# generated using pymatgen
data_ThTi2GaAu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.70750316
_cell_length_b   5.70750457
_cell_length_c   5.61869214
_cell_angle_alpha   102.02592931
_cell_angle_beta   102.02591527
_cell_angle_gamma   126.14110652
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThTi2GaAu3
_chemical_formula_sum   'Th1 Ti2 Ga1 Au3'
_cell_volume   131.24005378
_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
  Th  Th0  1  0.00557941  0.99442059  1.00000000  1.0
  Ti  Ti1  1  0.24813446  0.75186554  0.50000000  1.0
  Ti  Ti2  1  0.74813446  0.25186554  0.50000000  1.0
  Ga  Ga3  1  0.30344420  0.69655580  1.00000000  1.0
  Au  Au4  1  0.30692090  0.31728692  0.62420682  1.0
  Au  Au5  1  0.68271308  0.69307910  0.37579318  1.0
  Au  Au6  1  0.70507251  0.29492749  1.00000000  1.0