# generated using pymatgen
data_LaBe2Au5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.65885276
_cell_length_b   8.63601830
_cell_length_c   9.88449260
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBe2Au5
_chemical_formula_sum   'La4 Be8 Au20'
_cell_volume   568.41737730
_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
  La  La0  1  0.25000000  0.25737400  0.12589948  1.0
  La  La1  1  0.25000000  0.75737400  0.37410052  1.0
  La  La2  1  0.75000000  0.74262600  0.87410052  1.0
  La  La3  1  0.75000000  0.24262600  0.62589948  1.0
  Be  Be4  1  0.25000000  0.06111587  0.59653857  1.0
  Be  Be5  1  0.25000000  0.56111587  0.90346143  1.0
  Be  Be6  1  0.75000000  0.93888413  0.40346143  1.0
  Be  Be7  1  0.75000000  0.43888413  0.09653857  1.0
  Be  Be8  1  0.25000000  0.32787338  0.48009197  1.0
  Be  Be9  1  0.25000000  0.82787338  0.01990803  1.0
  Be  Be10  1  0.75000000  0.67212662  0.51990803  1.0
  Be  Be11  1  0.75000000  0.17212662  0.98009197  1.0
  Au  Au12  1  0.04219632  0.10363760  0.39365817  1.0
  Au  Au13  1  0.45780368  0.60363760  0.10634183  1.0
  Au  Au14  1  0.54219632  0.89636240  0.60634183  1.0
  Au  Au15  1  0.95780368  0.39636240  0.89365817  1.0
  Au  Au16  1  0.95780368  0.89636240  0.60634183  1.0
  Au  Au17  1  0.54219632  0.39636240  0.89365817  1.0
  Au  Au18  1  0.45780368  0.10363760  0.39365817  1.0
  Au  Au19  1  0.04219632  0.60363760  0.10634183  1.0
  Au  Au20  1  0.02145360  0.05901965  0.86520827  1.0
  Au  Au21  1  0.47854640  0.55901965  0.63479173  1.0
  Au  Au22  1  0.52145360  0.94098035  0.13479173  1.0
  Au  Au23  1  0.97854640  0.44098035  0.36520827  1.0
  Au  Au24  1  0.97854640  0.94098035  0.13479173  1.0
  Au  Au25  1  0.52145360  0.44098035  0.36520827  1.0
  Au  Au26  1  0.47854640  0.05901965  0.86520827  1.0
  Au  Au27  1  0.02145360  0.55901965  0.63479173  1.0
  Au  Au28  1  0.25000000  0.28954784  0.71347955  1.0
  Au  Au29  1  0.25000000  0.78954784  0.78652045  1.0
  Au  Au30  1  0.75000000  0.71045216  0.28652045  1.0
  Au  Au31  1  0.75000000  0.21045216  0.21347955  1.0