# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.18640811
_cell_length_b   12.96105328
_cell_length_c   46.28238876
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   113.09346927
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu216
_cell_volume   5620.84746673
_cell_formula_units_Z   216
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  0.640152  0.317352  0.287603  1
  Cu  Cu2  1  0.140152  0.317352  0.287603  1
  Cu  Cu3  1  0.775589  0.588381  0.320895  1
  Cu  Cu4  1  0.207216  0.951484  0.303600  1
  Cu  Cu5  1  0.275589  0.588381  0.320895  1
  Cu  Cu6  1  0.707216  0.951484  0.303600  1
  Cu  Cu7  1  0.673677  0.134381  0.295555  1
  Cu  Cu8  1  0.173677  0.134381  0.295555  1
  Cu  Cu9  1  0.106126  0.499417  0.280588  1
  Cu  Cu10  1  0.240325  0.767788  0.311185  1
  Cu  Cu11  1  0.606126  0.499417  0.280588  1
  Cu  Cu12  1  0.740325  0.767788  0.311185  1
  Cu  Cu13  1  0.423677  0.134381  0.295555  1
  Cu  Cu14  1  0.923677  0.134381  0.295555  1
  Cu  Cu15  1  0.856126  0.499417  0.280588  1
  Cu  Cu16  1  0.990325  0.767788  0.311185  1
  Cu  Cu17  1  0.356126  0.499417  0.280588  1
  Cu  Cu18  1  0.490325  0.767788  0.311185  1
  Cu  Cu19  1  0.890152  0.317352  0.287603  1
  Cu  Cu20  1  0.390152  0.317352  0.287603  1
  Cu  Cu21  1  0.025589  0.588381  0.320895  1
  Cu  Cu22  1  0.457216  0.951484  0.303600  1
  Cu  Cu23  1  0.525589  0.588381  0.320895  1
  Cu  Cu24  1  0.957216  0.951484  0.303600  1
  Cu  Cu25  1  0.343336  0.223902  0.336748  1
  Cu  Cu26  1  0.843336  0.223902  0.336748  1
  Cu  Cu27  1  0.479832  0.497053  0.370398  1
  Cu  Cu28  1  0.911127  0.859585  0.352708  1
  Cu  Cu29  1  0.979832  0.497053  0.370398  1
  Cu  Cu30  1  0.411127  0.859585  0.352708  1
  Cu  Cu31  1  0.377274  0.041817  0.344783  1
  Cu  Cu32  1  0.877274  0.041817  0.344783  1
  Cu  Cu33  1  0.809342  0.405901  0.328921  1
  Cu  Cu34  1  0.946018  0.679390  0.361835  1
  Cu  Cu35  1  0.309342  0.405901  0.328921  1
  Cu  Cu36  1  0.446018  0.679390  0.361835  1
  Cu  Cu37  1  0.127274  0.041817  0.344783  1
  Cu  Cu38  1  0.627274  0.041817  0.344783  1
  Cu  Cu39  1  0.559342  0.405901  0.328921  1
  Cu  Cu40  1  0.696018  0.679390  0.361835  1
  Cu  Cu41  1  0.059342  0.405901  0.328921  1
  Cu  Cu42  1  0.196018  0.679390  0.361835  1
  Cu  Cu43  1  0.593336  0.223902  0.336748  1
  Cu  Cu44  1  0.093336  0.223902  0.336748  1
  Cu  Cu45  1  0.729832  0.497053  0.370398  1
  Cu  Cu46  1  0.161127  0.859585  0.352708  1
  Cu  Cu47  1  0.229832  0.497053  0.370398  1
  Cu  Cu48  1  0.661127  0.859585  0.352708  1
  Cu  Cu49  1  0.047426  0.132310  0.386661  1
  Cu  Cu50  1  0.547426  0.132310  0.386661  1
  Cu  Cu51  1  0.183795  0.405187  0.420339  1
  Cu  Cu52  1  0.615842  0.769207  0.403420  1
  Cu  Cu53  1  0.683795  0.405187  0.420339  1
  Cu  Cu54  1  0.115842  0.769207  0.403420  1
  Cu  Cu55  1  0.081373  0.950247  0.394734  1
  Cu  Cu56  1  0.581373  0.950247  0.394734  1
  Cu  Cu57  1  0.513533  0.314487  0.378590  1
  Cu  Cu58  1  0.649928  0.587415  0.411995  1
  Cu  Cu59  1  0.013533  0.314487  0.378590  1
  Cu  Cu60  1  0.149928  0.587415  0.411995  1
  Cu  Cu61  1  0.831373  0.950247  0.394734  1
  Cu  Cu62  1  0.331373  0.950247  0.394734  1
  Cu  Cu63  1  0.263533  0.314487  0.378590  1
  Cu  Cu64  1  0.399928  0.587415  0.411995  1
  Cu  Cu65  1  0.763533  0.314487  0.378590  1
  Cu  Cu66  1  0.899928  0.587415  0.411995  1
  Cu  Cu67  1  0.297426  0.132310  0.386661  1
  Cu  Cu68  1  0.797426  0.132310  0.386661  1
  Cu  Cu69  1  0.433795  0.405187  0.420339  1
  Cu  Cu70  1  0.865842  0.769207  0.403420  1
  Cu  Cu71  1  0.933795  0.405187  0.420339  1
  Cu  Cu72  1  0.365842  0.769207  0.403420  1
  Cu  Cu73  1  0.751651  0.040972  0.436706  1
  Cu  Cu74  1  0.251651  0.040972  0.436706  1
  Cu  Cu75  1  0.887926  0.313661  0.470384  1
  Cu  Cu76  1  0.319979  0.677691  0.453656  1
  Cu  Cu77  1  0.387926  0.313661  0.470384  1
  Cu  Cu78  1  0.819979  0.677691  0.453656  1
  Cu  Cu79  1  0.785874  0.859445  0.445154  1
  Cu  Cu80  1  0.285874  0.859445  0.445154  1
  Cu  Cu81  1  0.217684  0.223004  0.428550  1
  Cu  Cu82  1  0.353953  0.495679  0.462065  1
  Cu  Cu83  1  0.717684  0.223004  0.428550  1
  Cu  Cu84  1  0.853953  0.495679  0.462065  1
  Cu  Cu85  1  0.535874  0.859445  0.445154  1
  Cu  Cu86  1  0.035874  0.859445  0.445154  1
  Cu  Cu87  1  0.967684  0.223004  0.428550  1
  Cu  Cu88  1  0.103953  0.495679  0.462065  1
  Cu  Cu89  1  0.467684  0.223004  0.428550  1
  Cu  Cu90  1  0.603953  0.495679  0.462065  1
  Cu  Cu91  1  1.001651  0.040972  0.436706  1
  Cu  Cu92  1  0.501651  0.040972  0.436706  1
  Cu  Cu93  1  0.137926  0.313661  0.470384  1
  Cu  Cu94  1  0.569979  0.677691  0.453656  1
  Cu  Cu95  1  0.637926  0.313661  0.470384  1
  Cu  Cu96  1  0.069979  0.677691  0.453656  1
  Cu  Cu97  1  0.456006  0.949883  0.486939  1
  Cu  Cu98  1  0.956006  0.949883  0.486939  1
  Cu  Cu99  1  0.592196  0.222405  0.520514  1
  Cu  Cu100  1  0.024063  0.586074  0.503781  1
  Cu  Cu101  1  0.092196  0.222405  0.520514  1
  Cu  Cu102  1  0.524063  0.586074  0.503781  1
  Cu  Cu103  1  0.490058  0.768024  0.495352  1
  Cu  Cu104  1  0.990058  0.768024  0.495352  1
  Cu  Cu105  1  0.921925  0.131692  0.478620  1
  Cu  Cu106  1  0.058116  0.404214  0.512194  1
  Cu  Cu107  1  0.421925  0.131692  0.478620  1
  Cu  Cu108  1  0.558116  0.404214  0.512194  1
  Cu  Cu109  1  0.240058  0.768024  0.495352  1
  Cu  Cu110  1  0.740058  0.768024  0.495352  1
  Cu  Cu111  1  0.671925  0.131692  0.478620  1
  Cu  Cu112  1  0.808116  0.404214  0.512194  1
  Cu  Cu113  1  0.171925  0.131692  0.478620  1
  Cu  Cu114  1  0.308116  0.404214  0.512194  1
  Cu  Cu115  1  0.706006  0.949883  0.486939  1
  Cu  Cu116  1  0.206006  0.949883  0.486939  1
  Cu  Cu117  1  0.842196  0.222405  0.520514  1
  Cu  Cu118  1  0.274063  0.586074  0.503781  1
  Cu  Cu119  1  0.342196  0.222405  0.520514  1
  Cu  Cu120  1  0.774063  0.586074  0.503781  1
  Cu  Cu121  1  0.160168  0.858419  0.537068  1
  Cu  Cu122  1  0.660168  0.858419  0.537068  1
  Cu  Cu123  1  0.296437  0.131094  0.570583  1
  Cu  Cu124  1  0.728248  0.494652  0.553980  1
  Cu  Cu125  1  0.796437  0.131094  0.570583  1
  Cu  Cu126  1  0.228248  0.494652  0.553980  1
  Cu  Cu127  1  0.194142  0.676406  0.545477  1
  Cu  Cu128  1  0.694142  0.676406  0.545477  1
  Cu  Cu129  1  0.626196  0.040437  0.528750  1
  Cu  Cu130  1  0.762471  0.313125  0.562428  1
  Cu  Cu131  1  0.126196  0.040437  0.528750  1
  Cu  Cu132  1  0.262471  0.313125  0.562428  1
  Cu  Cu133  1  0.944142  0.676406  0.545477  1
  Cu  Cu134  1  0.444142  0.676406  0.545477  1
  Cu  Cu135  1  0.376196  0.040437  0.528750  1
  Cu  Cu136  1  0.512471  0.313125  0.562428  1
  Cu  Cu137  1  0.876196  0.040437  0.528750  1
  Cu  Cu138  1  0.012471  0.313125  0.562428  1
  Cu  Cu139  1  0.410168  0.858419  0.537068  1
  Cu  Cu140  1  0.910168  0.858419  0.537068  1
  Cu  Cu141  1  0.546437  0.131094  0.570583  1
  Cu  Cu142  1  0.978248  0.494652  0.553980  1
  Cu  Cu143  1  0.046437  0.131094  0.570583  1
  Cu  Cu144  1  0.478248  0.494652  0.553980  1
  Cu  Cu145  1  0.864194  0.766683  0.587138  1
  Cu  Cu146  1  0.364194  0.766683  0.587138  1
  Cu  Cu147  1  1.000589  0.039611  0.620543  1
  Cu  Cu148  1  0.432748  0.403850  0.604400  1
  Cu  Cu149  1  0.500589  0.039611  0.620543  1
  Cu  Cu150  1  0.932748  0.403850  0.604400  1
  Cu  Cu151  1  0.898279  0.584891  0.595714  1
  Cu  Cu152  1  0.398279  0.584891  0.595714  1
  Cu  Cu153  1  0.330327  0.948910  0.578794  1
  Cu  Cu154  1  0.466695  0.221787  0.612472  1
  Cu  Cu155  1  0.830327  0.948910  0.578794  1
  Cu  Cu156  1  0.966695  0.221787  0.612472  1
  Cu  Cu157  1  0.648279  0.584891  0.595714  1
  Cu  Cu158  1  0.148279  0.584891  0.595714  1
  Cu  Cu159  1  0.080327  0.948910  0.578794  1
  Cu  Cu160  1  0.216695  0.221787  0.612472  1
  Cu  Cu161  1  0.580327  0.948910  0.578794  1
  Cu  Cu162  1  0.716695  0.221787  0.612472  1
  Cu  Cu163  1  0.114194  0.766683  0.587138  1
  Cu  Cu164  1  0.614194  0.766683  0.587138  1
  Cu  Cu165  1  0.250589  0.039611  0.620543  1
  Cu  Cu166  1  0.682748  0.403850  0.604400  1
  Cu  Cu167  1  0.750589  0.039611  0.620543  1
  Cu  Cu168  1  0.182748  0.403850  0.604400  1
  Cu  Cu169  1  0.568103  0.674707  0.637298  1
  Cu  Cu170  1  0.068103  0.674707  0.637298  1
  Cu  Cu171  1  0.704779  0.948197  0.670213  1
  Cu  Cu172  1  0.136847  0.312281  0.654350  1
  Cu  Cu173  1  0.204779  0.948197  0.670213  1
  Cu  Cu174  1  0.636847  0.312281  0.654350  1
  Cu  Cu175  1  0.602994  0.494513  0.646426  1
  Cu  Cu176  1  0.102994  0.494513  0.646426  1
  Cu  Cu177  1  0.034290  0.857045  0.628735  1
  Cu  Cu178  1  0.170786  0.130195  0.662385  1
  Cu  Cu179  1  0.534290  0.857045  0.628735  1
  Cu  Cu180  1  0.670786  0.130195  0.662385  1
  Cu  Cu181  1  0.352994  0.494513  0.646426  1
  Cu  Cu182  1  0.852994  0.494513  0.646426  1
  Cu  Cu183  1  0.784290  0.857045  0.628735  1
  Cu  Cu184  1  0.920786  0.130195  0.662385  1
  Cu  Cu185  1  0.284290  0.857045  0.628735  1
  Cu  Cu186  1  0.420786  0.130195  0.662385  1
  Cu  Cu187  1  0.818103  0.674707  0.637298  1
  Cu  Cu188  1  0.318103  0.674707  0.637298  1
  Cu  Cu189  1  0.954779  0.948197  0.670213  1
  Cu  Cu190  1  0.386847  0.312281  0.654350  1
  Cu  Cu191  1  0.454779  0.948197  0.670213  1
  Cu  Cu192  1  0.886847  0.312281  0.654350  1
  Cu  Cu193  1  0.273797  0.586310  0.687948  1
  Cu  Cu194  1  0.773797  0.586310  0.687948  1
  Cu  Cu195  1  0.407995  0.854680  0.718546  1
  Cu  Cu196  1  0.840445  0.219716  0.703578  1
  Cu  Cu197  1  0.907995  0.854680  0.718546  1
  Cu  Cu198  1  0.340445  0.219716  0.703578  1
  Cu  Cu199  1  0.306906  0.402613  0.695533  1
  Cu  Cu200  1  0.806906  0.402613  0.695533  1
  Cu  Cu201  1  0.738532  0.765717  0.678239  1
  Cu  Cu202  1  0.873970  0.036745  0.711530  1
  Cu  Cu203  1  0.238532  0.765717  0.678239  1
  Cu  Cu204  1  0.373970  0.036745  0.711530  1
  Cu  Cu205  1  0.056906  0.402613  0.695533  1
  Cu  Cu206  1  0.556906  0.402613  0.695533  1
  Cu  Cu207  1  0.488532  0.765717  0.678239  1
  Cu  Cu208  1  0.623970  0.036745  0.711530  1
  Cu  Cu209  1  0.988532  0.765717  0.678239  1
  Cu  Cu210  1  0.123970  0.036745  0.711530  1
  Cu  Cu211  1  0.523797  0.586310  0.687948  1
  Cu  Cu212  1  0.023797  0.586310  0.687948  1
  Cu  Cu213  1  0.657995  0.854680  0.718546  1
  Cu  Cu214  1  0.090445  0.219716  0.703578  1
  Cu  Cu215  1  0.157995  0.854680  0.718546  1
  Cu  Cu216  1  0.590445  0.219716  0.703578  1
