# generated using pymatgen
data_AlCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.28210145
_cell_length_b   22.43922948
_cell_length_c   55.14005782
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCu
_chemical_formula_sum   'Al80 Cu80'
_cell_volume   5298.24588192
_cell_formula_units_Z   80
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  0.989913  0.786514  0.390271  1
  Al  Al2  1  0.989913  0.402204  0.293861  1
  Al  Al3  1  0.489913  0.191223  0.311715  1
  Al  Al4  1  0.489913  0.521017  0.352313  1
  Al  Al5  1  0.489913  0.756550  0.316519  1
  Al  Al6  1  0.489913  0.073336  0.371541  1
  Al  Al7  1  0.489913  0.076834  0.321647  1
  Al  Al8  1  0.489913  0.401964  0.368703  1
  Al  Al9  1  0.489913  0.856765  0.343596  1
  Al  Al10  1  0.489913  0.185247  0.361371  1
  Al  Al11  1  0.489913  0.902204  0.293861  1
  Al  Al12  1  0.489913  0.286514  0.390271  1
  Al  Al13  1  0.989913  0.021017  0.352313  1
  Al  Al14  1  0.989913  0.691223  0.311715  1
  Al  Al15  1  0.989913  0.573336  0.371541  1
  Al  Al16  1  0.989913  0.256550  0.316519  1
  Al  Al17  1  0.989913  0.901964  0.368703  1
  Al  Al18  1  0.989913  0.576834  0.321647  1
  Al  Al19  1  0.989913  0.685247  0.361371  1
  Al  Al20  1  0.989913  0.356765  0.343596  1
  Al  Al21  1  0.989913  0.331620  0.486344  1
  Al  Al22  1  0.989913  1.014208  0.400887  1
  Al  Al23  1  0.489913  0.736858  0.413568  1
  Al  Al24  1  0.489913  0.056396  0.464235  1
  Al  Al25  1  0.489913  0.280516  0.439010  1
  Al  Al26  1  0.489913  0.615629  0.483343  1
  Al  Al27  1  0.489913  0.617615  0.434459  1
  Al  Al28  1  0.489913  0.944547  0.474908  1
  Al  Al29  1  0.489913  0.397067  0.416176  1
  Al  Al30  1  0.489913  0.728073  0.462433  1
  Al  Al31  1  0.489913  0.514208  0.400887  1
  Al  Al32  1  0.489913  0.831620  0.486344  1
  Al  Al33  1  0.989913  0.556396  0.464235  1
  Al  Al34  1  0.989913  0.236858  0.413568  1
  Al  Al35  1  0.989913  0.115629  0.483343  1
  Al  Al36  1  0.989913  0.780516  0.439010  1
  Al  Al37  1  0.989913  0.444547  0.474908  1
  Al  Al38  1  0.989913  0.117615  0.434459  1
  Al  Al39  1  0.989913  0.228073  0.462433  1
  Al  Al40  1  0.989913  0.897067  0.416176  1
  Al  Al41  1  0.989913  0.861411  0.602778  1
  Al  Al42  1  0.989913  0.556339  0.512754  1
  Al  Al43  1  0.489913  0.381698  0.509388  1
  Al  Al44  1  0.489913  0.601055  0.577459  1
  Al  Al45  1  0.489913  0.828665  0.535225  1
  Al  Al46  1  0.489913  0.037034  0.604477  1
  Al  Al47  1  0.489913  0.151660  0.554125  1
  Al  Al48  1  0.489913  0.478083  0.586308  1
  Al  Al49  1  0.489913  0.943788  0.524110  1
  Al  Al50  1  0.489913  0.262166  0.534208  1
  Al  Al51  1  0.489913  0.056339  0.512754  1
  Al  Al52  1  0.489913  0.361411  0.602778  1
  Al  Al53  1  0.989913  0.101055  0.577459  1
  Al  Al54  1  0.989913  0.881698  0.509388  1
  Al  Al55  1  0.989913  0.537034  0.604477  1
  Al  Al56  1  0.989913  0.328665  0.535225  1
  Al  Al57  1  0.989913  0.978083  0.586308  1
  Al  Al58  1  0.989913  0.651660  0.554125  1
  Al  Al59  1  0.989913  0.762166  0.534208  1
  Al  Al60  1  0.989913  0.443788  0.524110  1
  Al  Al61  1  0.989913  0.414594  0.707666  1
  Al  Al62  1  0.989913  0.094673  0.626124  1
  Al  Al63  1  0.489913  0.813210  0.628053  1
  Al  Al64  1  0.489913  0.135025  0.657675  1
  Al  Al65  1  0.489913  0.355061  0.652293  1
  Al  Al66  1  0.489913  0.674932  0.691974  1
  Al  Al67  1  0.489913  0.703265  0.647534  1
  Al  Al68  1  0.489913  0.027650  0.695415  1
  Al  Al69  1  0.489913  0.470921  0.635312  1
  Al  Al70  1  0.489913  0.806254  0.679162  1
  Al  Al71  1  0.489913  0.594673  0.626124  1
  Al  Al72  1  0.489913  0.914594  0.707666  1
  Al  Al73  1  0.989913  0.635025  0.657675  1
  Al  Al74  1  0.989913  0.313210  0.628053  1
  Al  Al75  1  0.989913  0.174932  0.691974  1
  Al  Al76  1  0.989913  0.855061  0.652293  1
  Al  Al77  1  0.989913  0.527650  0.695415  1
  Al  Al78  1  0.989913  0.203265  0.647534  1
  Al  Al79  1  0.989913  0.306254  0.679162  1
  Al  Al80  1  0.989913  0.970921  0.635312  1
  Cu  Cu81  1  0.989913  0.816108  0.299666  1
  Cu  Cu82  1  0.989913  0.139906  0.341440  1
  Cu  Cu83  1  0.989913  0.792543  0.343204  1
  Cu  Cu84  1  0.989913  0.134355  0.387170  1
  Cu  Cu85  1  0.989913  0.125744  0.297880  1
  Cu  Cu86  1  0.989913  0.468650  0.335751  1
  Cu  Cu87  1  0.489913  0.748748  0.365279  1
  Cu  Cu88  1  0.489913  0.410305  0.323302  1
  Cu  Cu89  1  0.489913  0.851230  0.392824  1
  Cu  Cu90  1  0.489913  0.512558  0.306314  1
  Cu  Cu91  1  0.489913  0.639906  0.341440  1
  Cu  Cu92  1  0.489913  0.316108  0.299666  1
  Cu  Cu93  1  0.489913  0.634355  0.387170  1
  Cu  Cu94  1  0.489913  0.292543  0.343204  1
  Cu  Cu95  1  0.489913  0.968650  0.335751  1
  Cu  Cu96  1  0.489913  0.625744  0.297880  1
  Cu  Cu97  1  0.989913  0.910305  0.323302  1
  Cu  Cu98  1  0.989913  0.248748  0.365279  1
  Cu  Cu99  1  0.989913  1.012558  0.306314  1
  Cu  Cu100  1  0.989913  0.351230  0.392824  1
  Cu  Cu101  1  0.989913  0.460573  0.382139  1
  Cu  Cu102  1  0.989913  0.668044  0.456223  1
  Cu  Cu103  1  0.989913  0.347103  0.439177  1
  Cu  Cu104  1  0.989913  0.666073  0.504013  1
  Cu  Cu105  1  0.989913  0.672061  0.409463  1
  Cu  Cu106  1  0.989913  0.997574  0.448058  1
  Cu  Cu107  1  0.489913  0.268574  0.486590  1
  Cu  Cu108  1  0.489913  0.956565  0.427972  1
  Cu  Cu109  1  0.489913  0.384539  0.462493  1
  Cu  Cu110  1  0.489913  0.064108  0.418021  1
  Cu  Cu111  1  0.489913  0.168044  0.456223  1
  Cu  Cu112  1  0.489913  0.960573  0.382139  1
  Cu  Cu113  1  0.489913  0.166073  0.504013  1
  Cu  Cu114  1  0.489913  0.847103  0.439177  1
  Cu  Cu115  1  0.489913  0.497574  0.448058  1
  Cu  Cu116  1  0.489913  0.172061  0.409463  1
  Cu  Cu117  1  0.989913  0.456565  0.427972  1
  Cu  Cu118  1  0.989913  0.768574  0.486590  1
  Cu  Cu119  1  0.989913  0.564108  0.418021  1
  Cu  Cu120  1  0.989913  0.884539  0.462493  1
  Cu  Cu121  1  0.989913  0.997822  0.494200  1
  Cu  Cu122  1  0.989913  0.216916  0.556320  1
  Cu  Cu123  1  0.989913  0.875870  0.556554  1
  Cu  Cu124  1  0.989913  0.210571  0.601032  1
  Cu  Cu125  1  0.989913  0.222343  0.510014  1
  Cu  Cu126  1  0.989913  0.536346  0.558693  1
  Cu  Cu127  1  0.489913  0.816476  0.580846  1
  Cu  Cu128  1  0.489913  0.497703  0.540124  1
  Cu  Cu129  1  0.489913  0.925689  0.570113  1
  Cu  Cu130  1  0.489913  0.613800  0.530085  1
  Cu  Cu131  1  0.489913  0.716916  0.556320  1
  Cu  Cu132  1  0.489913  0.497822  0.494200  1
  Cu  Cu133  1  0.489913  0.710571  0.601032  1
  Cu  Cu134  1  0.489913  0.375870  0.556554  1
  Cu  Cu135  1  0.489913  0.036346  0.558693  1
  Cu  Cu136  1  0.489913  0.722343  0.510014  1
  Cu  Cu137  1  0.989913  0.997703  0.540124  1
  Cu  Cu138  1  0.989913  0.316476  0.580846  1
  Cu  Cu139  1  0.989913  0.113800  0.530085  1
  Cu  Cu140  1  0.989913  0.425689  0.570113  1
  Cu  Cu141  1  0.989913  0.424339  0.615414  1
  Cu  Cu142  1  0.989913  0.747579  0.627134  1
  Cu  Cu143  1  0.989913  0.417570  0.661463  1
  Cu  Cu144  1  0.989913  0.743261  0.674649  1
  Cu  Cu145  1  0.989913  0.754262  0.581166  1
  Cu  Cu146  1  0.989913  0.067836  0.671713  1
  Cu  Cu147  1  0.489913  0.350862  0.699237  1
  Cu  Cu148  1  0.489913  0.023738  0.650192  1
  Cu  Cu149  1  0.489913  0.457966  0.682409  1
  Cu  Cu150  1  0.489913  0.151071  0.604540  1
  Cu  Cu151  1  0.489913  0.247579  0.627134  1
  Cu  Cu152  1  0.489913  0.924339  0.615414  1
  Cu  Cu153  1  0.489913  0.243261  0.674649  1
  Cu  Cu154  1  0.489913  0.917570  0.661463  1
  Cu  Cu155  1  0.489913  0.567836  0.671713  1
  Cu  Cu156  1  0.489913  0.254262  0.581166  1
  Cu  Cu157  1  0.989913  0.523738  0.650192  1
  Cu  Cu158  1  0.989913  0.850862  0.699237  1
  Cu  Cu159  1  0.989913  0.651071  0.604540  1
  Cu  Cu160  1  0.989913  0.957966  0.682409  1
