# generated using pymatgen
data_AlCu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.70545198
_cell_length_b   13.31169666
_cell_length_c   48.11197318
_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   'Al32 Cu96'
_cell_volume   3654.06809333
_cell_formula_units_Z   32
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  0.016182  0.994042  0.280683  1
  Al  Al2  1  0.016182  0.376287  0.329187  1
  Al  Al3  1  0.516182  0.594807  0.364252  1
  Al  Al4  1  0.516182  0.171936  0.296494  1
  Al  Al5  1  0.516182  0.876287  0.329187  1
  Al  Al6  1  0.516182  0.494042  0.280683  1
  Al  Al7  1  0.016182  0.671936  0.296494  1
  Al  Al8  1  0.016182  0.094807  0.364252  1
  Al  Al9  1  0.016182  0.780743  0.384750  1
  Al  Al10  1  0.016182  0.192023  0.449138  1
  Al  Al11  1  0.516182  0.382343  0.470082  1
  Al  Al12  1  0.516182  0.980662  0.411480  1
  Al  Al13  1  0.516182  0.692023  0.449138  1
  Al  Al14  1  0.516182  0.280743  0.384750  1
  Al  Al15  1  0.016182  0.480662  0.411480  1
  Al  Al16  1  0.016182  0.882343  0.470082  1
  Al  Al17  1  0.016182  0.578162  0.494910  1
  Al  Al18  1  0.016182  0.982528  0.556046  1
  Al  Al19  1  0.516182  0.174523  0.578531  1
  Al  Al20  1  0.516182  0.789831  0.533355  1
  Al  Al21  1  0.516182  0.482528  0.556046  1
  Al  Al22  1  0.516182  0.078162  0.494910  1
  Al  Al23  1  0.016182  0.289831  0.533355  1
  Al  Al24  1  0.016182  0.674523  0.578531  1
  Al  Al25  1  0.016182  0.386599  0.616983  1
  Al  Al26  1  0.016182  0.773984  0.663002  1
  Al  Al27  1  0.516182  0.984966  0.703301  1
  Al  Al28  1  0.516182  0.580126  0.641901  1
  Al  Al29  1  0.516182  0.273984  0.663002  1
  Al  Al30  1  0.516182  0.886599  0.616983  1
  Al  Al31  1  0.016182  0.080126  0.641901  1
  Al  Al32  1  0.016182  0.484966  0.703301  1
  Cu  Cu33  1  0.016182  0.882434  0.328286  1
  Cu  Cu34  1  0.016182  0.484016  0.281264  1
  Cu  Cu35  1  0.271489  0.432111  0.369983  1
  Cu  Cu36  1  0.270199  0.038588  0.323048  1
  Cu  Cu37  1  0.262166  0.538588  0.323048  1
  Cu  Cu38  1  0.260876  0.932111  0.369983  1
  Cu  Cu39  1  0.516182  0.678342  0.301395  1
  Cu  Cu40  1  0.516182  0.089188  0.364634  1
  Cu  Cu41  1  0.769382  0.829792  0.287221  1
  Cu  Cu42  1  0.751247  0.228179  0.341053  1
  Cu  Cu43  1  0.781117  0.728179  0.341053  1
  Cu  Cu44  1  0.762982  0.329792  0.287221  1
  Cu  Cu45  1  0.516182  0.984016  0.281264  1
  Cu  Cu46  1  0.516182  0.382434  0.328286  1
  Cu  Cu47  1  0.770199  0.538588  0.323048  1
  Cu  Cu48  1  0.771489  0.932111  0.369983  1
  Cu  Cu49  1  0.760876  0.432111  0.369983  1
  Cu  Cu50  1  0.762166  0.038588  0.323048  1
  Cu  Cu51  1  0.016182  0.589188  0.364634  1
  Cu  Cu52  1  0.016182  0.178342  0.301395  1
  Cu  Cu53  1  0.251247  0.728179  0.341053  1
  Cu  Cu54  1  0.269382  0.329792  0.287221  1
  Cu  Cu55  1  0.262982  0.829792  0.287221  1
  Cu  Cu56  1  0.281117  0.228179  0.341053  1
  Cu  Cu57  1  0.016182  0.690988  0.448161  1
  Cu  Cu58  1  0.016182  0.283347  0.384003  1
  Cu  Cu59  1  0.266705  0.240517  0.491131  1
  Cu  Cu60  1  0.266909  0.832110  0.427232  1
  Cu  Cu61  1  0.265456  0.332110  0.427232  1
  Cu  Cu62  1  0.265659  0.740517  0.491131  1
  Cu  Cu63  1  0.516182  0.480546  0.412042  1
  Cu  Cu64  1  0.516182  0.883558  0.470376  1
  Cu  Cu65  1  0.763621  0.641952  0.406856  1
  Cu  Cu66  1  0.767569  0.030093  0.453126  1
  Cu  Cu67  1  0.764796  0.530093  0.453126  1
  Cu  Cu68  1  0.768744  0.141952  0.406856  1
  Cu  Cu69  1  0.516182  0.783347  0.384003  1
  Cu  Cu70  1  0.516182  0.190988  0.448161  1
  Cu  Cu71  1  0.766909  0.332110  0.427232  1
  Cu  Cu72  1  0.766705  0.740517  0.491131  1
  Cu  Cu73  1  0.765659  0.240517  0.491131  1
  Cu  Cu74  1  0.765456  0.832110  0.427232  1
  Cu  Cu75  1  0.016182  0.383558  0.470376  1
  Cu  Cu76  1  0.016182  0.980546  0.412042  1
  Cu  Cu77  1  0.267569  0.530093  0.453126  1
  Cu  Cu78  1  0.263621  0.141952  0.406856  1
  Cu  Cu79  1  0.268744  0.641952  0.406856  1
  Cu  Cu80  1  0.264796  0.030093  0.453126  1
  Cu  Cu81  1  0.016182  0.481960  0.556035  1
  Cu  Cu82  1  0.016182  0.078054  0.495454  1
  Cu  Cu83  1  0.266123  0.032259  0.598961  1
  Cu  Cu84  1  0.267592  0.626844  0.536709  1
  Cu  Cu85  1  0.264772  0.126844  0.536709  1
  Cu  Cu86  1  0.266242  0.532259  0.598961  1
  Cu  Cu87  1  0.516182  0.289027  0.532514  1
  Cu  Cu88  1  0.516182  0.675704  0.579396  1
  Cu  Cu89  1  0.765256  0.432469  0.513122  1
  Cu  Cu90  1  0.769121  0.837725  0.575354  1
  Cu  Cu91  1  0.763244  0.337725  0.575354  1
  Cu  Cu92  1  0.767109  0.932469  0.513122  1
  Cu  Cu93  1  0.516182  0.578054  0.495454  1
  Cu  Cu94  1  0.516182  0.981960  0.556035  1
  Cu  Cu95  1  0.767592  0.126844  0.536709  1
  Cu  Cu96  1  0.766123  0.532259  0.598961  1
  Cu  Cu97  1  0.766242  0.032259  0.598961  1
  Cu  Cu98  1  0.764772  0.626844  0.536709  1
  Cu  Cu99  1  0.016182  0.175704  0.579396  1
  Cu  Cu100  1  0.016182  0.789027  0.532514  1
  Cu  Cu101  1  0.269121  0.337725  0.575354  1
  Cu  Cu102  1  0.265256  0.932469  0.513122  1
  Cu  Cu103  1  0.267109  0.432469  0.513122  1
  Cu  Cu104  1  0.263244  0.837725  0.575354  1
  Cu  Cu105  1  0.016182  0.272003  0.662431  1
  Cu  Cu106  1  0.016182  0.887384  0.617257  1
  Cu  Cu107  1  0.277197  0.817832  0.704413  1
  Cu  Cu108  1  0.257165  0.435373  0.659844  1
  Cu  Cu109  1  0.275199  0.935373  0.659844  1
  Cu  Cu110  1  0.255167  0.317832  0.704413  1
  Cu  Cu111  1  0.516182  0.082571  0.641971  1
  Cu  Cu112  1  0.516182  0.476542  0.699655  1
  Cu  Cu113  1  0.765312  0.223450  0.620650  1
  Cu  Cu114  1  0.759774  0.631594  0.684841  1
  Cu  Cu115  1  0.772590  0.131594  0.684841  1
  Cu  Cu116  1  0.767052  0.723450  0.620650  1
  Cu  Cu117  1  0.516182  0.387384  0.617257  1
  Cu  Cu118  1  0.516182  0.772003  0.662431  1
  Cu  Cu119  1  0.757165  0.935373  0.659844  1
  Cu  Cu120  1  0.777197  0.317832  0.704413  1
  Cu  Cu121  1  0.755167  0.817832  0.704413  1
  Cu  Cu122  1  0.775199  0.435373  0.659844  1
  Cu  Cu123  1  0.016182  0.976542  0.699655  1
  Cu  Cu124  1  0.016182  0.582571  0.641971  1
  Cu  Cu125  1  0.259774  0.131594  0.684841  1
  Cu  Cu126  1  0.265312  0.723450  0.620650  1
  Cu  Cu127  1  0.267052  0.223450  0.620650  1
  Cu  Cu128  1  0.272590  0.631594  0.684841  1
