# generated using pymatgen
data_Al3Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.07538443
_cell_length_b   6.47551905
_cell_length_c   47.01594117
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Cu
_chemical_formula_sum   'Al48 Cu16'
_cell_volume   2154.11934498
_cell_formula_units_Z   16
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
  Al  Al1  1  0.534276  0.066628  0.308404  1
  Al  Al2  1  0.534276  0.671520  0.281057  1
  Al  Al3  1  0.267092  0.360967  0.294031  1
  Al  Al4  1  0.253648  0.970181  0.270182  1
  Al  Al5  1  0.801460  0.360967  0.294031  1
  Al  Al6  1  0.814903  0.970181  0.270182  1
  Al  Al7  1  0.534276  0.864950  0.365786  1
  Al  Al8  1  0.534276  0.464360  0.336210  1
  Al  Al9  1  0.275677  0.168603  0.351594  1
  Al  Al10  1  0.275338  0.764822  0.323846  1
  Al  Al11  1  0.792874  0.168603  0.351594  1
  Al  Al12  1  0.793214  0.764822  0.323846  1
  Al  Al13  1  0.534276  0.664379  0.421115  1
  Al  Al14  1  0.534276  0.267759  0.393615  1
  Al  Al15  1  0.267210  0.964983  0.407172  1
  Al  Al16  1  0.266786  0.565959  0.378921  1
  Al  Al17  1  0.801341  0.964983  0.407172  1
  Al  Al18  1  0.801766  0.565959  0.378921  1
  Al  Al19  1  0.534276  0.463197  0.476911  1
  Al  Al20  1  0.534276  0.063485  0.448935  1
  Al  Al21  1  0.267841  0.762835  0.462994  1
  Al  Al22  1  0.266799  0.364024  0.434984  1
  Al  Al23  1  0.800711  0.762835  0.462994  1
  Al  Al24  1  0.801752  0.364024  0.434984  1
  Al  Al25  1  0.534276  0.262321  0.532928  1
  Al  Al26  1  0.534276  0.861544  0.504866  1
  Al  Al27  1  0.266872  0.562010  0.518882  1
  Al  Al28  1  0.269602  0.162561  0.490855  1
  Al  Al29  1  0.801679  0.562010  0.518882  1
  Al  Al30  1  0.798949  0.162561  0.490855  1
  Al  Al31  1  0.534276  0.061439  0.588533  1
  Al  Al32  1  0.534276  0.658759  0.560446  1
  Al  Al33  1  0.264156  0.359442  0.574737  1
  Al  Al34  1  0.268583  0.961371  0.546757  1
  Al  Al35  1  0.804396  0.359442  0.574737  1
  Al  Al36  1  0.799969  0.961371  0.546757  1
  Al  Al37  1  0.534276  0.869866  0.645073  1
  Al  Al38  1  0.534276  0.454103  0.615824  1
  Al  Al39  1  0.267040  0.159046  0.630961  1
  Al  Al40  1  0.272838  0.759485  0.602484  1
  Al  Al41  1  0.801511  0.159046  0.630961  1
  Al  Al42  1  0.795714  0.759485  0.602484  1
  Al  Al43  1  0.534276  0.671850  0.698105  1
  Al  Al44  1  0.534276  0.257499  0.674630  1
  Al  Al45  1  0.257275  0.961654  0.686242  1
  Al  Al46  1  0.283017  0.559460  0.657408  1
  Al  Al47  1  0.811276  0.961654  0.686242  1
  Al  Al48  1  0.785535  0.559460  0.657408  1
  Cu  Cu49  1  0.034276  0.065128  0.312645  1
  Cu  Cu50  1  0.034276  0.666800  0.284548  1
  Cu  Cu51  1  0.034276  0.869270  0.364891  1
  Cu  Cu52  1  0.034276  0.463275  0.336665  1
  Cu  Cu53  1  0.034276  0.664528  0.421003  1
  Cu  Cu54  1  0.034276  0.264495  0.392720  1
  Cu  Cu55  1  0.034276  0.462041  0.476987  1
  Cu  Cu56  1  0.034276  0.063422  0.449190  1
  Cu  Cu57  1  0.034276  0.260087  0.532485  1
  Cu  Cu58  1  0.034276  0.863478  0.504852  1
  Cu  Cu59  1  0.034276  0.056268  0.588979  1
  Cu  Cu60  1  0.034276  0.663019  0.560987  1
  Cu  Cu61  1  0.034276  0.851456  0.643779  1
  Cu  Cu62  1  0.034276  0.463103  0.617076  1
  Cu  Cu63  1  0.034276  0.642434  0.695367  1
  Cu  Cu64  1  0.034276  0.273418  0.671447  1
