# generated using pymatgen
data_Th2In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.31073858
_cell_length_b   6.31073858
_cell_length_c   6.31073858
_cell_angle_alpha   103.16196428
_cell_angle_beta   103.16196428
_cell_angle_gamma   122.99671695
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2In
_chemical_formula_sum   'Th4 In2'
_cell_volume   185.24217938
_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  0.65256753  0.15256753  0.80513406  1.0
  Th  Th1  1  0.84743247  0.65256753  0.50000000  1.0
  Th  Th2  1  0.15256753  0.34743247  0.50000000  1.0
  Th  Th3  1  0.34743247  0.84743247  0.19486594  1.0
  In  In4  1  0.75000000  0.75000000  -0.00000000  1.0
  In  In5  1  0.25000000  0.25000000  -0.00000000  1.0