# generated using pymatgen
data_LaAu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.68087120
_cell_length_b   6.68086940
_cell_length_c   4.69999003
_cell_angle_alpha   89.99999968
_cell_angle_beta   89.99999115
_cell_angle_gamma   119.99996672
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaAu3
_chemical_formula_sum   'La2 Au6'
_cell_volume   181.67442537
_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
  La  La0  1  0.66666592  0.33333407  0.25000353  1.0
  La  La1  1  0.33333295  0.66666741  0.75000231  1.0
  Au  Au2  1  0.15085813  0.84914224  0.25000260  1.0
  Au  Au3  1  0.69828362  0.84914197  0.25000257  1.0
  Au  Au4  1  0.15085813  0.30171638  0.25000260  1.0
  Au  Au5  1  0.84914155  0.69828423  0.74999945  1.0
  Au  Au6  1  0.30171596  0.15085854  0.74999945  1.0
  Au  Au7  1  0.84914174  0.15085815  0.74999950  1.0