# generated using pymatgen
data_AlCu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22771960
_cell_length_b   14.22629076
_cell_length_c   48.98732857
_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   'Al30 Cu90'
_cell_volume   3643.23950624
_cell_formula_units_Z   30
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  0.501643  0.235567  0.296150  1
  Al  Al2  1  0.501643  0.845608  0.351866  1
  Al  Al3  1  0.501643  0.547327  0.320909  1
  Al  Al4  1  1.001643  0.093100  0.325852  1
  Al  Al5  1  1.001643  0.782866  0.300695  1
  Al  Al6  1  0.001643  0.397908  0.355623  1
  Al  Al7  1  0.501643  0.147991  0.378764  1
  Al  Al8  1  0.501643  0.755591  0.434647  1
  Al  Al9  1  0.501643  0.452089  0.406280  1
  Al  Al10  1  1.001643  0.005394  0.411215  1
  Al  Al11  1  1.001643  0.700573  0.384321  1
  Al  Al12  1  1.001643  0.308728  0.438993  1
  Al  Al13  1  0.501643  0.059437  0.462019  1
  Al  Al14  1  0.501643  0.665990  0.517984  1
  Al  Al15  1  0.501643  0.362638  0.489934  1
  Al  Al16  1  1.001643  0.915436  0.494884  1
  Al  Al17  1  1.001643  0.611738  0.467168  1
  Al  Al18  1  0.001643  0.218944  0.522530  1
  Al  Al19  1  0.501643  0.969588  0.545677  1
  Al  Al20  1  0.501643  0.576352  0.601482  1
  Al  Al21  1  0.501643  0.272968  0.573372  1
  Al  Al22  1  0.001643  0.825741  0.578438  1
  Al  Al23  1  0.001643  0.522305  0.550606  1
  Al  Al24  1  1.001643  0.129313  0.605979  1
  Al  Al25  1  0.501643  0.880680  0.629163  1
  Al  Al26  1  0.501643  0.486124  0.686273  1
  Al  Al27  1  0.501643  0.184863  0.655997  1
  Al  Al28  1  0.001643  0.737605  0.661861  1
  Al  Al29  1  1.001643  0.433252  0.633874  1
  Al  Al30  1  1.001643  0.039845  0.690601  1
  Cu  Cu31  1  0.001643  0.245917  0.297071  1
  Cu  Cu32  1  1.001643  0.847989  0.351332  1
  Cu  Cu33  1  0.001643  0.546616  0.323143  1
  Cu  Cu34  1  0.501643  0.088780  0.327725  1
  Cu  Cu35  1  0.501643  0.782878  0.301828  1
  Cu  Cu36  1  0.501643  0.395987  0.354893  1
  Cu  Cu37  1  0.248636  0.997436  0.364415  1
  Cu  Cu38  1  0.250228  0.693805  0.338246  1
  Cu  Cu39  1  0.252306  0.391527  0.309641  1
  Cu  Cu40  1  0.754650  0.997436  0.364415  1
  Cu  Cu41  1  0.753058  0.693805  0.338246  1
  Cu  Cu42  1  0.750980  0.391527  0.309641  1
  Cu  Cu43  1  0.253469  0.245656  0.341980  1
  Cu  Cu44  1  0.253129  0.937141  0.314088  1
  Cu  Cu45  1  0.253893  0.549164  0.369037  1
  Cu  Cu46  1  0.749817  0.245656  0.341980  1
  Cu  Cu47  1  0.750157  0.937141  0.314088  1
  Cu  Cu48  1  0.749393  0.549164  0.369037  1
  Cu  Cu49  1  1.001643  0.151966  0.378318  1
  Cu  Cu50  1  1.001643  0.759613  0.435107  1
  Cu  Cu51  1  0.001643  0.456617  0.406616  1
  Cu  Cu52  1  0.501643  1.000558  0.410799  1
  Cu  Cu53  1  0.501643  0.696801  0.383872  1
  Cu  Cu54  1  0.501643  0.304407  0.438705  1
  Cu  Cu55  1  0.250947  0.907903  0.448357  1
  Cu  Cu56  1  0.251557  0.603384  0.420668  1
  Cu  Cu57  1  0.251373  0.300535  0.392429  1
  Cu  Cu58  1  0.752339  0.907903  0.448357  1
  Cu  Cu59  1  0.751729  0.603384  0.420668  1
  Cu  Cu60  1  0.751913  0.300535  0.392429  1
  Cu  Cu61  1  0.251555  0.156640  0.425054  1
  Cu  Cu62  1  0.250983  0.853011  0.397735  1
  Cu  Cu63  1  0.252390  0.459869  0.453002  1
  Cu  Cu64  1  0.751731  0.156640  0.425054  1
  Cu  Cu65  1  0.752303  0.853011  0.397735  1
  Cu  Cu66  1  0.750897  0.459869  0.453002  1
  Cu  Cu67  1  0.001643  0.063343  0.462461  1
  Cu  Cu68  1  0.001643  0.670077  0.518330  1
  Cu  Cu69  1  1.001643  0.366740  0.490264  1
  Cu  Cu70  1  0.501643  0.911486  0.494508  1
  Cu  Cu71  1  0.501643  0.607686  0.466842  1
  Cu  Cu72  1  0.501643  0.214856  0.522195  1
  Cu  Cu73  1  0.251027  0.818033  0.531880  1
  Cu  Cu74  1  0.251088  0.514427  0.504010  1
  Cu  Cu75  1  0.251007  0.211255  0.475966  1
  Cu  Cu76  1  0.752259  0.818033  0.531880  1
  Cu  Cu77  1  0.752198  0.514427  0.504010  1
  Cu  Cu78  1  0.752279  0.211255  0.475966  1
  Cu  Cu79  1  0.252275  0.066990  0.508630  1
  Cu  Cu80  1  0.252277  0.763457  0.481108  1
  Cu  Cu81  1  0.252261  0.370448  0.536503  1
  Cu  Cu82  1  0.751011  0.066990  0.508630  1
  Cu  Cu83  1  0.751009  0.763457  0.481108  1
  Cu  Cu84  1  0.751025  0.370448  0.536503  1
  Cu  Cu85  1  0.001643  0.973581  0.546011  1
  Cu  Cu86  1  1.001643  0.580892  0.601808  1
  Cu  Cu87  1  0.001643  0.277317  0.573672  1
  Cu  Cu88  1  0.501643  0.821756  0.578057  1
  Cu  Cu89  1  0.501643  0.518270  0.550224  1
  Cu  Cu90  1  0.501643  0.124819  0.605611  1
  Cu  Cu91  1  0.251359  0.728508  0.615396  1
  Cu  Cu92  1  0.251694  0.425161  0.587475  1
  Cu  Cu93  1  0.250983  0.121544  0.559452  1
  Cu  Cu94  1  0.751927  0.728508  0.615396  1
  Cu  Cu95  1  0.751592  0.425161  0.587475  1
  Cu  Cu96  1  0.752304  0.121544  0.559452  1
  Cu  Cu97  1  0.251928  0.977349  0.592231  1
  Cu  Cu98  1  0.252300  0.673816  0.564524  1
  Cu  Cu99  1  0.251553  0.281766  0.619817  1
  Cu  Cu100  1  0.751358  0.977349  0.592231  1
  Cu  Cu101  1  0.750986  0.673816  0.564524  1
  Cu  Cu102  1  0.751734  0.281766  0.619817  1
  Cu  Cu103  1  1.001643  0.884468  0.629613  1
  Cu  Cu104  1  0.001643  0.491332  0.684622  1
  Cu  Cu105  1  1.001643  0.186502  0.656727  1
  Cu  Cu106  1  0.501643  0.733833  0.661500  1
  Cu  Cu107  1  0.501643  0.429109  0.634278  1
  Cu  Cu108  1  0.501643  0.039946  0.688700  1
  Cu  Cu109  1  0.253081  0.640837  0.697421  1
  Cu  Cu110  1  0.247827  0.336229  0.671101  1
  Cu  Cu111  1  0.249703  0.032055  0.643329  1
  Cu  Cu112  1  0.750205  0.640837  0.697421  1
  Cu  Cu113  1  0.755459  0.336229  0.671101  1
  Cu  Cu114  1  0.753584  0.032055  0.643329  1
  Cu  Cu115  1  0.255294  0.887994  0.675786  1
  Cu  Cu116  1  0.253881  0.584128  0.648065  1
  Cu  Cu117  1  0.252099  0.194341  0.701738  1
  Cu  Cu118  1  0.747992  0.887994  0.675786  1
  Cu  Cu119  1  0.749405  0.584128  0.648065  1
  Cu  Cu120  1  0.751188  0.194341  0.701738  1
