# generated using pymatgen
data_Al2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.09628900
_cell_length_b   15.80583544
_cell_length_c   50.89115684
_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   4903.71618576
_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  0.638753  0.793379  0.285754  1
  Al  Al2  1  0.634089  0.084730  0.316082  1
  Al  Al3  1  0.650413  0.367729  0.349911  1
  Al  Al4  1  0.351138  0.503779  0.369831  1
  Al  Al5  1  0.375498  0.945260  0.300625  1
  Al  Al6  1  0.356093  0.226326  0.331505  1
  Al  Al7  1  0.670579  0.617161  0.295141  1
  Al  Al8  1  0.677333  0.888213  0.332743  1
  Al  Al9  1  0.647041  0.177706  0.367503  1
  Al  Al10  1  0.317677  0.747908  0.315736  1
  Al  Al11  1  0.338408  0.032169  0.349936  1
  Al  Al12  1  0.358620  0.320230  0.386024  1
  Al  Al13  1  0.134089  0.584730  0.316082  1
  Al  Al14  1  0.150413  0.867729  0.349911  1
  Al  Al15  1  0.138753  0.293379  0.285754  1
  Al  Al16  1  0.856093  0.726326  0.331505  1
  Al  Al17  1  0.851138  0.003779  0.369831  1
  Al  Al18  1  0.875498  0.445260  0.300625  1
  Al  Al19  1  0.147041  0.677706  0.367503  1
  Al  Al20  1  0.170579  0.117161  0.295141  1
  Al  Al21  1  0.177333  0.388213  0.332743  1
  Al  Al22  1  0.838408  0.532169  0.349936  1
  Al  Al23  1  0.858620  0.820230  0.386024  1
  Al  Al24  1  0.817677  0.247908  0.315736  1
  Al  Al25  1  0.653258  0.645643  0.390122  1
  Al  Al26  1  0.653849  0.930247  0.426583  1
  Al  Al27  1  0.653899  0.214565  0.463786  1
  Al  Al28  1  0.350680  0.356262  0.482495  1
  Al  Al29  1  0.350830  0.788016  0.408618  1
  Al  Al30  1  0.350698  0.072159  0.444958  1
  Al  Al31  1  0.651052  0.462000  0.405143  1
  Al  Al32  1  0.655425  0.744377  0.442615  1
  Al  Al33  1  0.652793  0.028985  0.479534  1
  Al  Al34  1  0.348623  0.602426  0.424126  1
  Al  Al35  1  0.351049  0.886659  0.460993  1
  Al  Al36  1  0.351152  0.170796  0.498127  1
  Al  Al37  1  0.153849  0.430247  0.426583  1
  Al  Al38  1  0.153899  0.714565  0.463786  1
  Al  Al39  1  0.153258  0.145643  0.390122  1
  Al  Al40  1  0.850698  0.572159  0.444958  1
  Al  Al41  1  0.850680  0.856262  0.482495  1
  Al  Al42  1  0.850830  0.288016  0.408618  1
  Al  Al43  1  0.152793  0.528985  0.479534  1
  Al  Al44  1  0.151052  0.962000  0.405143  1
  Al  Al45  1  0.155425  0.244377  0.442615  1
  Al  Al46  1  0.851049  0.386659  0.460993  1
  Al  Al47  1  0.851152  0.670796  0.498127  1
  Al  Al48  1  0.848623  0.102426  0.424126  1
  Al  Al49  1  0.653313  0.498244  0.501175  1
  Al  Al50  1  0.653416  0.782381  0.538308  1
  Al  Al51  1  0.655842  0.066614  0.575176  1
  Al  Al52  1  0.353413  0.207040  0.594159  1
  Al  Al53  1  0.351672  0.640055  0.519768  1
  Al  Al54  1  0.349040  0.924663  0.556687  1
  Al  Al55  1  0.653785  0.312778  0.516807  1
  Al  Al56  1  0.653767  0.596881  0.554344  1
  Al  Al57  1  0.653635  0.881024  0.590684  1
  Al  Al58  1  0.350566  0.454475  0.535516  1
  Al  Al59  1  0.350616  0.738793  0.572719  1
  Al  Al60  1  0.351207  0.023397  0.609180  1
  Al  Al61  1  0.153416  0.282381  0.538308  1
  Al  Al62  1  0.155842  0.566614  0.575176  1
  Al  Al63  1  0.153313  0.998244  0.501175  1
  Al  Al64  1  0.849040  0.424663  0.556687  1
  Al  Al65  1  0.853413  0.707040  0.594159  1
  Al  Al66  1  0.851672  0.140055  0.519768  1
  Al  Al67  1  0.153635  0.381024  0.590684  1
  Al  Al68  1  0.153785  0.812778  0.516807  1
  Al  Al69  1  0.153767  0.096881  0.554344  1
  Al  Al70  1  0.850616  0.238793  0.572719  1
  Al  Al71  1  0.851207  0.523397  0.609180  1
  Al  Al72  1  0.850566  0.954475  0.535516  1
  Al  Al73  1  0.645845  0.348810  0.613278  1
  Al  Al74  1  0.666057  0.636871  0.649366  1
  Al  Al75  1  0.686788  0.921133  0.683566  1
  Al  Al76  1  0.333886  0.051880  0.704161  1
  Al  Al77  1  0.357424  0.491334  0.631799  1
  Al  Al78  1  0.327132  0.780827  0.666559  1
  Al  Al79  1  0.653327  0.165261  0.629471  1
  Al  Al80  1  0.648372  0.442714  0.667796  1
  Al  Al81  1  0.628967  0.723780  0.698676  1
  Al  Al82  1  0.354052  0.301311  0.649391  1
  Al  Al83  1  0.370376  0.584310  0.683220  1
  Al  Al84  1  0.365711  0.875661  0.713547  1
  Al  Al85  1  0.166057  0.136871  0.649366  1
  Al  Al86  1  0.186788  0.421133  0.683566  1
  Al  Al87  1  0.145845  0.848810  0.613278  1
  Al  Al88  1  0.827132  0.280827  0.666559  1
  Al  Al89  1  0.833886  0.551880  0.704161  1
  Al  Al90  1  0.857424  0.991334  0.631799  1
  Al  Al91  1  0.128967  0.223780  0.698676  1
  Al  Al92  1  0.153327  0.665261  0.629471  1
  Al  Al93  1  0.148372  0.942714  0.667796  1
  Al  Al94  1  0.870376  0.084310  0.683220  1
  Al  Al95  1  0.865711  0.375661  0.713547  1
  Al  Al96  1  0.854052  0.801311  0.649391  1
  Cu  Cu97  1  0.505247  0.768544  0.361011  1
  Cu  Cu98  1  0.516164  0.201318  0.281938  1
  Cu  Cu99  1  0.488561  0.490261  0.319264  1
  Cu  Cu100  1  0.503877  0.627559  0.341918  1
  Cu  Cu101  1  0.495787  0.910542  0.378961  1
  Cu  Cu102  1  0.517104  0.350091  0.298959  1
  Cu  Cu103  1  0.016164  0.701318  0.281938  1
  Cu  Cu104  1  0.988561  0.990261  0.319264  1
  Cu  Cu105  1  0.005247  0.268544  0.361011  1
  Cu  Cu106  1  0.017104  0.850091  0.298959  1
  Cu  Cu107  1  0.003877  0.127559  0.341918  1
  Cu  Cu108  1  0.995787  0.410542  0.378961  1
  Cu  Cu109  1  0.505092  0.621394  0.471816  1
  Cu  Cu110  1  0.508024  0.053344  0.396980  1
  Cu  Cu111  1  0.503973  0.337799  0.434469  1
  Cu  Cu112  1  0.499922  0.479388  0.453276  1
  Cu  Cu113  1  0.499539  0.763432  0.490400  1
  Cu  Cu114  1  0.499793  0.195696  0.415777  1
  Cu  Cu115  1  0.008024  0.553344  0.396980  1
  Cu  Cu116  1  0.003973  0.837799  0.434469  1
  Cu  Cu117  1  0.005092  0.121394  0.471816  1
  Cu  Cu118  1  0.999793  0.695696  0.415777  1
  Cu  Cu119  1  0.999922  0.979388  0.453276  1
  Cu  Cu120  1  0.999539  0.263432  0.490400  1
  Cu  Cu121  1  0.504672  0.473345  0.583524  1
  Cu  Cu122  1  0.504926  0.905608  0.508901  1
  Cu  Cu123  1  0.504543  0.189652  0.546025  1
  Cu  Cu124  1  0.500492  0.331241  0.564833  1
  Cu  Cu125  1  0.496441  0.615696  0.602322  1
  Cu  Cu126  1  0.499373  0.047646  0.527486  1
  Cu  Cu127  1  0.004926  0.405608  0.508901  1
  Cu  Cu128  1  0.004543  0.689652  0.546025  1
  Cu  Cu129  1  0.004672  0.973345  0.583524  1
  Cu  Cu130  1  0.999373  0.547646  0.527486  1
  Cu  Cu131  1  1.000492  0.831241  0.564833  1
  Cu  Cu132  1  0.996441  0.115696  0.602322  1
  Cu  Cu133  1  0.487361  0.318949  0.700342  1
  Cu  Cu134  1  0.508678  0.758498  0.620340  1
  Cu  Cu135  1  0.500588  0.041481  0.657384  1
  Cu  Cu136  1  0.515904  0.178779  0.680038  1
  Cu  Cu137  1  0.488301  0.467723  0.717364  1
  Cu  Cu138  1  0.499218  0.900497  0.638291  1
  Cu  Cu139  1  0.008678  0.258498  0.620340  1
  Cu  Cu140  1  1.000588  0.541481  0.657384  1
  Cu  Cu141  1  0.987361  0.818949  0.700342  1
  Cu  Cu142  1  0.999218  0.400497  0.638291  1
  Cu  Cu143  1  0.015904  0.678779  0.680038  1
  Cu  Cu144  1  0.988301  0.967723  0.717364  1
