# generated using pymatgen
data_Ti3AlAuO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.91532374
_cell_length_b   6.91532374
_cell_length_c   6.91532374
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3AlAuO
_chemical_formula_sum   'Ti12 Al4 Au4 O4'
_cell_volume   330.70255372
_cell_formula_units_Z   4
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
  Ti  Ti0  1  0.78577758  0.95687967  0.37587811  1.0
  Ti  Ti1  1  0.71422242  0.04312033  0.87587811  1.0
  Ti  Ti2  1  0.21422242  0.45687967  0.12412189  1.0
  Ti  Ti3  1  0.28577758  0.54312033  0.62412189  1.0
  Ti  Ti4  1  0.95687967  0.37587811  0.78577758  1.0
  Ti  Ti5  1  0.04312033  0.87587811  0.71422242  1.0
  Ti  Ti6  1  0.45687967  0.12412189  0.21422242  1.0
  Ti  Ti7  1  0.54312033  0.62412189  0.28577758  1.0
  Ti  Ti8  1  0.37587811  0.78577758  0.95687967  1.0
  Ti  Ti9  1  0.87587811  0.71422242  0.04312033  1.0
  Ti  Ti10  1  0.12412189  0.21422242  0.45687967  1.0
  Ti  Ti11  1  0.62412189  0.28577758  0.54312033  1.0
  Al  Al12  1  0.57278361  0.42721639  0.92721639  1.0
  Al  Al13  1  0.42721639  0.92721639  0.57278361  1.0
  Al  Al14  1  0.92721639  0.57278361  0.42721639  1.0
  Al  Al15  1  0.07278361  0.07278361  0.07278361  1.0
  Au  Au16  1  0.17875484  0.82124516  0.32124516  1.0
  Au  Au17  1  0.32124516  0.17875484  0.82124516  1.0
  Au  Au18  1  0.82124516  0.32124516  0.17875484  1.0
  Au  Au19  1  0.67875484  0.67875484  0.67875484  1.0
  O  O20  1  0.87691164  0.12308836  0.62308836  1.0
  O  O21  1  0.62308836  0.87691164  0.12308836  1.0
  O  O22  1  0.12308836  0.62308836  0.87691164  1.0
  O  O23  1  0.37691164  0.37691164  0.37691164  1.0