.0
  Fe  Fe2  1  0.00000000  0.00000000  0.00000000  1.0
  C  C3  1  0.15532984  0.15532984  0.31066068  1.0
  C  C4  1  0.84466916  0.84466916  0.68933932  1.0