# generated using pymatgen
data_AlCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.72673740
_cell_length_b   14.35047937
_cell_length_c   49.44352585
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   65.62720134
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCu
_chemical_formula_sum   'Al120 Cu120'
_cell_volume   8225.34151904
_cell_formula_units_Z   120
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  0.280864  0.063028  0.288476  1
  Al  Al2  1  0.331059  0.515759  0.311511  1
  Al  Al3  1  0.022004  0.366987  0.329795  1
  Al  Al4  1  0.178510  0.773805  0.328370  1
  Al  Al5  1  0.481303  0.917382  0.306608  1
  Al  Al6  1  0.525635  0.336770  0.389349  1
  Al  Al7  1  0.720500  0.262341  0.301274  1
  Al  Al8  1  0.969079  0.740989  0.327863  1
  Al  Al9  1  0.587644  0.028336  0.287529  1
  Al  Al10  1  0.575849  0.481598  0.366047  1
  Al  Al11  1  0.780864  0.063029  0.288475  1
  Al  Al12  1  0.831057  0.515760  0.311511  1
  Al  Al13  1  0.522007  0.366990  0.329794  1
  Al  Al14  1  0.678508  0.773805  0.328370  1
  Al  Al15  1  0.981307  0.917382  0.306607  1
  Al  Al16  1  0.025641  0.336779  0.389351  1
  Al  Al17  1  0.220502  0.262339  0.301274  1
  Al  Al18  1  0.469085  0.740993  0.327862  1
  Al  Al19  1  0.087646  0.028338  0.287528  1
  Al  Al20  1  0.075849  0.481590  0.366046  1
  Al  Al21  1  0.422475  0.084042  0.374459  1
  Al  Al22  1  0.419811  0.564567  0.404363  1
  Al  Al23  1  0.222537  0.231215  0.353751  1
  Al  Al24  1  0.207767  0.721838  0.383709  1
  Al  Al25  1  0.498180  0.873595  0.361431  1
  Al  Al26  1  0.728130  0.193911  0.408558  1
  Al  Al27  1  0.134158  0.101765  0.375066  1
  Al  Al28  1  0.166807  0.564150  0.402727  1
  Al  Al29  1  0.792938  0.848916  0.361824  1
  Al  Al30  1  0.784998  0.344703  0.389436  1
  Al  Al31  1  0.922468  0.084038  0.374463  1
  Al  Al32  1  0.919807  0.564575  0.404365  1
  Al  Al33  1  0.722533  0.231215  0.353754  1
  Al  Al34  1  0.707789  0.721821  0.383707  1
  Al  Al35  1  0.998189  0.873597  0.361438  1
  Al  Al36  1  0.228131  0.193927  0.408556  1
  Al  Al37  1  0.634161  0.101769  0.375067  1
  Al  Al38  1  0.666806  0.564150  0.402725  1
  Al  Al39  1  0.292931  0.848920  0.361822  1
  Al  Al40  1  0.285010  0.344701  0.389438  1
  Al  Al41  1  0.612811  0.888893  0.447838  1
  Al  Al42  1  0.728955  0.160352  0.460914  1
  Al  Al43  1  0.428605  0.048894  0.430953  1
  Al  Al44  1  0.465923  0.502034  0.460870  1
  Al  Al45  1  0.747152  0.662760  0.438064  1
  Al  Al46  1  0.903461  0.026212  0.486681  1
  Al  Al47  1  0.170746  0.037342  0.430611  1
  Al  Al48  1  0.365577  0.377245  0.482455  1
  Al  Al49  1  0.988610  0.674256  0.439189  1
  Al  Al50  1  0.012593  0.152719  0.468404  1
  Al  Al51  1  0.112825  0.888895  0.447841  1
  Al  Al52  1  0.228990  0.160251  0.460936  1
  Al  Al53  1  0.928602  0.048905  0.430944  1
  Al  Al54  1  0.965934  0.502019  0.460866  1
  Al  Al55  1  0.247161  0.662759  0.438062  1
  Al  Al56  1  0.403368  0.026258  0.486676  1
  Al  Al57  1  0.670742  0.037359  0.430604  1
  Al  Al58  1  0.865642  0.377253  0.482454  1
  Al  Al59  1  0.488599  0.674237  0.439189  1
  Al  Al60  1  0.512570  0.152728  0.468399  1
  Al  Al61  1  0.793795  0.585854  0.494707  1
  Al  Al62  1  0.861257  0.079944  0.539443  1
  Al  Al63  1  0.602720  0.892799  0.501244  1
  Al  Al64  1  0.704765  0.307885  0.542263  1
  Al  Al65  1  1.002300  0.417394  0.568965  1
  Al  Al66  1  0.030084  0.871009  0.549300  1
  Al  Al67  1  0.418656  0.836831  0.505094  1
  Al  Al68  1  0.455573  0.262457  0.539188  1
  Al  Al69  1  0.155477  0.484233  0.510152  1
  Al  Al70  1  0.242998  0.951064  0.535046  1
  Al  Al71  1  0.293824  0.585837  0.494705  1
  Al  Al72  1  0.361273  0.079933  0.539433  1
  Al  Al73  1  0.102708  0.892774  0.501237  1
  Al  Al74  1  0.204759  0.307864  0.542252  1
  Al  Al75  1  0.502351  0.417324  0.568966  1
  Al  Al76  1  0.529990  0.871022  0.549290  1
  Al  Al77  1  0.918633  0.836822  0.505091  1
  Al  Al78  1  0.955535  0.262487  0.539191  1
  Al  Al79  1  0.655471  0.484193  0.510145  1
  Al  Al80  1  0.742982  0.951057  0.535051  1
  Al  Al81  1  0.945744  0.605083  0.593055  1
  Al  Al82  1  0.042350  0.909607  0.605514  1
  Al  Al83  1  0.771285  0.747621  0.522662  1
  Al  Al84  1  0.866691  0.109552  0.595244  1
  Al  Al85  1  0.163376  0.268773  0.598263  1
  Al  Al86  1  0.244870  0.710947  0.620782  1
  Al  Al87  1  0.589611  0.712712  0.586042  1
  Al  Al88  1  0.665937  0.045795  0.610935  1
  Al  Al89  1  0.311915  0.365417  0.579078  1
  Al  Al90  1  0.393092  0.796661  0.611480  1
  Al  Al91  1  0.445695  0.605085  0.593052  1
  Al  Al92  1  0.542333  0.909628  0.605527  1
  Al  Al93  1  0.271287  0.747569  0.522665  1
  Al  Al94  1  0.366747  0.109481  0.595233  1
  Al  Al95  1  0.663382  0.268773  0.598264  1
  Al  Al96  1  0.744859  0.710940  0.620767  1
  Al  Al97  1  0.089559  0.712786  0.586056  1
  Al  Al98  1  0.165794  0.045865  0.610940  1
  Al  Al99  1  0.811973  0.365368  0.579071  1
  Al  Al100  1  0.893315  0.796554  0.611465  1
  Al  Al101  1  0.127232  0.367524  0.655032  1
  Al  Al102  1  0.080623  0.921435  0.687504  1
  Al  Al103  1  0.930593  0.545350  0.646441  1
  Al  Al104  1  0.992775  0.052752  0.645911  1
  Al  Al105  1  0.260212  0.159563  0.643498  1
  Al  Al106  1  0.222218  0.671029  0.671332  1
  Al  Al107  1  0.759230  0.475400  0.653289  1
  Al  Al108  1  0.859830  0.070604  0.691883  1
  Al  Al109  1  0.535739  0.215702  0.645895  1
  Al  Al110  1  0.372808  0.884323  0.686497  1
  Al  Al111  1  0.627216  0.367464  0.655037  1
  Al  Al112  1  0.580626  0.921461  0.687502  1
  Al  Al113  1  0.430555  0.545335  0.646439  1
  Al  Al114  1  0.492870  0.052746  0.645914  1
  Al  Al115  1  0.760245  0.159600  0.643514  1
  Al  Al116  1  0.722127  0.671059  0.671353  1
  Al  Al117  1  0.259196  0.475427  0.653287  1
  Al  Al118  1  0.359890  0.070569  0.691897  1
  Al  Al119  1  0.035749  0.215764  0.645890  1
  Al  Al120  1  0.872828  0.884326  0.686506  1
  Cu  Cu121  1  0.777527  0.888173  0.307803  1
  Cu  Cu122  1  0.749968  0.394927  0.333917  1
  Cu  Cu123  1  0.603606  0.983745  0.339693  1
  Cu  Cu124  1  0.546607  0.539828  0.315053  1
  Cu  Cu125  1  0.105080  0.155469  0.322512  1
  Cu  Cu126  1  0.945768  0.786158  0.276787  1
  Cu  Cu127  1  0.301415  0.018552  0.340751  1
  Cu  Cu128  1  0.138554  0.655096  0.294515  1
  Cu  Cu129  1  0.412588  0.121503  0.321551  1
  Cu  Cu130  1  0.347739  0.680960  0.296239  1
  Cu  Cu131  1  0.277532  0.888171  0.307802  1
  Cu  Cu132  1  0.249971  0.394925  0.333917  1
  Cu  Cu133  1  0.103603  0.983743  0.339695  1
  Cu  Cu134  1  0.046605  0.539827  0.315053  1
  Cu  Cu135  1  0.605085  0.155466  0.322512  1
  Cu  Cu136  1  0.445767  0.786156  0.276788  1
  Cu  Cu137  1  0.801417  0.018550  0.340748  1
  Cu  Cu138  1  0.638551  0.655096  0.294515  1
  Cu  Cu139  1  0.912590  0.121505  0.321551  1
  Cu  Cu140  1  0.847737  0.680957  0.296239  1
  Cu  Cu141  1  0.980352  0.699611  0.380793  1
  Cu  Cu142  1  0.936883  0.250080  0.353760  1
  Cu  Cu143  1  0.806617  0.811116  0.416069  1
  Cu  Cu144  1  0.625370  0.415215  0.424931  1
  Cu  Cu145  1  0.334455  0.965465  0.396769  1
  Cu  Cu146  1  0.163163  0.605595  0.347304  1
  Cu  Cu147  1  0.521959  0.815222  0.412773  1
  Cu  Cu148  1  0.347506  0.474815  0.366241  1
  Cu  Cu149  1  0.613323  0.935790  0.394550  1
  Cu  Cu150  1  0.373380  0.627615  0.348541  1
  Cu  Cu151  1  0.480359  0.699591  0.380789  1
  Cu  Cu152  1  0.436881  0.250078  0.353763  1
  Cu  Cu153  1  0.306622  0.811111  0.416075  1
  Cu  Cu154  1  0.125361  0.415217  0.424928  1
  Cu  Cu155  1  0.834477  0.965453  0.396769  1
  Cu  Cu156  1  0.663157  0.605601  0.347305  1
  Cu  Cu157  1  0.021959  0.815205  0.412766  1
  Cu  Cu158  1  0.847513  0.474814  0.366240  1
  Cu  Cu159  1  0.113324  0.935782  0.394554  1
  Cu  Cu160  1  0.873375  0.627615  0.348541  1
  Cu  Cu161  1  0.173432  0.525272  0.459193  1
  Cu  Cu162  1  0.978186  0.193564  0.410393  1
  Cu  Cu163  1  0.979292  0.642339  0.491690  1
  Cu  Cu164  1  0.822791  0.280204  0.442937  1
  Cu  Cu165  1  0.388898  0.891724  0.451570  1
  Cu  Cu166  1  0.347586  0.437590  0.427545  1
  Cu  Cu167  1  0.600585  0.733065  0.476119  1
  Cu  Cu168  1  0.533760  0.301782  0.443299  1
  Cu  Cu169  1  0.800336  0.776607  0.471047  1
  Cu  Cu170  1  0.659783  0.349794  0.475551  1
  Cu  Cu171  1  0.673393  0.525296  0.459180  1
  Cu  Cu172  1  0.478143  0.193594  0.410400  1
  Cu  Cu173  1  0.479328  0.642366  0.491693  1
  Cu  Cu174  1  0.322822  0.280201  0.442937  1
  Cu  Cu175  1  0.888907  0.891707  0.451571  1
  Cu  Cu176  1  0.847597  0.437571  0.427548  1
  Cu  Cu177  1  0.100576  0.733106  0.476112  1
  Cu  Cu178  1  0.033704  0.301801  0.443298  1
  Cu  Cu179  1  0.300318  0.776610  0.471047  1
  Cu  Cu180  1  0.159796  0.349765  0.475551  1
  Cu  Cu181  1  0.327449  0.468923  0.537128  1
  Cu  Cu182  1  0.215236  0.992059  0.482545  1
  Cu  Cu183  1  0.137550  0.531950  0.563325  1
  Cu  Cu184  1  0.045204  0.082013  0.517725  1
  Cu  Cu185  1  0.605468  0.676087  0.528051  1
  Cu  Cu186  1  0.515836  0.395852  0.512741  1
  Cu  Cu187  1  0.775849  0.633897  0.561842  1
  Cu  Cu188  1  0.649778  0.191667  0.508811  1
  Cu  Cu189  1  0.957630  0.573748  0.535799  1
  Cu  Cu190  1  0.834514  0.221397  0.500638  1
  Cu  Cu191  1  0.827515  0.468885  0.537131  1
  Cu  Cu192  1  0.715177  0.992021  0.482558  1
  Cu  Cu193  1  0.637623  0.531991  0.563321  1
  Cu  Cu194  1  0.545212  0.081983  0.517715  1
  Cu  Cu195  1  0.105478  0.676090  0.528053  1
  Cu  Cu196  1  0.015866  0.395851  0.512732  1
  Cu  Cu197  1  0.275955  0.633880  0.561826  1
  Cu  Cu198  1  0.149805  0.191682  0.508810  1
  Cu  Cu199  1  0.457482  0.573842  0.535805  1
  Cu  Cu200  1  0.334510  0.221415  0.500644  1
  Cu  Cu201  1  0.494890  0.210136  0.592660  1
  Cu  Cu202  1  0.418072  0.752904  0.555564  1
  Cu  Cu203  1  0.326304  0.297938  0.626933  1
  Cu  Cu204  1  0.223639  0.831626  0.575965  1
  Cu  Cu205  1  0.776605  0.533244  0.603401  1
  Cu  Cu206  1  0.663475  0.140615  0.560106  1
  Cu  Cu207  1  0.958084  0.386830  0.619022  1
  Cu  Cu208  1  0.840521  0.948895  0.579496  1
  Cu  Cu209  1  0.128269  0.457051  0.610427  1
  Cu  Cu210  1  0.059758  0.029528  0.567092  1
  Cu  Cu211  1  0.994863  0.210104  0.592676  1
  Cu  Cu212  1  0.918039  0.752935  0.555556  1
  Cu  Cu213  1  0.826245  0.297921  0.626921  1
  Cu  Cu214  1  0.723634  0.831650  0.575962  1
  Cu  Cu215  1  0.276578  0.533263  0.603403  1
  Cu  Cu216  1  0.163481  0.140602  0.560092  1
  Cu  Cu217  1  0.458167  0.386791  0.619031  1
  Cu  Cu218  1  0.340621  0.948824  0.579491  1
  Cu  Cu219  1  0.628220  0.457077  0.610427  1
  Cu  Cu220  1  0.559736  0.029533  0.567109  1
  Cu  Cu221  1  0.688017  0.038563  0.669436  1
  Cu  Cu222  1  0.582993  0.630390  0.633259  1
  Cu  Cu223  1  0.516406  0.139705  0.695419  1
  Cu  Cu224  1  0.392732  0.729677  0.659697  1
  Cu  Cu225  1  0.947269  0.368743  0.677957  1
  Cu  Cu226  1  0.858108  0.960930  0.637466  1
  Cu  Cu227  1  0.152676  0.223496  0.690450  1
  Cu  Cu228  1  0.042870  0.811184  0.649579  1
  Cu  Cu229  1  0.331983  0.263542  0.676764  1
  Cu  Cu230  1  0.206890  0.882094  0.643917  1
  Cu  Cu231  1  0.188021  0.038558  0.669442  1
  Cu  Cu232  1  0.083004  0.630347  0.633264  1
  Cu  Cu233  1  0.016447  0.139686  0.695416  1
  Cu  Cu234  1  0.892803  0.729639  0.659696  1
  Cu  Cu235  1  0.447259  0.368785  0.677962  1
  Cu  Cu236  1  0.358163  0.960922  0.637476  1
  Cu  Cu237  1  0.652723  0.223463  0.690431  1
  Cu  Cu238  1  0.542989  0.811138  0.649575  1
  Cu  Cu239  1  0.831995  0.263528  0.676771  1
  Cu  Cu240  1  0.706776  0.882122  0.643929  1
