# generated using pymatgen
data_ErTh2In5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.51460658
_cell_length_b   6.51460591
_cell_length_c   10.36679140
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   101.88493507
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErTh2In5
_chemical_formula_sum   'Er2 Th4 In10'
_cell_volume   430.53609606
_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
  Er  Er0  1  0.13488538  0.13488538  0.75000000  1.0
  Er  Er1  1  0.86511462  0.86511462  0.25000000  1.0
  Th  Th2  1  0.70327929  0.29672071  0.00000000  1.0
  Th  Th3  1  0.70327929  0.29672071  0.50000000  1.0
  Th  Th4  1  0.29672071  0.70327929  0.00000000  1.0
  Th  Th5  1  0.29672071  0.70327929  0.50000000  1.0
  In  In6  1  0.51315660  0.51315660  0.75000000  1.0
  In  In7  1  0.48684340  0.48684340  0.25000000  1.0
  In  In8  1  0.81795183  0.81795183  0.54526735  1.0
  In  In9  1  0.18204817  0.18204817  0.45473265  1.0
  In  In10  1  0.81795183  0.81795183  0.95473265  1.0
  In  In11  1  0.18204817  0.18204817  0.04526735  1.0
  In  In12  1  0.99331375  0.57386268  0.75000000  1.0
  In  In13  1  0.42613732  0.00668625  0.25000000  1.0
  In  In14  1  0.00668625  0.42613732  0.25000000  1.0
  In  In15  1  0.57386268  0.99331375  0.75000000  1.0