# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38622401
_cell_length_b   16.77940764
_cell_length_c   46.10933921
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.45985510
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu128
_cell_volume   3364.22263008
_cell_formula_units_Z   128
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  0.006376  0.946350  0.279010  1
  Cu  Cu2  1  0.753620  0.440711  0.291555  1
  Cu  Cu3  1  0.599728  0.067980  0.281623  1
  Cu  Cu4  1  0.348405  0.564858  0.294870  1
  Cu  Cu5  1  0.880033  0.192045  0.284882  1
  Cu  Cu6  1  0.628849  0.689028  0.298206  1
  Cu  Cu7  1  0.158788  0.316490  0.288125  1
  Cu  Cu8  1  0.913009  0.813292  0.300928  1
  Cu  Cu9  1  0.508473  0.936679  0.304676  1
  Cu  Cu10  1  0.256329  0.435072  0.318413  1
  Cu  Cu11  1  0.105263  0.062841  0.308604  1
  Cu  Cu12  1  0.852209  0.559338  0.321695  1
  Cu  Cu13  1  0.382496  0.186736  0.311726  1
  Cu  Cu14  1  0.131599  0.683515  0.325110  1
  Cu  Cu15  1  0.660607  0.310898  0.314916  1
  Cu  Cu16  1  0.411669  0.807970  0.328133  1
  Cu  Cu17  1  0.009064  0.932013  0.332736  1
  Cu  Cu18  1  0.759102  0.429306  0.346112  1
  Cu  Cu19  1  0.609287  0.055883  0.335897  1
  Cu  Cu20  1  0.357453  0.553555  0.349446  1
  Cu  Cu21  1  0.884163  0.180842  0.339431  1
  Cu  Cu22  1  0.634026  0.677819  0.352834  1
  Cu  Cu23  1  0.160732  0.305064  0.342682  1
  Cu  Cu24  1  0.912299  0.801802  0.356099  1
  Cu  Cu25  1  0.511684  0.925976  0.359983  1
  Cu  Cu26  1  0.261885  0.423520  0.373809  1
  Cu  Cu27  1  0.111798  0.050540  0.363705  1
  Cu  Cu28  1  0.860771  0.547795  0.377158  1
  Cu  Cu29  1  0.387170  0.174761  0.367011  1
  Cu  Cu30  1  0.137055  0.671976  0.380584  1
  Cu  Cu31  1  0.662733  0.299257  0.370374  1
  Cu  Cu32  1  0.414309  0.796154  0.383943  1
  Cu  Cu33  1  0.014042  0.920230  0.387933  1
  Cu  Cu34  1  0.764785  0.417660  0.401697  1
  Cu  Cu35  1  0.614172  0.044578  0.391454  1
  Cu  Cu36  1  0.363803  0.541931  0.405085  1
  Cu  Cu37  1  0.889573  0.169050  0.394921  1
  Cu  Cu38  1  0.639969  0.666170  0.408503  1
  Cu  Cu39  1  0.165550  0.293329  0.398263  1
  Cu  Cu40  1  0.916904  0.790287  0.411954  1
  Cu  Cu41  1  0.516520  0.914481  0.415675  1
  Cu  Cu42  1  0.267601  0.411810  0.429533  1
  Cu  Cu43  1  0.116529  0.038829  0.419302  1
  Cu  Cu44  1  0.866794  0.536105  0.432933  1
  Cu  Cu45  1  0.392329  0.163160  0.422707  1
  Cu  Cu46  1  0.142975  0.660338  0.436377  1
  Cu  Cu47  1  0.668219  0.287527  0.426108  1
  Cu  Cu48  1  0.419591  0.784550  0.439843  1
  Cu  Cu49  1  0.019156  0.908722  0.443556  1
  Cu  Cu50  1  0.770457  0.405979  0.457388  1
  Cu  Cu51  1  0.619025  0.033010  0.447112  1
  Cu  Cu52  1  0.369765  0.530264  0.460805  1
  Cu  Cu53  1  0.894988  0.157354  0.450564  1
  Cu  Cu54  1  0.645920  0.654530  0.464247  1
  Cu  Cu55  1  0.171018  0.281665  0.453957  1
  Cu  Cu56  1  0.922411  0.778740  0.467754  1
  Cu  Cu57  1  0.521911  0.902949  0.471390  1
  Cu  Cu58  1  0.273292  0.400139  0.485233  1
  Cu  Cu59  1  0.121604  0.027214  0.474963  1
  Cu  Cu60  1  0.872722  0.524438  0.488656  1
  Cu  Cu61  1  0.397737  0.151519  0.478394  1
  Cu  Cu62  1  0.148885  0.648713  0.492115  1
  Cu  Cu63  1  0.673800  0.275837  0.481806  1
  Cu  Cu64  1  0.425262  0.772958  0.495623  1
  Cu  Cu65  1  0.024722  0.897158  0.499268  1
  Cu  Cu66  1  0.776131  0.394303  0.513080  1
  Cu  Cu67  1  0.624236  0.021404  0.502808  1
  Cu  Cu68  1  0.375667  0.518613  0.516516  1
  Cu  Cu69  1  0.900487  0.145692  0.506247  1
  Cu  Cu70  1  0.651841  0.642901  0.519964  1
  Cu  Cu71  1  0.176610  0.269999  0.509656  1
  Cu  Cu72  1  0.928135  0.767166  0.523504  1
  Cu  Cu73  1  0.527557  0.891379  0.527132  1
  Cu  Cu74  1  0.278974  0.388475  0.540925  1
  Cu  Cu75  1  0.126879  0.015583  0.530675  1
  Cu  Cu76  1  0.878616  0.512778  0.544354  1
  Cu  Cu77  1  0.403244  0.139865  0.534091  1
  Cu  Cu78  1  0.154780  0.637106  0.547821  1
  Cu  Cu79  1  0.679425  0.264157  0.537503  1
  Cu  Cu80  1  0.431013  0.761388  0.551341  1
  Cu  Cu81  1  0.030384  0.885568  0.555039  1
  Cu  Cu82  1  0.781792  0.382621  0.568766  1
  Cu  Cu83  1  0.629501  0.009777  0.558547  1
  Cu  Cu84  1  0.381518  0.506973  0.572219  1
  Cu  Cu85  1  0.906027  0.134020  0.561955  1
  Cu  Cu86  1  0.657773  0.631281  0.575642  1
  Cu  Cu87  1  0.182252  0.258322  0.565363  1
  Cu  Cu88  1  0.933815  0.755630  0.579226  1
  Cu  Cu89  1  0.533161  0.879837  0.582915  1
  Cu  Cu90  1  0.284650  0.376805  0.596599  1
  Cu  Cu91  1  0.132032  0.003924  0.586430  1
  Cu  Cu92  1  0.884442  0.501090  0.600022  1
  Cu  Cu93  1  0.408753  0.128192  0.589794  1
  Cu  Cu94  1  0.160633  0.625539  0.603493  1
  Cu  Cu95  1  0.685111  0.252463  0.593202  1
  Cu  Cu96  1  0.436619  0.749864  0.606970  1
  Cu  Cu97  1  0.035877  0.873959  0.610924  1
  Cu  Cu98  1  0.787407  0.370926  0.624465  1
  Cu  Cu99  1  0.634524  0.998132  0.614358  1
  Cu  Cu100  1  0.387089  0.495356  0.627948  1
  Cu  Cu101  1  0.911552  0.122307  0.617701  1
  Cu  Cu102  1  0.663762  0.619545  0.631269  1
  Cu  Cu103  1  0.188003  0.246598  0.621108  1
  Cu  Cu104  1  0.939161  0.744148  0.634933  1
  Cu  Cu105  1  0.538564  0.868340  0.638722  1
  Cu  Cu106  1  0.290390  0.365032  0.652134  1
  Cu  Cu107  1  0.136567  0.992231  0.642143  1
  Cu  Cu108  1  0.889784  0.489325  0.655585  1
  Cu  Cu109  1  0.414207  0.116544  0.645400  1
  Cu  Cu110  1  0.165815  0.614209  0.659034  1
  Cu  Cu111  1  0.691444  0.240772  0.648808  1
  Cu  Cu112  1  0.442889  0.738116  0.662167  1
  Cu  Cu113  1  0.041991  0.862019  0.666725  1
  Cu  Cu114  1  0.793308  0.359174  0.679818  1
  Cu  Cu115  1  0.637195  0.986614  0.669878  1
  Cu  Cu116  1  0.389485  0.483371  0.683282  1
  Cu  Cu117  1  0.917078  0.110823  0.673106  1
  Cu  Cu118  1  0.669081  0.607455  0.686452  1
  Cu  Cu119  1  0.196830  0.234993  0.676562  1
  Cu  Cu120  1  0.944189  0.733032  0.690250  1
  Cu  Cu121  1  0.542576  0.857053  0.693809  1
  Cu  Cu122  1  0.296185  0.353609  0.706686  1
  Cu  Cu123  1  0.138376  0.981182  0.696798  1
  Cu  Cu124  1  0.890502  0.477527  0.710142  1
  Cu  Cu125  1  0.419861  0.105271  0.699980  1
  Cu  Cu126  1  0.169446  0.601419  0.713299  1
  Cu  Cu127  1  0.700717  0.229392  0.703383  1
  Cu  Cu128  1  0.444893  0.724652  0.715834  1
