# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.53905123
_cell_length_b   18.10712293
_cell_length_c   47.37275209
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   94.02088077
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu80
_cell_volume   2172.59723422
_cell_formula_units_Z   80
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  0.942910  0.444344  0.295891  1
  Cu  Cu2  1  0.683984  0.926476  0.315686  1
  Cu  Cu3  1  0.491426  0.541372  0.324869  1
  Cu  Cu4  1  0.752449  0.063418  0.304870  1
  Cu  Cu5  1  0.313772  0.186054  0.306175  1
  Cu  Cu6  1  0.574301  0.707115  0.285810  1
  Cu  Cu7  1  0.875990  0.310488  0.307645  1
  Cu  Cu8  1  0.134973  0.828453  0.286824  1
  Cu  Cu9  1  0.422562  0.403644  0.338648  1
  Cu  Cu10  1  0.161737  0.881986  0.359508  1
  Cu  Cu11  1  0.969549  0.497619  0.368739  1
  Cu  Cu12  1  0.230263  0.019043  0.347684  1
  Cu  Cu13  1  0.791862  0.142239  0.349049  1
  Cu  Cu14  1  0.052924  0.664363  0.328238  1
  Cu  Cu15  1  0.353446  0.265405  0.350582  1
  Cu  Cu16  1  0.614571  0.787653  0.329346  1
  Cu  Cu17  1  0.900263  0.359044  0.381857  1
  Cu  Cu18  1  0.639501  0.837517  0.403417  1
  Cu  Cu19  1  0.447230  0.452982  0.412569  1
  Cu  Cu20  1  0.708153  0.974824  0.391094  1
  Cu  Cu21  1  0.269878  0.098272  0.392747  1
  Cu  Cu22  1  0.530726  0.619968  0.371087  1
  Cu  Cu23  1  0.831518  0.221549  0.394306  1
  Cu  Cu24  1  0.092600  0.743712  0.372928  1
  Cu  Cu25  1  0.378314  0.315146  0.425385  1
  Cu  Cu26  1  0.117299  0.793115  0.447071  1
  Cu  Cu27  1  0.925129  0.408779  0.456307  1
  Cu  Cu28  1  0.186138  0.930795  0.434621  1
  Cu  Cu29  1  0.747816  0.054148  0.436277  1
  Cu  Cu30  1  0.008720  0.575957  0.414554  1
  Cu  Cu31  1  0.309490  0.177495  0.437913  1
  Cu  Cu32  1  0.570416  0.699346  0.416308  1
  Cu  Cu33  1  0.856266  0.271050  0.468951  1
  Cu  Cu34  1  0.595167  0.748852  0.490665  1
  Cu  Cu35  1  0.403035  0.364592  0.499967  1
  Cu  Cu36  1  0.664045  0.886610  0.478137  1
  Cu  Cu37  1  0.225740  0.009998  0.479806  1
  Cu  Cu38  1  0.486664  0.531846  0.458107  1
  Cu  Cu39  1  0.787420  0.133356  0.481474  1
  Cu  Cu40  1  0.048322  0.655159  0.459803  1
  Cu  Cu41  1  0.334186  0.226890  0.512534  1
  Cu  Cu42  1  0.073058  0.704636  0.534223  1
  Cu  Cu43  1  0.880966  0.320455  0.543565  1
  Cu  Cu44  1  0.141948  0.842418  0.521667  1
  Cu  Cu45  1  0.703651  0.965822  0.523321  1
  Cu  Cu46  1  0.964579  0.487677  0.501739  1
  Cu  Cu47  1  0.265343  0.089204  0.525013  1
  Cu  Cu48  1  0.526220  0.610957  0.503360  1
  Cu  Cu49  1  0.812084  0.182689  0.556126  1
  Cu  Cu50  1  0.551000  0.660520  0.577758  1
  Cu  Cu51  1  0.358937  0.276397  0.587067  1
  Cu  Cu52  1  0.619840  0.798202  0.565215  1
  Cu  Cu53  1  0.181526  0.921573  0.566829  1
  Cu  Cu54  1  0.442478  0.443475  0.545425  1
  Cu  Cu55  1  0.743242  0.045003  0.568514  1
  Cu  Cu56  1  0.004114  0.566745  0.546975  1
  Cu  Cu57  1  0.289905  0.138333  0.599727  1
  Cu  Cu58  1  0.029095  0.616709  0.621259  1
  Cu  Cu59  1  0.836907  0.232339  0.630373  1
  Cu  Cu60  1  0.097796  0.754117  0.608824  1
  Cu  Cu61  1  0.659372  0.877266  0.610366  1
  Cu  Cu62  1  0.920355  0.399229  0.589158  1
  Cu  Cu63  1  0.221044  1.000607  0.611939  1
  Cu  Cu64  1  0.482029  0.522574  0.590659  1
  Cu  Cu65  1  0.767381  0.093288  0.643370  1
  Cu  Cu66  1  0.506838  0.572195  0.664422  1
  Cu  Cu67  1  0.314204  0.186934  0.673030  1
  Cu  Cu68  1  0.575930  0.710386  0.652559  1
  Cu  Cu69  1  0.137510  0.833544  0.654097  1
  Cu  Cu70  1  0.398177  0.354874  0.633056  1
  Cu  Cu71  1  0.699068  0.956656  0.655429  1
  Cu  Cu72  1  0.959720  0.477957  0.634373  1
  Cu  Cu73  1  0.245628  0.049783  0.687386  1
  Cu  Cu74  1  0.986314  0.531143  0.707110  1
  Cu  Cu75  1  0.793859  0.146244  0.715069  1
  Cu  Cu76  1  0.053337  0.665204  0.695487  1
  Cu  Cu77  1  0.615607  0.789742  0.696966  1
  Cu  Cu78  1  0.875548  0.309617  0.676026  1
  Cu  Cu79  1  0.176985  0.912489  0.698249  1
  Cu  Cu80  1  0.438009  0.434537  0.677919  1
