# generated using pymatgen
data_Th2Fe2Si2C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.80684865
_cell_length_b   5.80684865
_cell_length_c   7.05657761
_cell_angle_alpha   52.87290604
_cell_angle_beta   52.87290604
_cell_angle_gamma   40.23278660
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2Fe2Si2C
_chemical_formula_sum   'Th2 Fe2 Si2 C1'
_cell_volume   117.72959346
_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  0.44073500  0.44073500  0.29834800  1.0
  Th  Th1  1  0.55926500  0.55926500  0.70165200  1.0
  Fe  Fe2  1  0.80607600  0.80607600  0.07713500  1.0
  Fe  Fe3  1  0.19392400  0.19392400  0.92286500  1.0
  Si  Si4  1  0.82792100  0.82792100  0.72481000  1.0
  Si  Si5  1  0.17207900  0.17207900  0.27519000  1.0
  C  C6  1  0.00000000  0.00000000  0.00000000  1.0