# generated using pymatgen
data_Er9Th(SiSn3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.14818565
_cell_length_b   9.14818632
_cell_length_c   6.42309392
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.03594989
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er9Th(SiSn3)2
_chemical_formula_sum   'Er9 Th1 Si2 Sn6'
_cell_volume   465.35826948
_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  0.66566478  0.33277734  0.00112506  1.0
  Er  Er1  1  0.33277734  0.66566478  0.00112506  1.0
  Er  Er2  1  0.33277734  0.66566478  0.49887494  1.0
  Er  Er3  1  0.66566478  0.33277734  0.49887494  1.0
  Er  Er4  1  0.24111230  0.99867709  0.75000000  1.0
  Er  Er5  1  0.99867709  0.24111230  0.75000000  1.0
  Er  Er6  1  0.26668092  0.26668092  0.25000000  1.0
  Er  Er7  1  0.73739793  0.00104337  0.25000000  1.0
  Er  Er8  1  0.00104337  0.73739793  0.25000000  1.0
  Th  Th9  1  0.75730961  0.75730961  0.75000000  1.0
  Si  Si10  1  0.00347817  0.00347817  0.03738957  1.0
  Si  Si11  1  0.00347817  0.00347817  0.46261043  1.0
  Sn  Sn12  1  0.39125269  0.39125269  0.75000000  1.0
  Sn  Sn13  1  0.59920659  0.00307831  0.75000000  1.0
  Sn  Sn14  1  0.00307831  0.59920659  0.75000000  1.0
  Sn  Sn15  1  0.61142020  0.61142020  0.25000000  1.0
  Sn  Sn16  1  0.38953582  0.99944359  0.25000000  1.0
  Sn  Sn17  1  0.99944359  0.38953582  0.25000000  1.0