# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.39674238
_cell_length_b   4.36684070
_cell_length_c   46.19810501
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu64
_cell_volume   1693.95683563
_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  0.497267  0.862816  0.283134  1
  Cu  Cu2  1  0.253534  0.213652  0.282811  1
  Cu  Cu3  1  0.009801  0.862816  0.283134  1
  Cu  Cu4  1  0.753534  0.028201  0.307169  1
  Cu  Cu5  1  0.506643  0.369887  0.308809  1
  Cu  Cu6  1  0.253534  0.709262  0.310008  1
  Cu  Cu7  1  1.000425  0.369887  0.308809  1
  Cu  Cu8  1  0.753534  0.535022  0.334854  1
  Cu  Cu9  1  0.503189  0.874166  0.337337  1
  Cu  Cu10  1  0.253534  0.211696  0.337164  1
  Cu  Cu11  1  0.003880  0.874166  0.337337  1
  Cu  Cu12  1  0.753534  0.037028  0.363410  1
  Cu  Cu13  1  0.503785  0.375758  0.364276  1
  Cu  Cu14  1  0.253534  0.713226  0.364913  1
  Cu  Cu15  1  1.003283  0.375758  0.364276  1
  Cu  Cu16  1  0.753534  0.538128  0.391274  1
  Cu  Cu17  1  0.503842  0.877362  0.392422  1
  Cu  Cu18  1  0.253534  0.215254  0.392554  1
  Cu  Cu19  1  1.003227  0.877362  0.392422  1
  Cu  Cu20  1  0.753534  0.039278  0.419543  1
  Cu  Cu21  1  0.503767  0.378533  0.420038  1
  Cu  Cu22  1  0.253534  0.716856  0.420403  1
  Cu  Cu23  1  1.003302  0.378533  0.420038  1
  Cu  Cu24  1  0.753534  0.540085  0.447426  1
  Cu  Cu25  1  0.503613  0.879434  0.448007  1
  Cu  Cu26  1  0.253534  0.218262  0.448158  1
  Cu  Cu27  1  1.003456  0.879434  0.448007  1
  Cu  Cu28  1  0.753534  0.040807  0.475432  1
  Cu  Cu29  1  0.503584  0.380156  0.475788  1
  Cu  Cu30  1  0.253534  0.719356  0.476032  1
  Cu  Cu31  1  1.003484  0.380156  0.475788  1
  Cu  Cu32  1  0.753534  0.541474  0.503257  1
  Cu  Cu33  1  0.503531  0.880809  0.503721  1
  Cu  Cu34  1  0.253534  0.220373  0.503851  1
  Cu  Cu35  1  0.003538  0.880809  0.503721  1
  Cu  Cu36  1  0.753534  0.042233  0.531159  1
  Cu  Cu37  1  0.503441  0.381432  0.531549  1
  Cu  Cu38  1  0.253534  0.721440  0.531755  1
  Cu  Cu39  1  0.003627  0.381432  0.531549  1
  Cu  Cu40  1  0.753534  0.543126  0.558859  1
  Cu  Cu41  1  0.503458  0.882122  0.559543  1
  Cu  Cu42  1  0.253534  0.222493  0.559618  1
  Cu  Cu43  1  0.003611  0.882122  0.559543  1
  Cu  Cu44  1  0.753534  0.044499  0.586744  1
  Cu  Cu45  1  0.503164  0.382822  0.587353  1
  Cu  Cu46  1  0.253534  0.723961  0.587559  1
  Cu  Cu47  1  0.003904  0.382822  0.587353  1
  Cu  Cu48  1  0.753534  0.546369  0.614123  1
  Cu  Cu49  1  0.503260  0.883726  0.615563  1
  Cu  Cu50  1  0.253534  0.225297  0.615482  1
  Cu  Cu51  1  0.003808  0.883726  0.615563  1
  Cu  Cu52  1  0.753534  0.049314  0.642094  1
  Cu  Cu53  1  0.502854  0.384318  0.643145  1
  Cu  Cu54  1  0.253534  0.727379  0.643294  1
  Cu  Cu55  1  0.004215  0.384318  0.643145  1
  Cu  Cu56  1  0.753534  0.551290  0.668507  1
  Cu  Cu57  1  0.504873  0.883983  0.671617  1
  Cu  Cu58  1  0.253534  0.229675  0.670960  1
  Cu  Cu59  1  1.002196  0.883983  0.671617  1
  Cu  Cu60  1  0.753534  0.061682  0.697018  1
  Cu  Cu61  1  0.499664  0.383614  0.698772  1
  Cu  Cu62  1  0.253534  0.736576  0.698404  1
  Cu  Cu63  1  0.007405  0.383614  0.698772  1
  Cu  Cu64  1  0.753534  0.573870  0.721103  1
