# generated using pymatgen
data_ErTh(FeSi2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.01152547
_cell_length_b   4.27602677
_cell_length_c   7.94975506
_cell_angle_alpha   75.82417748
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErTh(FeSi2)2
_chemical_formula_sum   'Er1 Th1 Fe2 Si4'
_cell_volume   132.21276278
_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
  Er  Er0  1  0.75000000  0.38882890  0.20911517  1.0
  Th  Th1  1  0.25000000  0.60731736  0.79384931  1.0
  Fe  Fe2  1  0.25000000  0.88831602  0.39128067  1.0
  Fe  Fe3  1  0.75000000  0.11334004  0.60832849  1.0
  Si  Si4  1  0.25000000  0.95175286  0.10117586  1.0
  Si  Si5  1  0.75000000  0.04485694  0.90924514  1.0
  Si  Si6  1  0.25000000  0.33110376  0.48979613  1.0
  Si  Si7  1  0.75000000  0.67448512  0.49721023  1.0