# generated using pymatgen
data_Al2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87146564
_cell_length_b   13.28489372
_cell_length_c   48.11241551
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2Cu
_chemical_formula_sum   'Al64 Cu32'
_cell_volume   3752.85486587
_cell_formula_units_Z   32
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  0.248536  0.458626  0.379960  1
  Al  Al2  1  0.246356  0.025374  0.326169  1
  Al  Al3  1  0.266664  0.525374  0.326169  1
  Al  Al4  1  0.264485  0.958626  0.379960  1
  Al  Al5  1  0.737096  0.854694  0.296642  1
  Al  Al6  1  0.777946  0.222422  0.336942  1
  Al  Al7  1  0.735074  0.722422  0.336942  1
  Al  Al8  1  0.775925  0.354694  0.296642  1
  Al  Al9  1  0.746356  0.525374  0.326169  1
  Al  Al10  1  0.748536  0.958626  0.379960  1
  Al  Al11  1  0.764485  0.458626  0.379960  1
  Al  Al12  1  0.766664  0.025374  0.326169  1
  Al  Al13  1  0.277946  0.722422  0.336942  1
  Al  Al14  1  0.237096  0.354694  0.296642  1
  Al  Al15  1  0.275925  0.854694  0.296642  1
  Al  Al16  1  0.235074  0.222422  0.336942  1
  Al  Al17  1  0.258299  0.245659  0.491173  1
  Al  Al18  1  0.273788  0.838949  0.425443  1
  Al  Al19  1  0.239232  0.338949  0.425443  1
  Al  Al20  1  0.254721  0.745659  0.491173  1
  Al  Al21  1  0.744110  0.646310  0.407258  1
  Al  Al22  1  0.741964  0.052622  0.462082  1
  Al  Al23  1  0.771056  0.552622  0.462082  1
  Al  Al24  1  0.768911  0.146310  0.407258  1
  Al  Al25  1  0.773788  0.338949  0.425443  1
  Al  Al26  1  0.758299  0.745659  0.491173  1
  Al  Al27  1  0.754721  0.245659  0.491173  1
  Al  Al28  1  0.739232  0.838949  0.425443  1
  Al  Al29  1  0.241964  0.552622  0.462082  1
  Al  Al30  1  0.244110  0.146310  0.407258  1
  Al  Al31  1  0.268911  0.646310  0.407258  1
  Al  Al32  1  0.271056  0.052622  0.462082  1
  Al  Al33  1  0.253930  0.034108  0.598060  1
  Al  Al34  1  0.239247  0.638720  0.543670  1
  Al  Al35  1  0.273774  0.138720  0.543670  1
  Al  Al36  1  0.259090  0.534108  0.598060  1
  Al  Al37  1  0.765550  0.441370  0.512387  1
  Al  Al38  1  0.765850  0.839673  0.576793  1
  Al  Al39  1  0.747170  0.339673  0.576793  1
  Al  Al40  1  0.747470  0.941370  0.512387  1
  Al  Al41  1  0.739247  0.138720  0.543670  1
  Al  Al42  1  0.753930  0.534108  0.598060  1
  Al  Al43  1  0.759090  0.034108  0.598060  1
  Al  Al44  1  0.773774  0.638720  0.543670  1
  Al  Al45  1  0.265850  0.339673  0.576793  1
  Al  Al46  1  0.265550  0.941370  0.512387  1
  Al  Al47  1  0.247470  0.441370  0.512387  1
  Al  Al48  1  0.247170  0.839673  0.576793  1
  Al  Al49  1  0.233581  0.833406  0.706367  1
  Al  Al50  1  0.275989  0.456008  0.662751  1
  Al  Al51  1  0.237031  0.956008  0.662751  1
  Al  Al52  1  0.279440  0.333406  0.706367  1
  Al  Al53  1  0.754568  0.229492  0.626077  1
  Al  Al54  1  0.759304  0.651516  0.681782  1
  Al  Al55  1  0.753717  0.151516  0.681782  1
  Al  Al56  1  0.758453  0.729492  0.626077  1
  Al  Al57  1  0.775989  0.956008  0.662751  1
  Al  Al58  1  0.733581  0.333406  0.706367  1
  Al  Al59  1  0.779440  0.833406  0.706367  1
  Al  Al60  1  0.737031  0.456008  0.662751  1
  Al  Al61  1  0.259304  0.151516  0.681782  1
  Al  Al62  1  0.254568  0.729492  0.626077  1
  Al  Al63  1  0.258453  0.229492  0.626077  1
  Al  Al64  1  0.253717  0.651516  0.681782  1
  Cu  Cu65  1  0.506510  0.661391  0.294058  1
  Cu  Cu66  1  0.506510  0.115321  0.365334  1
  Cu  Cu67  1  1.006510  0.869376  0.343681  1
  Cu  Cu68  1  0.006510  0.523141  0.284047  1
  Cu  Cu69  1  1.006510  0.615321  0.365334  1
  Cu  Cu70  1  0.006510  0.161391  0.294058  1
  Cu  Cu71  1  0.506510  0.023141  0.284047  1
  Cu  Cu72  1  0.506510  0.369376  0.343681  1
  Cu  Cu73  1  0.506510  0.490920  0.423731  1
  Cu  Cu74  1  0.506510  0.886320  0.468920  1
  Cu  Cu75  1  0.006510  0.710611  0.448077  1
  Cu  Cu76  1  1.006510  0.289107  0.379569  1
  Cu  Cu77  1  0.006510  0.386320  0.468920  1
  Cu  Cu78  1  0.006510  0.990920  0.423731  1
  Cu  Cu79  1  0.506510  0.789107  0.379569  1
  Cu  Cu80  1  0.506510  0.210611  0.448077  1
  Cu  Cu81  1  0.506510  0.303085  0.533466  1
  Cu  Cu82  1  0.506510  0.685790  0.583494  1
  Cu  Cu83  1  1.006510  0.477268  0.556095  1
  Cu  Cu84  1  0.006510  0.093449  0.503429  1
  Cu  Cu85  1  1.006510  0.185790  0.583494  1
  Cu  Cu86  1  0.006510  0.803085  0.533466  1
  Cu  Cu87  1  0.506510  0.593449  0.503429  1
  Cu  Cu88  1  0.506510  0.977268  0.556095  1
  Cu  Cu89  1  0.506510  0.079810  0.640156  1
  Cu  Cu90  1  0.506510  0.509014  0.707229  1
  Cu  Cu91  1  0.006510  0.303350  0.664550  1
  Cu  Cu92  1  1.006510  0.891340  0.621013  1
  Cu  Cu93  1  0.006510  0.009014  0.707229  1
  Cu  Cu94  1  1.006510  0.579810  0.640156  1
  Cu  Cu95  1  0.506510  0.391340  0.621013  1
  Cu  Cu96  1  0.506510  0.803350  0.664550  1
