# generated using pymatgen
data_SmTh(FeSi2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.03967355
_cell_length_b   4.30477311
_cell_length_c   8.03979448
_cell_angle_alpha   76.03521574
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmTh(FeSi2)2
_chemical_formula_sum   'Sm1 Th1 Fe2 Si4'
_cell_volume   135.67882325
_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
  Sm  Sm0  1  0.75000000  0.39537225  0.20649453  1.0
  Th  Th1  1  0.25000000  0.61012511  0.79132341  1.0
  Fe  Fe2  1  0.25000000  0.88127691  0.39356443  1.0
  Fe  Fe3  1  0.75000000  0.11216108  0.60963136  1.0
  Si  Si4  1  0.25000000  0.95681041  0.09908201  1.0
  Si  Si5  1  0.75000000  0.04646496  0.90664186  1.0
  Si  Si6  1  0.25000000  0.32536789  0.49286350  1.0
  Si  Si7  1  0.75000000  0.67242039  0.50039890  1.0