# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38747487
_cell_length_b   8.65884498
_cell_length_c   45.70432739
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   75.27389326
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu64
_cell_volume   1679.29376542
_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  0.393335  0.897494  0.280854  1
  Cu  Cu2  1  0.142938  0.381687  0.293195  1
  Cu  Cu3  1  0.609825  0.139248  0.286666  1
  Cu  Cu4  1  0.367713  0.625594  0.299316  1
  Cu  Cu5  1  0.904247  0.868908  0.306346  1
  Cu  Cu6  1  0.654780  0.360130  0.320251  1
  Cu  Cu7  1  0.117755  0.116086  0.313621  1
  Cu  Cu8  1  0.874723  0.604850  0.326562  1
  Cu  Cu9  1  0.412896  0.847825  0.334501  1
  Cu  Cu10  1  0.167921  0.337148  0.347884  1
  Cu  Cu11  1  0.628609  0.091548  0.340945  1
  Cu  Cu12  1  0.384368  0.581072  0.354544  1
  Cu  Cu13  1  0.924434  0.824970  0.361745  1
  Cu  Cu14  1  0.679104  0.313731  0.375566  1
  Cu  Cu15  1  0.139087  0.069744  0.368780  1
  Cu  Cu16  1  0.895028  0.558265  0.382340  1
  Cu  Cu17  1  0.435168  0.802086  0.389715  1
  Cu  Cu18  1  0.190242  0.291009  0.403494  1
  Cu  Cu19  1  0.650651  0.046461  0.396564  1
  Cu  Cu20  1  0.406501  0.535028  0.410333  1
  Cu  Cu21  1  0.946313  0.779171  0.417450  1
  Cu  Cu22  1  0.701668  0.267895  0.431328  1
  Cu  Cu23  1  0.161975  0.023625  0.424434  1
  Cu  Cu24  1  0.917685  0.512228  0.438218  1
  Cu  Cu25  1  0.457494  0.756282  0.445334  1
  Cu  Cu26  1  0.213041  0.244988  0.459199  1
  Cu  Cu27  1  0.673412  1.000613  0.452262  1
  Cu  Cu28  1  0.429102  0.489209  0.466115  1
  Cu  Cu29  1  0.968842  0.733390  0.473170  1
  Cu  Cu30  1  0.724467  0.222002  0.487052  1
  Cu  Cu31  1  0.184815  0.977690  0.480122  1
  Cu  Cu32  1  0.940466  0.466308  0.493982  1
  Cu  Cu33  1  0.480227  0.710440  0.501044  1
  Cu  Cu34  1  0.235879  0.199057  0.514905  1
  Cu  Cu35  1  0.696226  0.954745  0.507975  1
  Cu  Cu36  1  0.451852  0.443358  0.521856  1
  Cu  Cu37  1  0.991591  0.687539  0.528911  1
  Cu  Cu38  1  0.747281  0.176135  0.542764  1
  Cu  Cu39  1  0.207652  0.931760  0.535827  1
  Cu  Cu40  1  0.963199  0.420466  0.549692  1
  Cu  Cu41  1  0.503009  0.664520  0.556808  1
  Cu  Cu42  1  0.258719  0.153123  0.570593  1
  Cu  Cu43  1  0.719025  0.908853  0.563698  1
  Cu  Cu44  1  0.474380  0.397577  0.577576  1
  Cu  Cu45  1  0.014192  0.641720  0.584694  1
  Cu  Cu46  1  0.770042  0.130286  0.598462  1
  Cu  Cu47  1  0.230451  0.885738  0.591532  1
  Cu  Cu48  1  0.985525  0.374662  0.605312  1
  Cu  Cu49  1  0.525665  0.618483  0.612686  1
  Cu  Cu50  1  0.281606  0.107003  0.626246  1
  Cu  Cu51  1  0.741590  0.863016  0.619460  1
  Cu  Cu52  1  0.496259  0.351777  0.633281  1
  Cu  Cu53  1  0.036325  0.595675  0.640482  1
  Cu  Cu54  1  0.792084  0.085199  0.654081  1
  Cu  Cu55  1  0.252772  0.839599  0.647143  1
  Cu  Cu56  1  0.007798  0.328923  0.660525  1
  Cu  Cu57  1  0.545970  0.571898  0.668464  1
  Cu  Cu58  1  0.302938  0.060661  0.681405  1
  Cu  Cu59  1  0.765913  0.816617  0.674775  1
  Cu  Cu60  1  0.516446  0.307840  0.688680  1
  Cu  Cu61  1  0.052980  0.551153  0.695711  1
  Cu  Cu62  1  0.810868  0.037499  0.708361  1
  Cu  Cu63  1  0.277755  0.795061  0.701831  1
  Cu  Cu64  1  0.027359  0.279253  0.714172  1
