# generated using pymatgen
data_Al2Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.44956416
_cell_length_b   5.13684863
_cell_length_c   46.30829881
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   68.46560422
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2Cu
_chemical_formula_sum   'Al36 Cu18'
_cell_volume   2090.94440882
_cell_formula_units_Z   18
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  0.853970  0.432472  0.357683  1
  Al  Al2  1  0.398911  0.079808  0.331021  1
  Al  Al3  1  0.273214  0.626966  0.327412  1
  Al  Al4  1  0.962987  0.766292  0.326839  1
  Al  Al5  1  0.945652  0.915750  0.381852  1
  Al  Al6  1  0.426698  0.239203  0.386727  1
  Al  Al7  1  0.245150  0.890644  0.378677  1
  Al  Al8  1  0.528524  0.611812  0.359527  1
  Al  Al9  1  0.857633  0.958611  0.440601  1
  Al  Al10  1  0.260784  0.140061  0.430314  1
  Al  Al11  1  0.971429  0.358815  0.414183  1
  Al  Al12  1  0.690001  0.788614  0.398278  1
  Al  Al13  1  0.727556  0.512489  0.450853  1
  Al  Al14  1  0.407758  0.912396  0.485354  1
  Al  Al15  1  0.303072  0.480746  0.471920  1
  Al  Al16  1  0.550436  0.098921  0.443673  1
  Al  Al17  1  0.886577  0.601496  0.536469  1
  Al  Al18  1  0.157022  0.219969  0.514562  1
  Al  Al19  1  0.999049  0.537978  0.472714  1
  Al  Al20  1  0.581343  0.372918  0.492617  1
  Al  Al21  1  0.696885  0.134360  0.545029  1
  Al  Al22  1  0.132641  0.738529  0.517925  1
  Al  Al23  1  0.147108  0.469261  0.569161  1
  Al  Al24  1  0.578371  0.705520  0.536851  1
  Al  Al25  1  0.549819  0.917847  0.589861  1
  Al  Al26  1  0.155484  0.839502  0.607863  1
  Al  Al27  1  0.857745  0.857373  0.591638  1
  Al  Al28  1  0.299439  0.910101  0.560025  1
  Al  Al29  1  0.453510  0.134805  0.665154  1
  Al  Al30  1  0.003847  0.380739  0.620294  1
  Al  Al31  1  0.649878  0.228280  0.628560  1
  Al  Al32  1  0.418319  0.697090  0.634561  1
  Al  Al33  1  0.600119  0.531731  0.681362  1
  Al  Al34  1  0.928644  0.950744  0.647638  1
  Al  Al35  1  0.908336  0.438204  0.677178  1
  Al  Al36  1  0.186337  0.040082  0.666503  1
  Cu  Cu37  1  0.100568  0.161362  0.330380  1
  Cu  Cu38  1  0.682223  0.700020  0.316475  1
  Cu  Cu39  1  0.146747  0.437080  0.371311  1
  Cu  Cu40  1  0.684230  0.071679  0.350246  1
  Cu  Cu41  1  0.155408  0.679437  0.422449  1
  Cu  Cu42  1  0.690252  0.292150  0.400818  1
  Cu  Cu43  1  0.097184  0.994117  0.466132  1
  Cu  Cu44  1  0.450118  0.635854  0.425287  1
  Cu  Cu45  1  0.877177  0.174365  0.501294  1
  Cu  Cu46  1  0.718608  0.840990  0.492616  1
  Cu  Cu47  1  0.994869  0.095317  0.558659  1
  Cu  Cu48  1  0.400739  0.307381  0.533391  1
  Cu  Cu49  1  0.765372  0.426951  0.585462  1
  Cu  Cu50  1  0.471788  0.450624  0.582679  1
  Cu  Cu51  1  0.714458  0.689114  0.636082  1
  Cu  Cu52  1  0.306732  0.244697  0.615043  1
  Cu  Cu53  1  0.723998  0.964730  0.683946  1
  Cu  Cu54  1  0.182615  0.540603  0.657966  1
