# generated using pymatgen
data_ThFe2SiC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.69018334
_cell_length_b   5.69018334
_cell_length_c   6.79010100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   139.97602481
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThFe2SiC
_chemical_formula_sum   'Th2 Fe4 Si2 C2'
_cell_volume   141.38805979
_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  0.05853800  0.94146200  0.25000000  1.0
  Th  Th1  1  0.94146200  0.05853800  0.75000000  1.0
  Fe  Fe2  1  0.33623500  0.66376500  0.06056900  1.0
  Fe  Fe3  1  0.33623500  0.66376500  0.43943100  1.0
  Fe  Fe4  1  0.66376500  0.33623500  0.93943100  1.0
  Fe  Fe5  1  0.66376500  0.33623500  0.56056900  1.0
  Si  Si6  1  0.77534900  0.22465100  0.25000000  1.0
  Si  Si7  1  0.22465100  0.77534900  0.75000000  1.0
  C  C8  1  0.50000000  0.50000000  0.50000000  1.0
  C  C9  1  0.50000000  0.50000000  0.00000000  1.0