# generated using pymatgen
data_AlCu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22946068
_cell_length_b   9.97110457
_cell_length_c   50.47321405
_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   'Al24 Cu72'
_cell_volume   2631.8499982
_cell_formula_units_Z   24
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  0.501476  0.548063  0.331353  1
  Al  Al2  1  0.501476  0.143155  0.290704  1
  Al  Al3  1  0.001476  0.498232  0.280035  1
  Al  Al4  1  1.001476  0.912102  0.318875  1
  Al  Al5  1  0.501476  0.367692  0.408040  1
  Al  Al6  1  0.501476  0.957868  0.369419  1
  Al  Al7  1  0.001476  0.323089  0.357095  1
  Al  Al8  1  1.001476  0.734308  0.395341  1
  Al  Al9  1  0.501476  0.187871  0.485010  1
  Al  Al10  1  0.501476  0.777801  0.446473  1
  Al  Al11  1  1.001476  0.143952  0.433890  1
  Al  Al12  1  0.001476  0.554192  0.472405  1
  Al  Al13  1  0.501476  0.008253  0.562019  1
  Al  Al14  1  0.501476  0.598012  0.523504  1
  Al  Al15  1  1.001476  0.964333  0.510899  1
  Al  Al16  1  1.001476  0.374404  0.549436  1
  Al  Al17  1  0.501476  0.829115  0.638814  1
  Al  Al18  1  0.501476  0.417897  0.600568  1
  Al  Al19  1  0.001476  0.784513  0.587869  1
  Al  Al20  1  1.001476  0.194336  0.626490  1
  Al  Al21  1  0.501476  0.653972  0.715874  1
  Al  Al22  1  0.501476  0.240102  0.677034  1
  Al  Al23  1  1.001476  0.604142  0.664556  1
  Al  Al24  1  0.001476  0.009049  0.705206  1
  Cu  Cu25  1  0.001476  0.553225  0.331052  1
  Cu  Cu26  1  1.001476  0.141878  0.292793  1
  Cu  Cu27  1  0.501476  0.495955  0.280940  1
  Cu  Cu28  1  0.501476  0.909920  0.318142  1
  Cu  Cu29  1  0.250003  0.342436  0.312286  1
  Cu  Cu30  1  0.251172  0.930159  0.274798  1
  Cu  Cu31  1  0.752949  0.342436  0.312286  1
  Cu  Cu32  1  0.751780  0.930159  0.274798  1
  Cu  Cu33  1  0.253667  0.706444  0.298577  1
  Cu  Cu34  1  0.253772  0.118549  0.337024  1
  Cu  Cu35  1  0.749285  0.706444  0.298577  1
  Cu  Cu36  1  0.749180  0.118549  0.337024  1
  Cu  Cu37  1  1.001476  0.373182  0.408514  1
  Cu  Cu38  1  1.001476  0.964171  0.369873  1
  Cu  Cu39  1  0.501476  0.317702  0.356629  1
  Cu  Cu40  1  0.501476  0.728157  0.394917  1
  Cu  Cu41  1  0.251161  0.162665  0.388744  1
  Cu  Cu42  1  0.251169  0.752417  0.350232  1
  Cu  Cu43  1  0.751791  0.162665  0.388744  1
  Cu  Cu44  1  0.751783  0.752417  0.350232  1
  Cu  Cu45  1  0.251272  0.528411  0.376147  1
  Cu  Cu46  1  0.252203  0.938710  0.414581  1
  Cu  Cu47  1  0.751680  0.528411  0.376147  1
  Cu  Cu48  1  0.750749  0.938710  0.414581  1
  Cu  Cu49  1  1.001476  0.193607  0.485431  1
  Cu  Cu50  1  0.001476  0.783547  0.446904  1
  Cu  Cu51  1  0.501476  0.138336  0.433470  1
  Cu  Cu52  1  0.501476  0.548479  0.471968  1
  Cu  Cu53  1  0.250890  0.983111  0.465777  1
  Cu  Cu54  1  0.250749  0.573122  0.427271  1
  Cu  Cu55  1  0.752062  0.983111  0.465777  1
  Cu  Cu56  1  0.752203  0.573122  0.427271  1
  Cu  Cu57  1  0.252087  0.348820  0.453143  1
  Cu  Cu58  1  0.252092  0.758959  0.491605  1
  Cu  Cu59  1  0.750865  0.348820  0.453143  1
  Cu  Cu60  1  0.750861  0.758959  0.491605  1
  Cu  Cu61  1  0.001476  0.013869  0.562439  1
  Cu  Cu62  1  0.001476  0.603726  0.523941  1
  Cu  Cu63  1  0.501476  0.958597  0.510478  1
  Cu  Cu64  1  0.501476  0.368658  0.549005  1
  Cu  Cu65  1  0.250865  0.803385  0.542766  1
  Cu  Cu66  1  0.250861  0.393245  0.504304  1
  Cu  Cu67  1  0.752087  0.803385  0.542766  1
  Cu  Cu68  1  0.752092  0.393245  0.504304  1
  Cu  Cu69  1  0.252062  0.169093  0.530132  1
  Cu  Cu70  1  0.252203  0.579083  0.568638  1
  Cu  Cu71  1  0.750890  0.169093  0.530132  1
  Cu  Cu72  1  0.750749  0.579083  0.568638  1
  Cu  Cu73  1  0.001476  0.834502  0.639280  1
  Cu  Cu74  1  1.001476  0.424047  0.600992  1
  Cu  Cu75  1  0.501476  0.779023  0.587395  1
  Cu  Cu76  1  0.501476  0.188034  0.626036  1
  Cu  Cu77  1  0.251680  0.623794  0.619762  1
  Cu  Cu78  1  0.250749  0.213495  0.581328  1
  Cu  Cu79  1  0.751272  0.623794  0.619762  1
  Cu  Cu80  1  0.752203  0.213495  0.581328  1
  Cu  Cu81  1  0.251791  0.989539  0.607165  1
  Cu  Cu82  1  0.251783  0.399787  0.645677  1
  Cu  Cu83  1  0.751161  0.989539  0.607165  1
  Cu  Cu84  1  0.751169  0.399787  0.645677  1
  Cu  Cu85  1  1.001476  0.656249  0.714969  1
  Cu  Cu86  1  0.001476  0.242284  0.677767  1
  Cu  Cu87  1  0.501476  0.598980  0.664857  1
  Cu  Cu88  1  0.501476  0.010326  0.703116  1
  Cu  Cu89  1  0.249285  0.445761  0.697332  1
  Cu  Cu90  1  0.249180  0.033655  0.658885  1
  Cu  Cu91  1  0.753667  0.445761  0.697332  1
  Cu  Cu92  1  0.753772  0.033655  0.658885  1
  Cu  Cu93  1  0.252949  0.809768  0.683624  1
  Cu  Cu94  1  0.251780  0.222046  0.721111  1
  Cu  Cu95  1  0.750003  0.809768  0.683624  1
  Cu  Cu96  1  0.751172  0.222046  0.721111  1
