# generated using pymatgen
data_InAu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.83732732
_cell_length_b   5.27183027
_cell_length_c   5.77875826
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InAu3
_chemical_formula_sum   'In2 Au6'
_cell_volume   147.36740014
_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
  In  In0  1  0.75000000  0.66453087  0.75000000  1.0
  In  In1  1  0.25000000  0.33546913  0.25000000  1.0
  Au  Au2  1  0.25000000  0.33732240  0.75000000  1.0
  Au  Au3  1  0.75000000  0.66267760  0.25000000  1.0
  Au  Au4  1  0.25000000  0.83677779  0.99853364  1.0
  Au  Au5  1  0.75000000  0.16322221  0.00146636  1.0
  Au  Au6  1  0.25000000  0.83677779  0.50146636  1.0
  Au  Au7  1  0.75000000  0.16322221  0.49853364  1.0