# generated using pymatgen
data_Al2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.36494258
_cell_length_b   5.14220057
_cell_length_c   47.36350575
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   74.95661331
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2Cu
_chemical_formula_sum   'Al54 Cu27'
_cell_volume   3143.51455352
_cell_formula_units_Z   27
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  0.137094  0.317216  0.360700  1
  Al  Al2  1  0.497393  0.961411  0.337322  1
  Al  Al3  1  0.836327  0.581623  0.307503  1
  Al  Al4  1  0.197112  0.786296  0.342372  1
  Al  Al5  1  0.681020  0.604437  0.343698  1
  Al  Al6  1  0.005842  0.728043  0.326120  1
  Al  Al7  1  0.027031  0.873539  0.380515  1
  Al  Al8  1  0.444980  0.490589  0.338097  1
  Al  Al9  1  0.701617  0.747862  0.399325  1
  Al  Al10  1  0.347968  0.910467  0.373225  1
  Al  Al11  1  0.502339  0.122261  0.395177  1
  Al  Al12  1  0.799476  0.101011  0.322523  1
  Al  Al13  1  0.029984  0.028860  0.438278  1
  Al  Al14  1  0.375116  0.599146  0.422436  1
  Al  Al15  1  0.817814  0.247138  0.379306  1
  Al  Al16  1  0.159947  0.490830  0.414926  1
  Al  Al17  1  0.669593  0.270146  0.418356  1
  Al  Al18  1  0.980072  0.408848  0.398478  1
  Al  Al19  1  0.009964  0.551952  0.459601  1
  Al  Al20  1  0.349086  0.116473  0.430399  1
  Al  Al21  1  0.678527  0.373027  0.476652  1
  Al  Al22  1  0.208126  0.690038  0.462773  1
  Al  Al23  1  0.397409  0.744011  0.476544  1
  Al  Al24  1  0.710856  0.856874  0.455240  1
  Al  Al25  1  0.972252  0.700760  0.522654  1
  Al  Al26  1  0.357735  0.261205  0.486857  1
  Al  Al27  1  0.569752  0.888163  0.494822  1
  Al  Al28  1  0.045601  0.095094  0.495621  1
  Al  Al29  1  0.426554  0.886212  0.535686  1
  Al  Al30  1  0.869706  0.018515  0.475206  1
  Al  Al31  1  0.957029  0.982929  0.578432  1
  Al  Al32  1  0.350626  0.432794  0.538939  1
  Al  Al33  1  0.676435  0.519836  0.534473  1
  Al  Al34  1  0.068453  0.245953  0.549223  1
  Al  Al35  1  0.588939  0.073410  0.550535  1
  Al  Al36  1  0.874096  0.222998  0.530620  1
  Al  Al37  1  0.859301  0.599852  0.568589  1
  Al  Al38  1  0.237129  0.933345  0.516975  1
  Al  Al39  1  0.517805  0.741338  0.627624  1
  Al  Al40  1  0.244672  0.200603  0.574352  1
  Al  Al41  1  0.324786  0.676006  0.587018  1
  Al  Al42  1  0.669840  0.721670  0.589108  1
  Al  Al43  1  0.877729  0.584909  0.670488  1
  Al  Al44  1  0.310701  0.963714  0.632725  1
  Al  Al45  1  0.597928  0.191963  0.615103  1
  Al  Al46  1  0.922450  0.305491  0.621627  1
  Al  Al47  1  0.482578  0.055569  0.674886  1
  Al  Al48  1  0.824058  0.866749  0.620175  1
  Al  Al49  1  0.830966  0.116290  0.671506  1
  Al  Al50  1  0.210123  0.489881  0.624406  1
  Al  Al51  1  0.388162  0.649384  0.679237  1
  Al  Al52  1  0.080251  0.291091  0.656188  1
  Al  Al53  1  0.271547  0.268231  0.678669  1
  Al  Al54  1  0.601054  0.416680  0.671460  1
  Cu  Cu55  1  0.298166  0.228804  0.328688  1
  Cu  Cu56  1  0.649207  0.137402  0.359986  1
  Cu  Cu57  1  0.962120  0.257752  0.342005  1
  Cu  Cu58  1  0.311337  0.427434  0.377517  1
  Cu  Cu59  1  0.534704  0.595303  0.384363  1
  Cu  Cu60  1  0.852922  0.733690  0.362986  1
  Cu  Cu61  1  0.192159  0.966490  0.406324  1
  Cu  Cu62  1  0.543617  0.739738  0.437840  1
  Cu  Cu63  1  0.868623  0.875423  0.419583  1
  Cu  Cu64  1  0.189565  0.190559  0.462599  1
  Cu  Cu65  1  0.516361  0.251530  0.453051  1
  Cu  Cu66  1  0.838039  0.401395  0.436055  1
  Cu  Cu67  1  0.165785  0.473233  0.509805  1
  Cu  Cu68  1  0.519689  0.404804  0.509622  1
  Cu  Cu69  1  0.844387  0.536140  0.488617  1
  Cu  Cu70  1  0.146289  0.714751  0.558493  1
  Cu  Cu71  1  0.517020  0.535104  0.573414  1
  Cu  Cu72  1  0.750171  0.934899  0.518791  1
  Cu  Cu73  1  0.126014  0.995474  0.607382  1
  Cu  Cu74  1  0.438362  0.093681  0.587229  1
  Cu  Cu75  1  0.750977  0.186739  0.577098  1
  Cu  Cu76  1  0.049071  0.512867  0.596157  1
  Cu  Cu77  1  0.408128  0.374165  0.632431  1
  Cu  Cu78  1  0.732896  0.427600  0.631614  1
  Cu  Cu79  1  0.012433  0.811670  0.641171  1
  Cu  Cu80  1  0.183883  0.800072  0.667509  1
  Cu  Cu81  1  0.677182  0.871768  0.657865  1
