# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.16003220
_cell_length_b   4.87612980
_cell_length_c   45.71463576
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   68.76278617
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu72
_cell_volume   1903.20152846
_cell_formula_units_Z   72
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  0.903730  0.026141  0.278293  1
  Cu  Cu2  1  0.182313  0.967510  0.289192  1
  Cu  Cu3  1  0.461425  0.912994  0.301132  1
  Cu  Cu4  1  0.969683  0.480847  0.286976  1
  Cu  Cu5  1  0.249402  0.426538  0.298597  1
  Cu  Cu6  1  0.531038  0.371265  0.310245  1
  Cu  Cu7  1  0.739343  0.857593  0.313267  1
  Cu  Cu8  1  0.020916  0.805313  0.326314  1
  Cu  Cu9  1  0.301396  0.750144  0.338219  1
  Cu  Cu10  1  0.808179  0.317478  0.323710  1
  Cu  Cu11  1  0.088777  0.261016  0.335804  1
  Cu  Cu12  1  0.368592  0.207856  0.347750  1
  Cu  Cu13  1  0.579294  0.696624  0.350615  1
  Cu  Cu14  1  0.859496  0.643248  0.362865  1
  Cu  Cu15  1  0.140045  0.587379  0.375299  1
  Cu  Cu16  1  0.647127  0.152692  0.360253  1
  Cu  Cu17  1  0.927034  0.098982  0.373026  1
  Cu  Cu18  1  0.207215  0.043844  0.385179  1
  Cu  Cu19  1  0.419279  0.532837  0.387622  1
  Cu  Cu20  1  0.698724  0.479233  0.399892  1
  Cu  Cu21  1  0.978583  0.425415  0.412275  1
  Cu  Cu22  1  0.486278  0.989817  0.397531  1
  Cu  Cu23  1  0.765789  0.935400  0.409924  1
  Cu  Cu24  1  0.045838  0.881017  0.422335  1
  Cu  Cu25  1  0.258244  0.370473  0.424683  1
  Cu  Cu26  1  0.537926  0.316199  0.437003  1
  Cu  Cu27  1  0.817592  0.262094  0.449313  1
  Cu  Cu28  1  0.325448  0.826429  0.434674  1
  Cu  Cu29  1  0.605052  0.772100  0.447017  1
  Cu  Cu30  1  0.884728  0.717955  0.459386  1
  Cu  Cu31  1  0.097209  0.207797  0.461708  1
  Cu  Cu32  1  0.376961  0.153289  0.474061  1
  Cu  Cu33  1  0.656674  0.098965  0.486402  1
  Cu  Cu34  1  0.164423  0.663547  0.471768  1
  Cu  Cu35  1  0.444141  0.609087  0.484111  1
  Cu  Cu36  1  0.723839  0.554756  0.496463  1
  Cu  Cu37  1  0.936277  0.044783  0.498771  1
  Cu  Cu38  1  0.215975  0.990452  0.511123  1
  Cu  Cu39  1  0.495693  0.935992  0.523466  1
  Cu  Cu40  1  0.003441  0.500574  0.508832  1
  Cu  Cu41  1  0.283155  0.446251  0.521173  1
  Cu  Cu42  1  0.562906  0.391743  0.533526  1
  Cu  Cu43  1  0.775388  0.881584  0.535848  1
  Cu  Cu44  1  0.055064  0.827440  0.548217  1
  Cu  Cu45  1  0.334668  0.773111  0.560560  1
  Cu  Cu46  1  0.842524  0.337445  0.545922  1
  Cu  Cu47  1  0.122189  0.283340  0.558231  1
  Cu  Cu48  1  0.401872  0.229066  0.570551  1
  Cu  Cu49  1  0.614277  0.718522  0.572899  1
  Cu  Cu50  1  0.894327  0.664139  0.585310  1
  Cu  Cu51  1  0.173838  0.609723  0.597704  1
  Cu  Cu52  1  0.681533  0.174125  0.582959  1
  Cu  Cu53  1  0.961392  0.120306  0.595343  1
  Cu  Cu54  1  0.240837  0.066703  0.607612  1
  Cu  Cu55  1  0.452901  0.555696  0.610055  1
  Cu  Cu56  1  0.733082  0.500558  0.622209  1
  Cu  Cu57  1  0.012988  0.446847  0.634982  1
  Cu  Cu58  1  0.520071  0.012161  0.619935  1
  Cu  Cu59  1  0.800620  0.956291  0.632369  1
  Cu  Cu60  1  0.080822  0.902915  0.644620  1
  Cu  Cu61  1  0.291524  0.391683  0.647484  1
  Cu  Cu62  1  0.571339  0.338523  0.659430  1
  Cu  Cu63  1  0.851937  0.282062  0.671524  1
  Cu  Cu64  1  0.358720  0.849396  0.657016  1
  Cu  Cu65  1  0.639199  0.794226  0.668920  1
  Cu  Cu66  1  0.920773  0.741947  0.681968  1
  Cu  Cu67  1  0.129078  0.228274  0.684989  1
  Cu  Cu68  1  0.410713  0.173001  0.696638  1
  Cu  Cu69  1  0.690433  0.118692  0.708258  1
  Cu  Cu70  1  0.198691  0.686545  0.694103  1
  Cu  Cu71  1  0.477803  0.632029  0.706043  1
  Cu  Cu72  1  0.756386  0.573399  0.716941  1
