# generated using pymatgen
data_Al3Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.81683300
_cell_length_b   15.24752175
_cell_length_c   47.47961716
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Cu
_chemical_formula_sum   'Al48 Cu16'
_cell_volume   2039.23638023
_cell_formula_units_Z   16
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  0.501684  0.087751  0.299756  1
  Al  Al2  1  0.501684  0.594079  0.273426  1
  Al  Al3  1  1.001684  0.241488  0.282151  1
  Al  Al4  1  1.001684  0.704255  0.309617  1
  Al  Al5  1  0.001684  0.966987  0.266610  1
  Al  Al6  1  1.001684  0.443038  0.292559  1
  Al  Al7  1  0.501684  0.046797  0.360939  1
  Al  Al8  1  0.501684  0.557655  0.330241  1
  Al  Al9  1  1.001684  0.189328  0.339539  1
  Al  Al10  1  1.001684  0.673861  0.367557  1
  Al  Al11  1  1.001684  0.940591  0.323451  1
  Al  Al12  1  0.001684  0.421379  0.355215  1
  Al  Al13  1  0.501684  0.010924  0.419918  1
  Al  Al14  1  0.501684  0.532815  0.391180  1
  Al  Al15  1  1.001684  0.156674  0.398651  1
  Al  Al16  1  1.001684  0.643010  0.428057  1
  Al  Al17  1  1.001684  0.900915  0.382090  1
  Al  Al18  1  0.001684  0.384666  0.412648  1
  Al  Al19  1  0.501684  0.977130  0.478704  1
  Al  Al20  1  0.501684  0.496441  0.449660  1
  Al  Al21  1  1.001684  0.122935  0.457355  1
  Al  Al22  1  1.001684  0.606417  0.487010  1
  Al  Al23  1  1.001684  0.864906  0.441110  1
  Al  Al24  1  0.001684  0.350105  0.471150  1
  Al  Al25  1  0.501684  0.944870  0.537989  1
  Al  Al26  1  0.501684  0.460789  0.508509  1
  Al  Al27  1  1.001684  0.089330  0.516167  1
  Al  Al28  1  0.001684  0.571545  0.545758  1
  Al  Al29  1  1.001684  0.833149  0.500771  1
  Al  Al30  1  1.001684  0.315734  0.530111  1
  Al  Al31  1  0.501684  0.910191  0.596626  1
  Al  Al32  1  0.501684  0.426562  0.567638  1
  Al  Al33  1  1.001684  0.056526  0.575490  1
  Al  Al34  1  0.001684  0.538097  0.604927  1
  Al  Al35  1  0.001684  0.798760  0.559444  1
  Al  Al36  1  0.001684  0.281028  0.589182  1
  Al  Al37  1  0.501684  0.874121  0.654943  1
  Al  Al38  1  0.501684  0.391542  0.626612  1
  Al  Al39  1  1.001684  0.021257  0.634150  1
  Al  Al40  1  1.001684  0.502801  0.663445  1
  Al  Al41  1  0.001684  0.763429  0.618009  1
  Al  Al42  1  0.001684  0.247761  0.648980  1
  Al  Al43  1  0.501684  0.839927  0.714681  1
  Al  Al44  1  0.501684  0.359118  0.686450  1
  Al  Al45  1  0.001684  0.980502  0.691920  1
  Al  Al46  1  0.001684  0.473396  0.721183  1
  Al  Al47  1  0.001684  0.733456  0.677447  1
  Al  Al48  1  1.001684  0.215133  0.707567  1
  Cu  Cu49  1  0.501684  0.836610  0.289757  1
  Cu  Cu50  1  0.501684  0.323900  0.321094  1
  Cu  Cu51  1  0.501684  0.806071  0.345377  1
  Cu  Cu52  1  0.501684  0.287005  0.376417  1
  Cu  Cu53  1  0.501684  0.770083  0.404084  1
  Cu  Cu54  1  0.501684  0.253527  0.434873  1
  Cu  Cu55  1  0.501684  0.736923  0.464716  1
  Cu  Cu56  1  0.501684  0.219712  0.493645  1
  Cu  Cu57  1  0.501684  0.702354  0.523284  1
  Cu  Cu58  1  0.501684  0.185660  0.552553  1
  Cu  Cu59  1  0.501684  0.667707  0.581822  1
  Cu  Cu60  1  0.501684  0.152270  0.612224  1
  Cu  Cu61  1  0.501684  0.634744  0.641279  1
  Cu  Cu62  1  0.501684  0.116550  0.670786  1
  Cu  Cu63  1  0.501684  0.603174  0.698072  1
  Cu  Cu64  1  0.501684  0.079871  0.724831  1
