# generated using pymatgen
data_AlCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.27575326
_cell_length_b   21.44365834
_cell_length_c   51.21894021
_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   4696.15154225
_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  -0.009360  0.550062  0.364096  1
  Al  Al2  1  -0.009360  0.998924  0.336966  1
  Al  Al3  1  0.490640  0.440697  0.354145  1
  Al  Al4  1  0.490640  0.887268  0.273530  1
  Al  Al5  1  0.490640  0.633982  0.369067  1
  Al  Al6  1  0.490640  0.078405  0.337161  1
  Al  Al7  1  0.490640  0.226278  0.306064  1
  Al  Al8  1  0.490640  0.861697  0.325718  1
  Al  Al9  1  0.490640  0.743779  0.346193  1
  Al  Al10  1  0.490640  0.269244  0.401694  1
  Al  Al11  1  0.490640  0.759725  0.292689  1
  Al  Al12  1  0.490640  0.317688  0.353440  1
  Al  Al13  1  0.990640  0.764584  0.377585  1
  Al  Al14  1  0.990640  0.152699  0.327081  1
  Al  Al15  1  0.990640  0.392158  0.332718  1
  Al  Al16  1  0.990640  0.810322  0.270728  1
  Al  Al17  1  0.990640  0.559678  0.308824  1
  Al  Al18  1  0.990640  0.096298  0.372334  1
  Al  Al19  1  0.990640  0.418801  0.283762  1
  Al  Al20  1  -0.009360  0.974600  0.387585  1
  Al  Al21  1  -0.009360  0.630617  0.449354  1
  Al  Al22  1  -0.009360  0.119725  0.424495  1
  Al  Al23  1  0.490640  0.515861  0.507245  1
  Al  Al24  1  0.490640  0.057004  0.444565  1
  Al  Al25  1  0.490640  0.778276  0.492684  1
  Al  Al26  1  0.490640  0.189671  0.448933  1
  Al  Al27  1  0.490640  0.389225  0.402579  1
  Al  Al28  1  0.490640  0.932794  0.458575  1
  Al  Al29  1  0.490640  0.816894  0.441201  1
  Al  Al30  1  0.490640  0.393323  0.495409  1
  Al  Al31  1  0.490640  0.841327  0.382444  1
  Al  Al32  1  0.490640  0.452160  0.446111  1
  Al  Al33  1  0.990640  0.800923  0.523648  1
  Al  Al34  1  0.990640  0.261020  0.431589  1
  Al  Al35  1  0.990640  0.468354  0.477429  1
  Al  Al36  1  0.990640  0.866841  0.416666  1
  Al  Al37  1  -0.009360  0.649716  0.398236  1
  Al  Al38  1  -0.009360  0.215357  0.479837  1
  Al  Al39  1  -0.009360  0.521295  0.426333  1
  Al  Al40  1  0.990640  0.086719  0.476235  1
  Al  Al41  1  -0.009360  0.802107  0.620388  1
  Al  Al42  1  0.990640  0.167928  0.527255  1
  Al  Al43  1  0.490640  0.678332  0.590866  1
  Al  Al44  1  0.490640  0.101034  0.545463  1
  Al  Al45  1  0.490640  0.867490  0.636405  1
  Al  Al46  1  0.490640  0.344145  0.543774  1
  Al  Al47  1  0.490640  0.465272  0.552725  1
  Al  Al48  1  0.490640  0.049281  0.592143  1
  Al  Al49  1  0.490640  0.925330  0.588609  1
  Al  Al50  1  0.490640  0.490906  0.639659  1
  Al  Al51  1  0.490640  0.896531  0.504995  1
  Al  Al52  1  0.490640  0.547649  0.593052  1
  Al  Al53  1  0.990640  0.935265  0.619671  1
  Al  Al54  1  -0.009360  0.367105  0.574139  1
  Al  Al55  1  0.990640  0.612316  0.576618  1
  Al  Al56  1  -0.009360  0.041643  0.526173  1
  Al  Al57  1  0.990640  0.743247  0.571894  1
  Al  Al58  1  0.990640  0.308709  0.621789  1
  Al  Al59  1  0.990640  0.667413  0.528672  1
  Al  Al60  1  0.990640  0.240781  0.572277  1
  Al  Al61  1  -0.009360  0.816040  0.714305  1
  Al  Al62  1  0.990640  0.364623  0.671310  1
  Al  Al63  1  0.490640  0.752986  0.732242  1
  Al  Al64  1  0.490640  0.242275  0.639899  1
  Al  Al65  1  0.490640  0.992193  0.734101  1
  Al  Al66  1  0.490640  0.429350  0.687898  1
  Al  Al67  1  0.490640  0.619825  0.639248  1
  Al  Al68  1  0.490640  0.177316  0.686744  1
  Al  Al69  1  0.490640  0.051908  0.686332  1
  Al  Al70  1  0.490640  0.622400  0.734519  1
  Al  Al71  1  0.490640  0.114740  0.638631  1
  Al  Al72  1  0.490640  0.563303  0.687077  1
  Al  Al73  1  0.990640  0.063640  0.717625  1
  Al  Al74  1  0.990640  0.495720  0.671617  1
  Al  Al75  1  -0.009360  0.684253  0.715265  1
  Al  Al76  1  0.990640  0.180772  0.620650  1
  Al  Al77  1  0.990640  0.872880  0.667227  1
  Al  Al78  1  0.990640  0.432298  0.721317  1
  Al  Al79  1  0.990640  0.744609  0.667758  1
  Al  Al80  1  -0.009360  0.303583  0.717761  1
  Cu  Cu81  1  0.990640  0.786866  0.322751  1
  Cu  Cu82  1  0.990640  0.181335  0.280354  1
  Cu  Cu83  1  0.990640  0.665245  0.341365  1
  Cu  Cu84  1  0.990640  0.058713  0.295292  1
  Cu  Cu85  1  0.990640  0.444938  0.386171  1
  Cu  Cu86  1  0.990640  0.907842  0.303847  1
  Cu  Cu87  1  0.490640  0.514535  0.393891  1
  Cu  Cu88  1  0.490640  0.953702  0.358509  1
  Cu  Cu89  1  0.490640  0.548521  0.336287  1
  Cu  Cu90  1  0.490640  0.981148  0.306434  1
  Cu  Cu91  1  0.490640  0.468863  0.302985  1
  Cu  Cu92  1  0.490640  0.043601  0.392065  1
  Cu  Cu93  1  0.490640  0.352144  0.304959  1
  Cu  Cu94  1  0.490640  0.939042  0.411038  1
  Cu  Cu95  1  0.490640  0.646711  0.313405  1
  Cu  Cu96  1  0.490640  0.195252  0.355063  1
  Cu  Cu97  1  -0.009360  0.687813  0.293465  1
  Cu  Cu98  1  0.990640  0.266471  0.337975  1
  Cu  Cu99  1  0.990640  0.296927  0.291759  1
  Cu  Cu100  1  0.990640  0.879235  0.355477  1
  Cu  Cu101  1  0.990640  0.845450  0.471878  1
  Cu  Cu102  1  0.990640  0.330058  0.383221  1
  Cu  Cu103  1  -0.009360  0.718629  0.482084  1
  Cu  Cu104  1  0.990640  0.212197  0.382346  1
  Cu  Cu105  1  -0.009360  0.583542  0.493773  1
  Cu  Cu106  1  0.990640  0.988051  0.437305  1
  Cu  Cu107  1  0.490640  0.651288  0.498253  1
  Cu  Cu108  1  0.490640  0.024560  0.496347  1
  Cu  Cu109  1  0.490640  0.697762  0.453061  1
  Cu  Cu110  1  0.490640  0.152919  0.399642  1
  Cu  Cu111  1  0.490640  0.609030  0.419783  1
  Cu  Cu112  1  0.490640  0.145497  0.497283  1
  Cu  Cu113  1  0.490640  0.565134  0.463235  1
  Cu  Cu114  1  0.490640  0.977903  0.543736  1
  Cu  Cu115  1  0.490640  0.726868  0.404553  1
  Cu  Cu116  1  0.490640  0.322895  0.450522  1
  Cu  Cu117  1  0.990640  0.748140  0.432478  1
  Cu  Cu118  1  0.990640  0.338132  0.477982  1
  Cu  Cu119  1  0.990640  0.385249  0.432385  1
  Cu  Cu120  1  -0.009360  0.961517  0.486377  1
  Cu  Cu121  1  0.990640  0.992856  0.573263  1
  Cu  Cu122  1  0.990640  0.417174  0.525552  1
  Cu  Cu123  1  0.990640  0.863890  0.575504  1
  Cu  Cu124  1  0.990640  0.293062  0.523898  1
  Cu  Cu125  1  0.990640  0.679153  0.622203  1
  Cu  Cu126  1  -0.009360  0.114513  0.575829  1
  Cu  Cu127  1  0.490640  0.741487  0.637841  1
  Cu  Cu128  1  0.490640  0.225196  0.542940  1
  Cu  Cu129  1  0.490640  0.799500  0.591861  1
  Cu  Cu130  1  0.490640  0.270369  0.496706  1
  Cu  Cu131  1  0.490640  0.729085  0.541520  1
  Cu  Cu132  1  0.490640  0.296115  0.592124  1
  Cu  Cu133  1  0.490640  0.602301  0.544722  1
  Cu  Cu134  1  0.490640  0.175485  0.589853  1
  Cu  Cu135  1  0.490640  0.847108  0.548622  1
  Cu  Cu136  1  0.490640  0.415303  0.598019  1
  Cu  Cu137  1  0.990640  0.919381  0.533388  1
  Cu  Cu138  1  -0.009360  0.484298  0.583077  1
  Cu  Cu139  1  0.990640  0.533635  0.537853  1
  Cu  Cu140  1  0.990640  0.056435  0.621324  1
  Cu  Cu141  1  0.990640  0.119270  0.668465  1
  Cu  Cu142  1  -0.009360  0.556107  0.624769  1
  Cu  Cu143  1  0.990640  0.945291  0.707678  1
  Cu  Cu144  1  0.990640  0.429249  0.625921  1
  Cu  Cu145  1  0.990640  0.906653  0.750796  1
  Cu  Cu146  1  -0.009360  0.241250  0.670206  1
  Cu  Cu147  1  0.490640  0.877901  0.724694  1
  Cu  Cu148  1  0.490640  0.301593  0.686507  1
  Cu  Cu149  1  0.490640  0.933052  0.681515  1
  Cu  Cu150  1  0.490640  0.365377  0.641692  1
  Cu  Cu151  1  0.490640  0.807391  0.683023  1
  Cu  Cu152  1  0.490640  0.365000  0.731439  1
  Cu  Cu153  1  0.490640  0.686113  0.684934  1
  Cu  Cu154  1  0.490640  0.240834  0.730047  1
  Cu  Cu155  1  0.490640  0.992622  0.638190  1
  Cu  Cu156  1  0.490640  0.497960  0.731188  1
  Cu  Cu157  1  -0.009360  0.999988  0.665020  1
  Cu  Cu158  1  0.990640  0.558747  0.716839  1
  Cu  Cu159  1  -0.009360  0.622110  0.669386  1
  Cu  Cu160  1  -0.009360  0.183041  0.714724  1
