# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.53596363
_cell_length_b   10.66382311
_cell_length_c   46.96614714
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.84360324
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu48
_cell_volume   1261.05930938
_cell_formula_units_Z   48
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  0.046624  0.585294  0.295903  1
  Cu  Cu2  1  0.330814  0.153791  0.278403  1
  Cu  Cu3  1  0.645822  0.783402  0.310133  1
  Cu  Cu4  1  0.928967  0.349778  0.292404  1
  Cu  Cu5  1  0.482243  0.456519  0.332490  1
  Cu  Cu6  1  0.763673  0.019686  0.313438  1
  Cu  Cu7  1  0.080992  0.653828  0.347109  1
  Cu  Cu8  1  0.362937  0.217840  0.329001  1
  Cu  Cu9  1  0.917043  0.326172  0.369235  1
  Cu  Cu10  1  0.199355  0.890844  0.350560  1
  Cu  Cu11  1  0.515785  0.523469  0.384384  1
  Cu  Cu12  1  0.797642  0.087220  0.365659  1
  Cu  Cu13  1  0.352014  0.196143  0.406195  1
  Cu  Cu14  1  0.634676  0.761449  0.387626  1
  Cu  Cu15  1  0.950605  0.393141  0.421490  1
  Cu  Cu16  1  0.233024  0.957974  0.402898  1
  Cu  Cu17  1  0.787274  0.066673  0.443363  1
  Cu  Cu18  1  0.069815  0.631734  0.424815  1
  Cu  Cu19  1  0.385702  0.263352  0.458610  1
  Cu  Cu20  1  0.668196  0.828329  0.440054  1
  Cu  Cu21  1  0.222423  0.936982  0.480503  1
  Cu  Cu22  1  0.504858  0.501840  0.461925  1
  Cu  Cu23  1  0.820848  0.133660  0.495764  1
  Cu  Cu24  1  0.103290  0.698533  0.477193  1
  Cu  Cu25  1  0.657523  0.807197  0.517629  1
  Cu  Cu26  1  0.939964  0.372070  0.499058  1
  Cu  Cu27  1  0.255954  0.003891  0.532897  1
  Cu  Cu28  1  0.538390  0.568749  0.514319  1
  Cu  Cu29  1  0.092616  0.677402  0.554768  1
  Cu  Cu30  1  0.375110  0.242378  0.536212  1
  Cu  Cu31  1  0.690997  0.873997  0.570007  1
  Cu  Cu32  1  0.973538  0.439057  0.551459  1
  Cu  Cu33  1  0.527788  0.547756  0.591924  1
  Cu  Cu34  1  0.810208  0.112590  0.573332  1
  Cu  Cu35  1  0.126136  0.744281  0.607196  1
  Cu  Cu36  1  0.408798  0.309588  0.588627  1
  Cu  Cu37  1  0.963170  0.418510  0.629163  1
  Cu  Cu38  1  0.245027  0.982261  0.610438  1
  Cu  Cu39  1  0.561457  0.614886  0.644262  1
  Cu  Cu40  1  0.843769  0.179559  0.625587  1
  Cu  Cu41  1  0.397876  0.287890  0.665822  1
  Cu  Cu42  1  0.679820  0.851902  0.647713  1
  Cu  Cu43  1  0.997139  0.486044  0.681384  1
  Cu  Cu44  1  0.278569  0.049211  0.662332  1
  Cu  Cu45  1  0.831845  0.155952  0.702418  1
  Cu  Cu46  1  0.114990  0.722328  0.684689  1
  Cu  Cu47  1  0.429998  0.351940  0.716420  1
  Cu  Cu48  1  0.714188  0.920437  0.698919  1
