# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.42054551
_cell_length_b   8.78051783
_cell_length_c   45.78102970
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   104.63468065
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu64
_cell_volume   1719.3244905
_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  0.403433  0.137800  0.288650  1
  Cu  Cu2  1  0.647631  0.628686  0.301747  1
  Cu  Cu3  1  0.608061  0.894495  0.282903  1
  Cu  Cu4  1  0.856557  0.383347  0.295413  1
  Cu  Cu5  1  0.892669  0.117809  0.314966  1
  Cu  Cu6  1  0.137772  0.607684  0.328160  1
  Cu  Cu7  1  0.101481  0.872524  0.308454  1
  Cu  Cu8  1  0.349219  0.362120  0.321716  1
  Cu  Cu9  1  0.382218  0.094966  0.342425  1
  Cu  Cu10  1  0.625884  0.583373  0.356164  1
  Cu  Cu11  1  0.593542  0.850905  0.336060  1
  Cu  Cu12  1  0.839139  0.339813  0.349387  1
  Cu  Cu13  1  0.870842  0.072680  0.370348  1
  Cu  Cu14  1  0.114644  0.561100  0.384030  1
  Cu  Cu15  1  0.082969  0.827554  0.363442  1
  Cu  Cu16  1  0.328929  0.316661  0.377228  1
  Cu  Cu17  1  0.359001  0.049589  0.398140  1
  Cu  Cu18  1  0.603237  0.538326  0.411991  1
  Cu  Cu19  1  0.573314  0.805115  0.391315  1
  Cu  Cu20  1  0.818319  0.294156  0.405111  1
  Cu  Cu21  1  0.847695  0.026990  0.426054  1
  Cu  Cu22  1  0.092076  0.515631  0.439917  1
  Cu  Cu23  1  0.062677  0.782506  0.419129  1
  Cu  Cu24  1  0.307245  0.271250  0.432998  1
  Cu  Cu25  1  0.336447  0.004213  0.453925  1
  Cu  Cu26  1  0.580817  0.492875  0.467820  1
  Cu  Cu27  1  0.551670  0.759835  0.447000  1
  Cu  Cu28  1  0.796110  0.248575  0.460896  1
  Cu  Cu29  1  0.825214  0.981499  0.481814  1
  Cu  Cu30  1  0.069589  0.470173  0.495723  1
  Cu  Cu31  1  0.040479  0.737134  0.474878  1
  Cu  Cu32  1  0.284868  0.225820  0.488782  1
  Cu  Cu33  1  0.313974  0.958768  0.509704  1
  Cu  Cu34  1  0.558362  0.447455  0.523607  1
  Cu  Cu35  1  0.529253  0.714415  0.502762  1
  Cu  Cu36  1  0.773627  0.203090  0.516672  1
  Cu  Cu37  1  0.802732  0.936013  0.537589  1
  Cu  Cu38  1  0.047172  0.424754  0.551486  1
  Cu  Cu39  1  0.018025  0.691713  0.530666  1
  Cu  Cu40  1  0.262395  0.180376  0.544561  1
  Cu  Cu41  1  0.291597  0.913339  0.565487  1
  Cu  Cu42  1  0.536165  0.402083  0.579357  1
  Cu  Cu43  1  0.506765  0.668957  0.558568  1
  Cu  Cu44  1  0.751146  0.157598  0.572432  1
  Cu  Cu45  1  0.780522  0.890433  0.593374  1
  Cu  Cu46  1  0.025528  0.379473  0.607170  1
  Cu  Cu47  1  0.995605  0.646262  0.586494  1
  Cu  Cu48  1  0.239840  0.134999  0.600345  1
  Cu  Cu49  1  0.269913  0.867927  0.621258  1
  Cu  Cu50  1  0.515873  0.357034  0.635043  1
  Cu  Cu51  1  0.484198  0.623488  0.614455  1
  Cu  Cu52  1  0.727999  0.111908  0.628137  1
  Cu  Cu53  1  0.759703  0.844776  0.649098  1
  Cu  Cu54  1  0.005300  0.333684  0.662425  1
  Cu  Cu55  1  0.972957  0.601216  0.642322  1
  Cu  Cu56  1  0.216624  0.089622  0.656061  1
  Cu  Cu57  1  0.249622  0.822468  0.676770  1
  Cu  Cu58  1  0.497360  0.312064  0.690031  1
  Cu  Cu59  1  0.461070  0.576904  0.670326  1
  Cu  Cu60  1  0.706173  0.066779  0.683520  1
  Cu  Cu61  1  0.742285  0.801241  0.703073  1
  Cu  Cu62  1  0.990780  0.290093  0.715583  1
  Cu  Cu63  1  0.951210  0.555903  0.696739  1
  Cu  Cu64  1  0.195409  0.046789  0.709835  1
