# generated using pymatgen
data_Al2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.87725065
_cell_length_b   19.28374823
_cell_length_c   52.32760906
_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   'Al96 Cu48'
_cell_volume   4921.49920454
_cell_formula_units_Z   48
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  0.501105  0.134960  0.350369  1
  Al  Al2  1  0.501105  0.834585  0.313798  1
  Al  Al3  1  0.501105  0.435137  0.387515  1
  Al  Al4  1  0.001105  0.227115  0.361784  1
  Al  Al5  1  0.001105  0.926208  0.324563  1
  Al  Al6  1  0.001105  0.628333  0.288795  1
  Al  Al7  1  0.001105  0.166693  0.316383  1
  Al  Al8  1  1.001105  0.765952  0.390423  1
  Al  Al9  1  0.001105  0.466050  0.353253  1
  Al  Al10  1  0.501105  0.257451  0.327527  1
  Al  Al11  1  0.501105  0.958235  0.290986  1
  Al  Al12  1  0.501105  0.557902  0.364618  1
  Al  Al13  1  0.001105  0.334585  0.313798  1
  Al  Al14  1  0.001105  0.935137  0.387515  1
  Al  Al15  1  1.001105  0.634960  0.350369  1
  Al  Al16  1  0.501105  0.128333  0.288795  1
  Al  Al17  1  0.501105  0.727115  0.361784  1
  Al  Al18  1  0.501105  0.426208  0.324563  1
  Al  Al19  1  0.501105  0.265952  0.390423  1
  Al  Al20  1  0.501105  0.966050  0.353253  1
  Al  Al21  1  0.501105  0.666693  0.316383  1
  Al  Al22  1  0.001105  0.057902  0.364618  1
  Al  Al23  1  0.001105  0.757451  0.327527  1
  Al  Al24  1  0.001105  0.458235  0.290986  1
  Al  Al25  1  0.501105  0.035118  0.461608  1
  Al  Al26  1  0.501105  0.735116  0.424570  1
  Al  Al27  1  0.501105  0.335118  0.498645  1
  Al  Al28  1  0.001105  0.127108  0.472925  1
  Al  Al29  1  0.001105  0.827107  0.435888  1
  Al  Al30  1  0.001105  0.527092  0.398839  1
  Al  Al31  1  1.001105  0.065956  0.427463  1
  Al  Al32  1  0.001105  0.665955  0.501539  1
  Al  Al33  1  0.001105  0.365955  0.464502  1
  Al  Al34  1  0.501105  0.157944  0.438780  1
  Al  Al35  1  0.501105  0.857945  0.401744  1
  Al  Al36  1  0.501105  0.457944  0.475819  1
  Al  Al37  1  0.001105  0.235116  0.424570  1
  Al  Al38  1  0.001105  0.835118  0.498645  1
  Al  Al39  1  1.001105  0.535118  0.461608  1
  Al  Al40  1  0.501105  0.027092  0.398839  1
  Al  Al41  1  0.501105  0.627108  0.472925  1
  Al  Al42  1  0.501105  0.327107  0.435888  1
  Al  Al43  1  0.501105  0.165955  0.501539  1
  Al  Al44  1  0.501105  0.865955  0.464502  1
  Al  Al45  1  0.501105  0.565956  0.427463  1
  Al  Al46  1  1.001105  0.957944  0.475819  1
  Al  Al47  1  0.001105  0.657944  0.438780  1
  Al  Al48  1  0.001105  0.357945  0.401744  1
  Al  Al49  1  0.501105  0.935119  0.572719  1
  Al  Al50  1  0.501105  0.635118  0.535683  1
  Al  Al51  1  0.501105  0.235118  0.609777  1
  Al  Al52  1  0.001105  0.027109  0.584037  1
  Al  Al53  1  0.001105  0.727108  0.547000  1
  Al  Al54  1  0.001105  0.427108  0.509963  1
  Al  Al55  1  0.001105  0.965955  0.538576  1
  Al  Al56  1  0.001105  0.565971  0.612664  1
  Al  Al57  1  0.001105  0.265958  0.575615  1
  Al  Al58  1  0.501105  0.057945  0.549893  1
  Al  Al59  1  0.501105  0.757944  0.512856  1
  Al  Al60  1  0.501105  0.357941  0.586931  1
  Al  Al61  1  0.001105  0.135118  0.535683  1
  Al  Al62  1  0.001105  0.735118  0.609777  1
  Al  Al63  1  1.001105  0.435119  0.572719  1
  Al  Al64  1  0.501105  0.927108  0.509963  1
  Al  Al65  1  0.501105  0.527109  0.584037  1
  Al  Al66  1  0.501105  0.227108  0.547000  1
  Al  Al67  1  0.501105  0.065971  0.612664  1
  Al  Al68  1  0.501105  0.765958  0.575615  1
  Al  Al69  1  0.501105  0.465955  0.538576  1
  Al  Al70  1  0.001105  0.857941  0.586931  1
  Al  Al71  1  0.001105  0.557945  0.549893  1
  Al  Al72  1  0.001105  0.257944  0.512856  1
  Al  Al73  1  0.501105  0.835309  0.684299  1
  Al  Al74  1  0.501105  0.535128  0.646836  1
  Al  Al75  1  0.501105  0.135171  0.720391  1
  Al  Al76  1  0.001105  0.925201  0.695019  1
  Al  Al77  1  0.001105  0.627148  0.658229  1
  Al  Al78  1  1.001105  0.327087  0.621100  1
  Al  Al79  1  1.001105  0.866009  0.649690  1
  Al  Al80  1  0.001105  0.463565  0.723717  1
  Al  Al81  1  0.001105  0.166782  0.686840  1
  Al  Al82  1  0.501105  0.957993  0.660977  1
  Al  Al83  1  0.501105  0.657975  0.624000  1
  Al  Al84  1  0.501105  0.259252  0.697613  1
  Al  Al85  1  0.001105  0.035128  0.646836  1
  Al  Al86  1  1.001105  0.635171  0.720391  1
  Al  Al87  1  0.001105  0.335309  0.684299  1
  Al  Al88  1  0.501105  0.827087  0.621100  1
  Al  Al89  1  0.501105  0.425201  0.695019  1
  Al  Al90  1  0.501105  0.127148  0.658229  1
  Al  Al91  1  0.501105  0.963565  0.723717  1
  Al  Al92  1  0.501105  0.666782  0.686840  1
  Al  Al93  1  0.501105  0.366009  0.649690  1
  Al  Al94  1  1.001105  0.759252  0.697613  1
  Al  Al95  1  0.001105  0.457993  0.660977  1
  Al  Al96  1  0.001105  0.157975  0.624000  1
  Cu  Cu97  1  0.251706  0.246847  0.283319  1
  Cu  Cu98  1  0.250969  0.846565  0.357620  1
  Cu  Cu99  1  0.252262  0.546524  0.320210  1
  Cu  Cu100  1  0.750504  0.246847  0.283319  1
  Cu  Cu101  1  0.751241  0.846565  0.357620  1
  Cu  Cu102  1  0.749948  0.546524  0.320210  1
  Cu  Cu103  1  0.750969  0.346565  0.357620  1
  Cu  Cu104  1  0.752262  0.046524  0.320210  1
  Cu  Cu105  1  0.751706  0.746847  0.283319  1
  Cu  Cu106  1  0.251241  0.346565  0.357620  1
  Cu  Cu107  1  0.249948  0.046524  0.320210  1
  Cu  Cu108  1  0.250504  0.746847  0.283319  1
  Cu  Cu109  1  0.251118  0.146523  0.394625  1
  Cu  Cu110  1  0.251110  0.746531  0.468714  1
  Cu  Cu111  1  0.251114  0.446531  0.431675  1
  Cu  Cu112  1  0.751092  0.146523  0.394625  1
  Cu  Cu113  1  0.751100  0.746531  0.468714  1
  Cu  Cu114  1  0.751096  0.446531  0.431675  1
  Cu  Cu115  1  0.751110  0.246531  0.468714  1
  Cu  Cu116  1  0.751114  0.946531  0.431675  1
  Cu  Cu117  1  0.751118  0.646523  0.394625  1
  Cu  Cu118  1  0.251100  0.246531  0.468714  1
  Cu  Cu119  1  0.251096  0.946531  0.431675  1
  Cu  Cu120  1  0.251092  0.646523  0.394625  1
  Cu  Cu121  1  0.251110  0.046531  0.505751  1
  Cu  Cu122  1  0.251116  0.646533  0.579828  1
  Cu  Cu123  1  0.251110  0.346531  0.542788  1
  Cu  Cu124  1  0.751100  0.046531  0.505751  1
  Cu  Cu125  1  0.751094  0.646533  0.579828  1
  Cu  Cu126  1  0.751100  0.346531  0.542788  1
  Cu  Cu127  1  0.751116  0.146533  0.579828  1
  Cu  Cu128  1  0.751110  0.846531  0.542788  1
  Cu  Cu129  1  0.751110  0.546531  0.505751  1
  Cu  Cu130  1  0.251094  0.146533  0.579828  1
  Cu  Cu131  1  0.251100  0.846531  0.542788  1
  Cu  Cu132  1  0.251100  0.546531  0.505751  1
  Cu  Cu133  1  0.251095  0.946534  0.616859  1
  Cu  Cu134  1  0.253320  0.546839  0.691041  1
  Cu  Cu135  1  0.251066  0.246642  0.653995  1
  Cu  Cu136  1  0.751115  0.946534  0.616859  1
  Cu  Cu137  1  0.748890  0.546839  0.691041  1
  Cu  Cu138  1  0.751144  0.246642  0.653995  1
  Cu  Cu139  1  0.753320  0.046839  0.691041  1
  Cu  Cu140  1  0.751066  0.746642  0.653995  1
  Cu  Cu141  1  0.751095  0.446534  0.616859  1
  Cu  Cu142  1  0.248890  0.046839  0.691041  1
  Cu  Cu143  1  0.251144  0.746642  0.653995  1
  Cu  Cu144  1  0.251115  0.446534  0.616859  1
