# generated using pymatgen
data_Ta3Al2AuC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.37100734
_cell_length_b   8.37100726
_cell_length_c   8.37100604
_cell_angle_alpha   60.00000095
_cell_angle_beta   60.00000130
_cell_angle_gamma   60.00000275
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3Al2AuC
_chemical_formula_sum   'Ta12 Al8 Au4 C4'
_cell_volume   414.78029408
_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
  Ta  Ta0  1  0.57008970  0.92991030  0.57008970  1.0
  Ta  Ta1  1  0.32008970  0.67991030  0.67991030  1.0
  Ta  Ta2  1  0.67991030  0.32008970  0.32008970  1.0
  Ta  Ta3  1  0.32008970  0.67991030  0.32008970  1.0
  Ta  Ta4  1  0.67991030  0.67991030  0.32008970  1.0
  Ta  Ta5  1  0.32008970  0.32008970  0.67991030  1.0
  Ta  Ta6  1  0.57008970  0.57008970  0.92991030  1.0
  Ta  Ta7  1  0.92991030  0.57008970  0.57008970  1.0
  Ta  Ta8  1  0.57008970  0.92991030  0.92991030  1.0
  Ta  Ta9  1  0.92991030  0.92991030  0.57008970  1.0
  Ta  Ta10  1  0.67991030  0.32008970  0.67991030  1.0
  Ta  Ta11  1  0.92991030  0.57008970  0.92991030  1.0
  Al  Al12  1  0.91422500  0.91422500  0.91422500  1.0
  Al  Al13  1  0.99267500  0.33577500  0.33577500  1.0
  Al  Al14  1  0.33577500  0.99267500  0.33577500  1.0
  Al  Al15  1  0.33577500  0.33577500  0.99267500  1.0
  Al  Al16  1  0.91422500  0.25732500  0.91422500  1.0
  Al  Al17  1  0.91422500  0.91422500  0.25732500  1.0
  Al  Al18  1  0.25732500  0.91422500  0.91422500  1.0
  Al  Al19  1  0.33577500  0.33577500  0.33577500  1.0
  Au  Au20  1  0.12500000  0.12500000  0.12500000  1.0
  Au  Au21  1  0.62500000  0.12500000  0.12500000  1.0
  Au  Au22  1  0.12500000  0.62500000  0.12500000  1.0
  Au  Au23  1  0.12500000  0.12500000  0.62500000  1.0
  C  C24  1  0.62500000  0.62500000  0.62500000  1.0
  C  C25  1  0.12500000  0.62500000  0.62500000  1.0
  C  C26  1  0.62500000  0.12500000  0.62500000  1.0
  C  C27  1  0.62500000  0.62500000  0.12500000  1.0