# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.18970694
_cell_length_b   6.59523189
_cell_length_c   47.24603949
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.43494882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu44
_cell_volume   1238.51245661
_cell_formula_units_Z   44
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
  Cu  Cu1  1  0.940636  0.504076  0.288674  1
  Cu  Cu2  1  0.155149  0.933031  0.308340  1
  Cu  Cu3  1  0.334546  0.291581  0.280852  1
  Cu  Cu4  1  0.544200  0.711214  0.298685  1
  Cu  Cu5  1  0.378118  0.378899  0.329443  1
  Cu  Cu6  1  0.601760  0.826534  0.349516  1
  Cu  Cu7  1  0.766621  0.155973  0.316703  1
  Cu  Cu8  1  0.989558  0.601881  0.339012  1
  Cu  Cu9  1  0.822124  0.267680  0.370361  1
  Cu  Cu10  1  0.044100  0.711976  0.391615  1
  Cu  Cu11  1  0.211139  0.045567  0.360309  1
  Cu  Cu12  1  0.432867  0.489337  0.381112  1
  Cu  Cu13  1  0.265847  0.155830  0.412547  1
  Cu  Cu14  1  0.487865  0.600213  0.433292  1
  Cu  Cu15  1  0.655208  0.934359  0.401810  1
  Cu  Cu16  1  0.876950  0.378210  0.422834  1
  Cu  Cu17  1  0.709811  0.044459  0.454222  1
  Cu  Cu18  1  0.931618  0.488432  0.475183  1
  Cu  Cu19  1  0.098740  0.822147  0.443845  1
  Cu  Cu20  1  0.320651  0.266321  0.464743  1
  Cu  Cu21  1  0.153450  0.932450  0.496119  1
  Cu  Cu22  1  0.375368  0.376639  0.517041  1
  Cu  Cu23  1  0.542566  0.710502  0.485611  1
  Cu  Cu24  1  0.764484  0.154691  0.506533  1
  Cu  Cu25  1  0.597282  0.820820  0.537910  1
  Cu  Cu26  1  0.819194  0.264994  0.558807  1
  Cu  Cu27  1  0.986316  0.598709  0.527469  1
  Cu  Cu28  1  0.208123  0.042682  0.548430  1
  Cu  Cu29  1  0.040984  0.708931  0.579819  1
  Cu  Cu30  1  0.262726  0.152782  0.600842  1
  Cu  Cu31  1  0.430069  0.486928  0.569360  1
  Cu  Cu32  1  0.652087  0.931311  0.590105  1
  Cu  Cu33  1  0.485067  0.597805  0.621540  1
  Cu  Cu34  1  0.706795  0.041574  0.642343  1
  Cu  Cu35  1  0.873834  0.375165  0.611037  1
  Cu  Cu36  1  0.095810  0.819462  0.632291  1
  Cu  Cu37  1  0.928376  0.485260  0.663640  1
  Cu  Cu38  1  0.151313  0.931168  0.685949  1
  Cu  Cu39  1  0.316174  0.260607  0.653137  1
  Cu  Cu40  1  0.539816  0.708242  0.673209  1
  Cu  Cu41  1  0.373734  0.375928  0.703967  1
  Cu  Cu42  1  0.583388  0.795560  0.721800  1
  Cu  Cu43  1  0.762785  0.154111  0.694312  1
  Cu  Cu44  1  0.977297  0.583065  0.713978  1
