# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.94024204
_cell_length_b   8.52314012
_cell_length_c   48.08068265
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu66
_cell_volume   1573.81962528
_cell_formula_units_Z   66
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  0.353124  0.851851  0.285252  1
  Cu  Cu2  1  0.494696  0.156306  0.297887  1
  Cu  Cu3  1  0.629689  0.465183  0.310759  1
  Cu  Cu4  1  0.774397  0.693685  0.281426  1
  Cu  Cu5  1  0.922987  1.000199  0.291925  1
  Cu  Cu6  1  0.064118  0.312271  0.303657  1
  Cu  Cu7  1  0.754178  0.787584  0.325779  1
  Cu  Cu8  1  0.882187  0.099655  0.337644  1
  Cu  Cu9  1  0.011121  0.411042  0.350009  1
  Cu  Cu10  1  0.199155  0.625740  0.315256  1
  Cu  Cu11  1  0.318822  0.943628  0.331129  1
  Cu  Cu12  1  0.445409  0.253877  0.344194  1
  Cu  Cu13  1  0.137817  0.721378  0.363267  1
  Cu  Cu14  1  0.257561  0.037437  0.377876  1
  Cu  Cu15  1  0.381235  0.349507  0.391089  1
  Cu  Cu16  1  0.572511  0.564810  0.357167  1
  Cu  Cu17  1  0.695559  0.881071  0.371688  1
  Cu  Cu18  1  0.819629  0.194155  0.384420  1
  Cu  Cu19  1  0.506282  0.660567  0.404390  1
  Cu  Cu20  1  0.629798  0.974957  0.418270  1
  Cu  Cu21  1  0.753137  0.287772  0.431415  1
  Cu  Cu22  1  0.944435  0.505332  0.397394  1
  Cu  Cu23  1  0.069537  0.817088  0.410900  1
  Cu  Cu24  1  0.191419  0.131394  0.424781  1
  Cu  Cu25  1  0.877357  0.599698  0.444684  1
  Cu  Cu26  1  1.001647  0.912071  0.458164  1
  Cu  Cu27  1  0.124498  0.225282  0.471770  1
  Cu  Cu28  1  0.314782  0.443680  0.438156  1
  Cu  Cu29  1  0.439227  0.755657  0.451545  1
  Cu  Cu30  1  0.562820  0.068916  0.465135  1
  Cu  Cu31  1  0.247779  0.537975  0.485247  1
  Cu  Cu32  1  0.371900  0.850308  0.498688  1
  Cu  Cu33  1  0.495737  0.162894  0.512117  1
  Cu  Cu34  1  0.686225  0.381634  0.478435  1
  Cu  Cu35  1  0.810061  0.694219  0.491863  1
  Cu  Cu36  1  0.934183  1.006553  0.505305  1
  Cu  Cu37  1  0.619141  0.475612  0.525417  1
  Cu  Cu38  1  0.742735  0.788871  0.539006  1
  Cu  Cu39  1  0.867179  0.100848  0.552395  1
  Cu  Cu40  1  0.057464  0.319246  0.518781  1
  Cu  Cu41  1  0.180315  0.632457  0.532388  1
  Cu  Cu42  1  0.304604  0.944830  0.545868  1
  Cu  Cu43  1  0.990543  0.413133  0.565770  1
  Cu  Cu44  1  0.112424  0.727440  0.579651  1
  Cu  Cu45  1  0.237527  0.039196  0.593158  1
  Cu  Cu46  1  0.428825  0.256756  0.559137  1
  Cu  Cu47  1  0.552164  0.569571  0.572281  1
  Cu  Cu48  1  0.675680  0.883961  0.586162  1
  Cu  Cu49  1  0.362333  0.350373  0.606132  1
  Cu  Cu50  1  0.486402  0.663457  0.618864  1
  Cu  Cu51  1  0.609450  0.979718  0.633384  1
  Cu  Cu52  1  0.800727  0.195021  0.599462  1
  Cu  Cu53  1  0.924401  0.507091  0.612676  1
  Cu  Cu54  1  0.044144  0.823150  0.627285  1
  Cu  Cu55  1  0.736553  0.290651  0.646358  1
  Cu  Cu56  1  0.863139  0.600900  0.659423  1
  Cu  Cu57  1  0.982806  0.918788  0.675296  1
  Cu  Cu58  1  0.170841  0.133486  0.640543  1
  Cu  Cu59  1  0.299775  0.444873  0.652908  1
  Cu  Cu60  1  0.427784  0.756944  0.664773  1
  Cu  Cu61  1  0.117844  0.232257  0.686894  1
  Cu  Cu62  1  0.258975  0.544329  0.698627  1
  Cu  Cu63  1  0.407565  0.850843  0.709126  1
  Cu  Cu64  1  0.552272  0.079345  0.679793  1
  Cu  Cu65  1  0.687265  0.388221  0.692665  1
  Cu  Cu66  1  0.828837  0.692676  0.705300  1
