# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.20052481
_cell_length_b   9.19423433
_cell_length_c   46.35760554
_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   Cu66
_cell_volume   1790.35897915
_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  0.251268  0.043234  0.314543  1
  Cu  Cu2  1  0.251268  0.774890  0.301958  1
  Cu  Cu3  1  0.251268  0.504550  0.289642  1
  Cu  Cu4  1  0.751268  0.087951  0.286305  1
  Cu  Cu5  1  0.751268  0.621383  0.309998  1
  Cu  Cu6  1  0.751268  0.353547  0.297617  1
  Cu  Cu7  1  0.251268  0.851112  0.354091  1
  Cu  Cu8  1  0.251268  0.580890  0.340701  1
  Cu  Cu9  1  0.251268  0.308862  0.326717  1
  Cu  Cu10  1  0.751268  0.888781  0.323271  1
  Cu  Cu11  1  0.751268  0.427490  0.349489  1
  Cu  Cu12  1  0.751268  0.158118  0.337262  1
  Cu  Cu13  1  0.251268  0.658363  0.393995  1
  Cu  Cu14  1  0.251268  0.388685  0.380460  1
  Cu  Cu15  1  0.251268  0.119851  0.367558  1
  Cu  Cu16  1  0.751268  0.696295  0.362914  1
  Cu  Cu17  1  0.751268  0.234598  0.390146  1
  Cu  Cu18  1  0.751268  0.964752  0.376655  1
  Cu  Cu19  1  0.251268  0.466093  0.434122  1
  Cu  Cu20  1  0.251268  0.196986  0.420938  1
  Cu  Cu21  1  0.251268  0.927529  0.407578  1
  Cu  Cu22  1  0.751268  0.503329  0.403172  1
  Cu  Cu23  1  0.751268  0.041562  0.430176  1
  Cu  Cu24  1  0.751268  0.772108  0.416666  1
  Cu  Cu25  1  0.251268  0.273838  0.474430  1
  Cu  Cu26  1  0.251268  0.004455  0.461073  1
  Cu  Cu27  1  0.251268  0.735171  0.447596  1
  Cu  Cu28  1  0.751268  0.311054  0.443567  1
  Cu  Cu29  1  0.751268  0.849023  0.470275  1
  Cu  Cu30  1  0.751268  0.579931  0.456869  1
  Cu  Cu31  1  0.251268  0.081291  0.514581  1
  Cu  Cu32  1  0.251268  0.811987  0.501167  1
  Cu  Cu33  1  0.251268  0.542936  0.487766  1
  Cu  Cu34  1  0.751268  0.118422  0.483688  1
  Cu  Cu35  1  0.751268  0.656777  0.510503  1
  Cu  Cu36  1  0.751268  0.387726  0.497102  1
  Cu  Cu37  1  0.251268  0.888660  0.554702  1
  Cu  Cu38  1  0.251268  0.619783  0.541400  1
  Cu  Cu39  1  0.251268  0.350691  0.527994  1
  Cu  Cu40  1  0.751268  0.925875  0.523839  1
  Cu  Cu41  1  0.751268  0.464543  0.550673  1
  Cu  Cu42  1  0.751268  0.195259  0.537196  1
  Cu  Cu43  1  0.251268  0.696385  0.595097  1
  Cu  Cu44  1  0.251268  0.427605  0.581603  1
  Cu  Cu45  1  0.251268  0.158151  0.568093  1
  Cu  Cu46  1  0.751268  0.733620  0.564147  1
  Cu  Cu47  1  0.751268  0.272185  0.590691  1
  Cu  Cu48  1  0.751268  1.002727  0.577331  1
  Cu  Cu49  1  0.251268  0.503418  0.635355  1
  Cu  Cu50  1  0.251268  0.234961  0.621614  1
  Cu  Cu51  1  0.251268  0.965115  0.608122  1
  Cu  Cu52  1  0.751268  0.541351  0.604274  1
  Cu  Cu53  1  0.751268  0.079862  0.630711  1
  Cu  Cu54  1  0.751268  0.811029  0.617809  1
  Cu  Cu55  1  0.251268  0.310933  0.674998  1
  Cu  Cu56  1  0.251268  0.041595  0.661007  1
  Cu  Cu57  1  0.251268  0.772223  0.648779  1
  Cu  Cu58  1  0.751268  0.348602  0.644178  1
  Cu  Cu59  1  0.751268  0.890851  0.671551  1
  Cu  Cu60  1  0.751268  0.618824  0.657568  1
  Cu  Cu61  1  0.251268  0.111762  0.711964  1
  Cu  Cu62  1  0.251268  0.846166  0.700652  1
  Cu  Cu63  1  0.251268  0.578330  0.688271  1
  Cu  Cu64  1  0.751268  0.156480  0.683726  1
  Cu  Cu65  1  0.751268  0.695163  0.708627  1
  Cu  Cu66  1  0.751268  0.424823  0.696311  1
