# generated using pymatgen
data_AlCu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22140601
_cell_length_b   15.60615955
_cell_length_c   48.29978747
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCu3
_chemical_formula_sum   'Al36 Cu108'
_cell_volume   3935.76108624
_cell_formula_units_Z   36
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  0.502250  0.808964  0.291435  1
  Al  Al2  1  0.502250  0.200243  0.317482  1
  Al  Al3  1  0.502250  0.588182  0.344793  1
  Al  Al4  1  0.002250  0.644648  0.292025  1
  Al  Al5  1  0.002250  0.033785  0.319807  1
  Al  Al6  1  0.002250  0.255175  0.269837  1
  Al  Al7  1  0.502250  0.977093  0.370124  1
  Al  Al8  1  0.502250  0.366296  0.395845  1
  Al  Al9  1  0.502250  0.755204  0.421350  1
  Al  Al10  1  1.002250  0.812383  0.370512  1
  Al  Al11  1  1.002250  0.201421  0.396310  1
  Al  Al12  1  1.002250  0.423221  0.344786  1
  Al  Al13  1  0.502250  0.144470  0.447107  1
  Al  Al14  1  0.502250  0.533548  0.472714  1
  Al  Al15  1  0.502250  0.922601  0.498418  1
  Al  Al16  1  1.002250  0.979411  0.447739  1
  Al  Al17  1  1.002250  0.368483  0.473458  1
  Al  Al18  1  0.002250  0.590462  0.422144  1
  Al  Al19  1  0.502250  0.311654  0.524077  1
  Al  Al20  1  0.502250  0.700726  0.549795  1
  Al  Al21  1  0.502250  0.089675  0.575391  1
  Al  Al22  1  0.002250  0.146589  0.524821  1
  Al  Al23  1  0.002250  0.535667  0.550428  1
  Al  Al24  1  1.002250  0.757536  0.499117  1
  Al  Al25  1  0.502250  0.478716  0.601225  1
  Al  Al26  1  0.502250  0.867754  0.627022  1
  Al  Al27  1  0.502250  0.256916  0.652749  1
  Al  Al28  1  1.002250  0.313841  0.601690  1
  Al  Al29  1  0.002250  0.703044  0.627410  1
  Al  Al30  1  0.002250  0.924932  0.576185  1
  Al  Al31  1  0.502250  0.646352  0.677727  1
  Al  Al32  1  0.502250  0.035489  0.705509  1
  Al  Al33  1  0.502250  0.424962  0.727697  1
  Al  Al34  1  0.002250  0.479894  0.680053  1
  Al  Al35  1  0.002250  0.871173  0.706099  1
  Al  Al36  1  0.002250  0.091955  0.652742  1
  Cu  Cu37  1  0.002250  0.814093  0.294534  1
  Cu  Cu38  1  0.002250  0.201829  0.319981  1
  Cu  Cu39  1  1.002250  0.423259  0.271282  1
  Cu  Cu40  1  0.502250  0.642859  0.293784  1
  Cu  Cu41  1  0.502250  0.032240  0.318846  1
  Cu  Cu42  1  0.502250  0.420882  0.344549  1
  Cu  Cu43  1  0.254682  0.893160  0.331398  1
  Cu  Cu44  1  0.251263  0.114214  0.280364  1
  Cu  Cu45  1  0.256058  0.504834  0.306024  1
  Cu  Cu46  1  0.749817  0.893160  0.331398  1
  Cu  Cu47  1  0.753237  0.114214  0.280364  1
  Cu  Cu48  1  0.748442  0.504834  0.306024  1
  Cu  Cu49  1  0.252176  0.728393  0.331758  1
  Cu  Cu50  1  0.252666  0.951607  0.281324  1
  Cu  Cu51  1  0.256550  0.340625  0.306406  1
  Cu  Cu52  1  0.752323  0.728393  0.331758  1
  Cu  Cu53  1  0.751834  0.951607  0.281324  1
  Cu  Cu54  1  0.747949  0.340625  0.306406  1
  Cu  Cu55  1  0.002250  0.979971  0.371106  1
  Cu  Cu56  1  0.002250  0.368798  0.396611  1
  Cu  Cu57  1  1.002250  0.591219  0.344587  1
  Cu  Cu58  1  0.502250  0.809111  0.369631  1
  Cu  Cu59  1  0.502250  0.198923  0.395450  1
  Cu  Cu60  1  0.502250  0.587695  0.420945  1
  Cu  Cu61  1  0.251762  0.061120  0.408609  1
  Cu  Cu62  1  0.252933  0.282840  0.357093  1
  Cu  Cu63  1  0.250510  0.671925  0.382851  1
  Cu  Cu64  1  0.752738  0.061120  0.408609  1
  Cu  Cu65  1  0.751566  0.282840  0.357093  1
  Cu  Cu66  1  0.753990  0.671925  0.382851  1
  Cu  Cu67  1  0.252611  0.895573  0.409164  1
  Cu  Cu68  1  0.254271  0.118286  0.357750  1
  Cu  Cu69  1  0.251160  0.506655  0.383501  1
  Cu  Cu70  1  0.751888  0.895573  0.409164  1
  Cu  Cu71  1  0.750229  0.118286  0.357750  1
  Cu  Cu72  1  0.753339  0.506655  0.383501  1
  Cu  Cu73  1  1.002250  0.147048  0.448088  1
  Cu  Cu74  1  0.002250  0.536116  0.473812  1
  Cu  Cu75  1  1.002250  0.758022  0.422378  1
  Cu  Cu76  1  0.502250  0.976847  0.446697  1
  Cu  Cu77  1  0.502250  0.365899  0.472377  1
  Cu  Cu78  1  0.502250  0.754992  0.498083  1
  Cu  Cu79  1  0.251686  0.228168  0.485664  1
  Cu  Cu80  1  0.251501  0.450036  0.434298  1
  Cu  Cu81  1  0.251839  0.839081  0.459965  1
  Cu  Cu82  1  0.752813  0.228168  0.485664  1
  Cu  Cu83  1  0.752998  0.450036  0.434298  1
  Cu  Cu84  1  0.752660  0.839081  0.459965  1
  Cu  Cu85  1  0.252620  0.062884  0.486203  1
  Cu  Cu86  1  0.252385  0.284747  0.434873  1
  Cu  Cu87  1  0.252783  0.673860  0.460532  1
  Cu  Cu88  1  0.751879  0.062884  0.486203  1
  Cu  Cu89  1  0.752114  0.284747  0.434873  1
  Cu  Cu90  1  0.751717  0.673860  0.460532  1
  Cu  Cu91  1  0.002250  0.314238  0.525157  1
  Cu  Cu92  1  1.002250  0.703290  0.550838  1
  Cu  Cu93  1  1.002250  0.925145  0.499451  1
  Cu  Cu94  1  0.502250  0.144021  0.523722  1
  Cu  Cu95  1  0.502250  0.533089  0.549446  1
  Cu  Cu96  1  0.502250  0.922115  0.575156  1
  Cu  Cu97  1  0.252114  0.395390  0.562661  1
  Cu  Cu98  1  0.251879  0.617252  0.511332  1
  Cu  Cu99  1  0.251717  0.006276  0.537002  1
  Cu  Cu100  1  0.752385  0.395390  0.562661  1
  Cu  Cu101  1  0.752620  0.617252  0.511332  1
  Cu  Cu102  1  0.752783  0.006276  0.537002  1
  Cu  Cu103  1  0.252998  0.230101  0.563236  1
  Cu  Cu104  1  0.252813  0.451969  0.511870  1
  Cu  Cu105  1  0.252660  0.841056  0.537570  1
  Cu  Cu106  1  0.751501  0.230101  0.563236  1
  Cu  Cu107  1  0.751686  0.451969  0.511870  1
  Cu  Cu108  1  0.751839  0.841056  0.537570  1
  Cu  Cu109  1  1.002250  0.481213  0.602085  1
  Cu  Cu110  1  1.002250  0.871025  0.627903  1
  Cu  Cu111  1  1.002250  0.092442  0.576590  1
  Cu  Cu112  1  0.502250  0.311339  0.600924  1
  Cu  Cu113  1  0.502250  0.700166  0.626429  1
  Cu  Cu114  1  0.502250  0.088917  0.652948  1
  Cu  Cu115  1  0.250229  0.561851  0.639785  1
  Cu  Cu116  1  0.251888  0.784564  0.588370  1
  Cu  Cu117  1  0.253339  0.173482  0.614034  1
  Cu  Cu118  1  0.754271  0.561851  0.639785  1
  Cu  Cu119  1  0.752611  0.784564  0.588370  1
  Cu  Cu120  1  0.751160  0.173482  0.614034  1
  Cu  Cu121  1  0.251566  0.397297  0.640441  1
  Cu  Cu122  1  0.252738  0.619016  0.588925  1
  Cu  Cu123  1  0.253990  0.008212  0.614684  1
  Cu  Cu124  1  0.752933  0.397297  0.640441  1
  Cu  Cu125  1  0.751762  0.619016  0.588925  1
  Cu  Cu126  1  0.750510  0.008212  0.614684  1
  Cu  Cu127  1  1.002250  0.647897  0.678688  1
  Cu  Cu128  1  0.002250  0.037278  0.703750  1
  Cu  Cu129  1  0.002250  0.259254  0.652985  1
  Cu  Cu130  1  0.502250  0.478307  0.677554  1
  Cu  Cu131  1  0.502250  0.866044  0.703001  1
  Cu  Cu132  1  0.502250  0.256878  0.726252  1
  Cu  Cu133  1  0.251834  0.728530  0.716211  1
  Cu  Cu134  1  0.252323  0.951744  0.665776  1
  Cu  Cu135  1  0.247949  0.339512  0.691128  1
  Cu  Cu136  1  0.752666  0.728530  0.716211  1
  Cu  Cu137  1  0.752176  0.951744  0.665776  1
  Cu  Cu138  1  0.756550  0.339512  0.691128  1
  Cu  Cu139  1  0.253237  0.565923  0.717170  1
  Cu  Cu140  1  0.249817  0.786976  0.666136  1
  Cu  Cu141  1  0.248442  0.175303  0.691511  1
  Cu  Cu142  1  0.751263  0.565923  0.717170  1
  Cu  Cu143  1  0.754682  0.786976  0.666136  1
  Cu  Cu144  1  0.756058  0.175303  0.691511  1
