# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.42022875
_cell_length_b   8.78075586
_cell_length_c   45.78313444
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   75.36531908
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu64
_cell_volume   1719.32693523
_cell_formula_units_Z   64
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  0.265828  0.137881  0.288635  1
  Cu  Cu2  1  0.019347  0.628739  0.301741  1
  Cu  Cu3  1  0.714051  0.894590  0.282873  1
  Cu  Cu4  1  0.473596  0.383279  0.295387  1
  Cu  Cu5  1  0.775212  0.117804  0.314955  1
  Cu  Cu6  1  0.530450  0.607655  0.328153  1
  Cu  Cu7  1  0.229525  0.872495  0.308417  1
  Cu  Cu8  1  0.987445  0.362132  0.321693  1
  Cu  Cu9  1  0.287570  0.094948  0.342410  1
  Cu  Cu10  1  0.042813  0.583363  0.356155  1
  Cu  Cu11  1  0.743048  0.850910  0.336028  1
  Cu  Cu12  1  0.499633  0.339811  0.349361  1
  Cu  Cu13  1  0.798430  0.072668  0.370336  1
  Cu  Cu14  1  0.553797  0.561087  0.384019  1
  Cu  Cu15  1  0.255746  0.827557  0.363409  1
  Cu  Cu16  1  0.012543  0.316656  0.377200  1
  Cu  Cu17  1  0.309631  0.049575  0.398126  1
  Cu  Cu18  1  0.065108  0.538311  0.411979  1
  Cu  Cu19  1  0.768465  0.805116  0.391284  1
  Cu  Cu20  1  0.524394  0.294152  0.405083  1
  Cu  Cu21  1  0.820870  0.026975  0.426040  1
  Cu  Cu22  1  0.576586  0.515614  0.439905  1
  Cu  Cu23  1  0.280381  0.782505  0.419097  1
  Cu  Cu24  1  0.036175  0.271244  0.432968  1
  Cu  Cu25  1  0.332347  0.004194  0.453911  1
  Cu  Cu26  1  0.088027  0.492857  0.467806  1
  Cu  Cu27  1  0.791992  0.759830  0.446968  1
  Cu  Cu28  1  0.547659  0.248569  0.460866  1
  Cu  Cu29  1  0.843774  0.981479  0.481800  1
  Cu  Cu30  1  0.599446  0.470154  0.495709  1
  Cu  Cu31  1  0.303446  0.737128  0.474847  1
  Cu  Cu32  1  0.059118  0.225813  0.488751  1
  Cu  Cu33  1  0.355210  0.958748  0.509689  1
  Cu  Cu34  1  0.110883  0.447433  0.523593  1
  Cu  Cu35  1  0.814883  0.714408  0.502730  1
  Cu  Cu36  1  0.570555  0.203082  0.516640  1
  Cu  Cu37  1  0.866670  0.935992  0.537574  1
  Cu  Cu38  1  0.622337  0.424731  0.551472  1
  Cu  Cu39  1  0.326301  0.691704  0.530633  1
  Cu  Cu40  1  0.081981  0.180367  0.544529  1
  Cu  Cu41  1  0.378154  0.913317  0.565472  1
  Cu  Cu42  1  0.133948  0.402056  0.579342  1
  Cu  Cu43  1  0.837742  0.668947  0.558535  1
  Cu  Cu44  1  0.593459  0.157587  0.572399  1
  Cu  Cu45  1  0.889934  0.890409  0.593357  1
  Cu  Cu46  1  0.645864  0.379445  0.607155  1
  Cu  Cu47  1  0.349221  0.646250  0.586460  1
  Cu  Cu48  1  0.104698  0.134986  0.600313  1
  Cu  Cu49  1  0.401786  0.867905  0.621240  1
  Cu  Cu50  1  0.158583  0.357005  0.635031  1
  Cu  Cu51  1  0.860531  0.623474  0.614420  1
  Cu  Cu52  1  0.615899  0.111893  0.628103  1
  Cu  Cu53  1  0.914696  0.844750  0.649078  1
  Cu  Cu54  1  0.671281  0.333651  0.662411  1
  Cu  Cu55  1  0.371516  0.601198  0.642285  1
  Cu  Cu56  1  0.126758  0.089613  0.656030  1
  Cu  Cu57  1  0.426884  0.822429  0.676747  1
  Cu  Cu58  1  0.184804  0.312066  0.690023  1
  Cu  Cu59  1  0.883878  0.576906  0.670287  1
  Cu  Cu60  1  0.639116  0.066757  0.683485  1
  Cu  Cu61  1  0.940733  0.801282  0.703052  1
  Cu  Cu62  1  0.700278  0.289971  0.715567  1
  Cu  Cu63  1  0.394981  0.555822  0.696699  1
  Cu  Cu64  1  0.148500  0.046680  0.709804  1
