# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.09469654
_cell_length_b   8.83093117
_cell_length_c   47.85402375
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu66
_cell_volume   1686.58597612
_cell_formula_units_Z   66
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  0.623145  0.877022  0.276664  1
  Cu  Cu2  1  0.762201  0.182565  0.290093  1
  Cu  Cu3  1  0.893842  0.491347  0.303757  1
  Cu  Cu4  1  0.044596  0.716610  0.271827  1
  Cu  Cu5  1  0.192496  0.026749  0.283664  1
  Cu  Cu6  1  0.329863  0.338541  0.296200  1
  Cu  Cu7  1  0.017708  0.812121  0.318636  1
  Cu  Cu8  1  0.143529  0.124538  0.331477  1
  Cu  Cu9  1  0.270635  0.435965  0.344578  1
  Cu  Cu10  1  0.461668  0.651288  0.308548  1
  Cu  Cu11  1  0.580994  0.968430  0.324702  1
  Cu  Cu12  1  0.705778  0.278806  0.338402  1
  Cu  Cu13  1  0.396070  0.746690  0.358277  1
  Cu  Cu14  1  0.516928  0.062166  0.373273  1
  Cu  Cu15  1  0.640853  0.374675  0.387017  1
  Cu  Cu16  1  0.831592  0.590552  0.351898  1
  Cu  Cu17  1  0.955082  0.905765  0.366605  1
  Cu  Cu18  1  0.079158  0.218973  0.380079  1
  Cu  Cu19  1  0.765680  0.686202  0.400800  1
  Cu  Cu20  1  0.889764  1.000234  0.415069  1
  Cu  Cu21  1  0.013427  0.313291  0.428816  1
  Cu  Cu22  1  0.203780  0.530641  0.393632  1
  Cu  Cu23  1  0.328770  0.842560  0.407580  1
  Cu  Cu24  1  0.451538  0.156807  0.421920  1
  Cu  Cu25  1  0.137745  0.625496  0.442610  1
  Cu  Cu26  1  0.262283  0.938006  0.456555  1
  Cu  Cu27  1  0.385668  0.251335  0.470651  1
  Cu  Cu28  1  0.575208  0.469369  0.435804  1
  Cu  Cu29  1  0.699798  0.781599  0.449676  1
  Cu  Cu30  1  0.823833  0.094856  0.463727  1
  Cu  Cu31  1  0.509348  0.564239  0.484626  1
  Cu  Cu32  1  0.633747  0.876739  0.498545  1
  Cu  Cu33  1  0.757896  0.189483  0.512469  1
  Cu  Cu34  1  0.947562  0.407794  0.477581  1
  Cu  Cu35  1  0.071712  0.720538  0.491505  1
  Cu  Cu36  1  0.196110  0.033038  0.505425  1
  Cu  Cu37  1  0.881626  0.502422  0.526323  1
  Cu  Cu38  1  0.005661  0.815678  0.540374  1
  Cu  Cu39  1  0.130251  0.127908  0.554246  1
  Cu  Cu40  1  0.319791  0.345942  0.519400  1
  Cu  Cu41  1  0.443176  0.659271  0.533496  1
  Cu  Cu42  1  0.567713  0.971782  0.547440  1
  Cu  Cu43  1  0.253920  0.440470  0.568130  1
  Cu  Cu44  1  0.376688  0.754717  0.582471  1
  Cu  Cu45  1  0.501679  0.066637  0.596419  1
  Cu  Cu46  1  0.692031  0.283986  0.561234  1
  Cu  Cu47  1  0.815694  0.597044  0.574982  1
  Cu  Cu48  1  0.939779  0.911076  0.589250  1
  Cu  Cu49  1  0.626301  0.378304  0.609971  1
  Cu  Cu50  1  0.750376  0.691512  0.623445  1
  Cu  Cu51  1  0.873866  1.006725  0.638152  1
  Cu  Cu52  1  0.064605  0.222602  0.603033  1
  Cu  Cu53  1  0.188531  0.535112  0.616777  1
  Cu  Cu54  1  0.309388  0.850588  0.631773  1
  Cu  Cu55  1  0.999680  0.318471  0.651648  1
  Cu  Cu56  1  0.124465  0.628847  0.665349  1
  Cu  Cu57  1  0.243790  0.945989  0.681502  1
  Cu  Cu58  1  0.434823  0.161312  0.645473  1
  Cu  Cu59  1  0.561929  0.472739  0.658573  1
  Cu  Cu60  1  0.687750  0.785156  0.671414  1
  Cu  Cu61  1  0.375595  0.258737  0.693850  1
  Cu  Cu62  1  0.512963  0.570529  0.706386  1
  Cu  Cu63  1  0.660862  0.880668  0.718223  1
  Cu  Cu64  1  0.811617  0.105931  0.686293  1
  Cu  Cu65  1  0.943258  0.414712  0.699957  1
  Cu  Cu66  1  0.082313  0.720256  0.713387  1
